data_2k07_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 2k07 _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 ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.833 0.349 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.458 ' O ' HG21 ' A' ' 10' ' ' VAL . 11.0 m -59.57 -47.41 85.68 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.597 178.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 -67.08 -29.59 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.013 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -60.63 -50.79 72.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.95 0.405 . . . . 0.0 110.067 175.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.37 -42.5 95.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.88 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.499 HG23 HD22 ' A' ' 140' ' ' LEU . 64.7 t -62.52 -32.35 55.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.911 0.386 . . . . 0.0 110.589 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.4 t -69.54 -21.89 63.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.695 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.07 -3.31 54.4 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.06 0.457 . . . . 0.0 110.129 177.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.424 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 42.6 mt -108.35 88.46 4.97 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.57 175.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 10.3 Cg_endo -49.1 147.89 10.43 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 123.588 2.859 . . . . 0.0 113.318 -173.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.511 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 29.5 m -79.17 142.36 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.503 178.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.591 HD21 ' HG2' ' A' ' 31' ' ' ARG . 7.3 mp -81.33 134.16 35.53 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.23 -4.43 20.19 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.748 -173.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.1 m -87.55 -53.98 4.51 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 173.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.8 t30 46.25 81.13 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.52 0 O-C-N 124.037 0.836 . . . . 0.0 112.276 175.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.71 165.43 23.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.946 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -100.67 177.97 28.41 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.938 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.45 5.76 2.21 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 123.399 2.733 . . . . 0.0 113.238 -176.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.522 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 3.4 mmp_? -84.14 -48.0 10.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.828 0.347 . . . . 0.0 110.86 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -91.66 92.59 8.52 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 176.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.546 ' O ' HG21 ' A' ' 29' ' ' VAL . 61.4 mtt85 -59.9 -31.26 69.65 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -175.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.26 -52.16 60.03 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.603 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 12.3 mt -72.82 -28.57 62.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.716 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.508 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 67.9 t-105 -60.87 -49.54 77.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.463 175.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.546 HG21 ' O ' ' A' ' 25' ' ' ARG . 86.4 t -61.55 -30.5 48.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.927 178.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.435 ' O ' ' HG3' ' A' ' 34' ' ' GLU . 11.2 mt-30 -68.85 -49.94 54.11 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.84 0.352 . . . . 0.0 110.568 175.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.591 ' HG2' HD21 ' A' ' 16' ' ' LEU . 16.3 ttp180 -63.36 -32.16 73.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.063 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.415 HD21 ' HA ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -59.47 -48.47 81.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.683 -179.405 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.5 ptpp? -72.16 -34.89 68.83 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.248 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 30' ' ' GLN . 49.3 mt-10 -60.02 -46.92 87.92 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.718 0.77 . . . . 0.0 109.485 174.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -67.02 -42.45 84.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.614 -1.176 . . . . 0.0 111.028 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.24 -45.1 95.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.946 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -60.77 -39.2 87.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.955 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.4 m -62.89 -39.29 94.04 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.348 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.408 ' O ' HG23 ' A' ' 43' ' ' VAL . 96.1 mt -65.34 -47.78 75.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.584 177.546 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.63 -43.32 98.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.681 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.4 tpp180 -56.2 -47.19 78.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.737 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.457 ' CD2' ' HE3' ' A' ' 138' ' ' MET . 43.1 t80 -65.06 -45.58 84.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.724 -178.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.696 HG22 HH21 ' A' ' 55' ' ' ARG . 98.2 t -63.01 -45.16 99.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.107 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -59.94 -50.4 73.92 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.555 0.693 . . . . 0.0 110.137 177.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -53.64 -40.94 66.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.54 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.65 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 91.8 m-20 -68.49 -44.53 74.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.175 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -62.99 -31.9 73.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.284 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -64.24 -36.1 82.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 0.0 110.199 176.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.17 0.43 40.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.859 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.9 t70 74.02 12.12 4.29 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.291 177.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.65 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 5.3 t30 -119.82 92.78 3.87 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.12 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.89 146.86 35.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.692 0.282 . . . . 0.0 110.703 -176.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.776 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -104.94 -68.69 0.84 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -171.556 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.776 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 26.5 p90 -160.65 165.91 29.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.733 0.777 . . . . 0.0 112.923 -165.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.696 HH21 HG22 ' A' ' 43' ' ' VAL . 2.4 mmp_? -131.44 121.84 25.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.641 -1.163 . . . . 0.0 108.898 166.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.478 HD21 HD13 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -134.11 125.32 27.73 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 -177.004 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -131.93 168.77 17.31 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.844 0.354 . . . . 0.0 110.321 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.469 ' OG ' ' HA2' ' A' ' 62' ' ' GLY . 6.3 t -130.48 178.2 6.79 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.31 -0.404 . . . . 0.0 109.948 -175.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -84.43 -177.98 6.78 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.4 ptpp? -60.66 -28.43 68.58 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -93.59 -10.9 33.12 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.592 0.234 . . . . 0.0 111.092 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.469 ' HA2' ' OG ' ' A' ' 58' ' ' SER . . . 71.48 13.31 74.1 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.913 -0.66 . . . . 0.0 113.047 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.8 p -80.64 -15.92 55.36 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -174.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.489 ' HA ' ' HA ' ' A' ' 85' ' ' ASP . 32.1 ttm180 -143.65 122.1 12.41 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 55.3 m95 -103.12 139.03 39.16 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.361 -178.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 p90 -146.0 146.43 30.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.93 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.54 -153.51 21.94 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.836 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.613 ' HG3' ' HZ3' ' A' ' 70' ' ' TRP . 5.5 ptpp? -151.23 143.81 24.31 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.098 0.475 . . . . 0.0 110.987 -178.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 15.9 p -122.79 141.23 52.05 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.561 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.637 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 2.9 p90 -122.7 137.06 55.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.462 0.649 . . . . 0.0 110.877 -178.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -117.89 123.27 45.44 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.708 -176.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 34.7 mm -87.59 126.71 41.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.117 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -140.59 124.76 17.51 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 176.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.443 ' C ' HD22 ' A' ' 75' ' ' LEU . 39.1 t70 68.3 -85.95 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.93 0.769 . . . . 0.0 110.422 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.443 HD22 ' C ' ' A' ' 74' ' ' ASP . 2.2 mm? -142.03 5.62 1.72 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 175.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 82.0 mt -111.47 153.67 25.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.898 0.38 . . . . 0.0 111.116 -172.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -116.68 129.01 55.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.958 176.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -115.74 101.21 8.62 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.837 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.637 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 1.1 pm0 -96.2 135.76 37.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.092 0.473 . . . . 0.0 110.926 177.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -124.75 138.76 54.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.919 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -93.93 124.58 38.03 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.478 HD13 HD21 ' A' ' 56' ' ' LEU . 39.5 pt -130.8 160.32 42.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.927 0.394 . . . . 0.0 111.608 -173.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -154.14 153.39 31.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.398 177.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -172.55 162.31 5.16 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.489 ' HA ' ' HA ' ' A' ' 64' ' ' ARG . 5.6 p-10 -115.64 176.1 5.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.625 0.25 . . . . 0.0 110.504 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.6 mm -114.34 89.05 16.62 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.227 -175.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.05 165.4 12.41 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.596 2.197 . . . . 0.0 112.122 177.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 55.6 mt -64.32 -21.84 29.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.256 0.551 . . . . 0.0 110.974 -178.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.16 -20.11 64.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.293 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.683 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 49.6 t80 -88.31 144.51 34.18 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.683 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.2 Cg_endo -95.5 17.67 36.31 Favored 'Cis proline' 0 N--CA 1.459 -0.531 0 C-N-CA 124.495 -1.044 . . . . 0.0 113.822 3.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 10.3 m -65.24 -38.45 90.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.51 0.671 . . . . 0.0 110.186 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -129.18 141.73 51.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.612 175.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.44 144.48 91.78 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.636 -0.257 . . . . 0.0 111.256 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.415 ' HD3' ' CD1' ' A' ' 90' ' ' TYR . 95.2 Cg_endo -92.98 -171.9 0.33 Allowed 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.159 2.572 . . . . 0.0 112.39 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -106.71 123.21 47.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.392 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.86 126.22 41.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.572 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -92.24 117.64 30.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.116 -178.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 25.6 t -119.96 87.24 38.19 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.439 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -68.74 -6.5 18.1 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.867 2.378 . . . . 0.0 113.008 -176.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -78.87 -43.25 25.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.046 0.45 . . . . 0.0 110.53 178.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.788 HD21 ' HG ' ' A' ' 153' ' ' LEU . 86.7 mt -86.76 -35.11 19.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.977 -175.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.0 128.67 38.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.364 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 95.86 -29.36 10.0 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.147 -177.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -92.34 4.59 53.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.914 0.388 . . . . 0.0 111.392 -177.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.9 t . . . . . 0 C--N 1.321 -0.661 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 175.567 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . 0.572 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . . . . . . 0 N--CA 1.448 -0.562 0 CA-C-O 120.246 -0.197 . . . . 0.0 113.079 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -96.51 131.19 43.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.941 0.401 . . . . 0.0 111.652 -173.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 33.3 pt -75.86 170.75 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.688 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 35.1 m -111.14 93.7 4.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.13 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 93.5 mt -74.28 157.32 36.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.722 0.296 . . . . 0.0 110.859 179.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.419 HG23 ' HB2' ' A' ' 121' ' ' PHE . 2.6 t -72.37 151.97 42.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.029 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -67.06 -25.38 66.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.601 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -78.56 -20.03 51.51 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.428 -176.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.419 ' HB2' HG23 ' A' ' 118' ' ' THR . 56.3 t80 -71.44 -34.43 70.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.953 -177.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.58 -53.53 63.63 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.009 -176.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.441 ' O ' ' HG3' ' A' ' 127' ' ' ARG . 37.0 Cg_endo -67.47 -34.17 27.07 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.529 1.486 . . . . 0.0 112.227 175.753 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.3 tp -60.35 -45.56 93.06 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.859 0.362 . . . . 0.0 110.462 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.529 ' O ' HG23 ' A' ' 129' ' ' VAL . 41.6 t-105 -59.91 -54.88 40.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.143 177.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.95 -34.68 68.26 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.413 -175.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 123' ' ' PRO . 97.0 mtt180 -69.15 -30.12 68.29 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -178.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -95.62 -21.8 18.0 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -172.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 125' ' ' TRP . 89.3 t -46.22 129.96 7.58 Favored Pre-proline 0 N--CA 1.473 0.678 0 O-C-N 123.446 0.466 . . . . 0.0 111.542 -178.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.473 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 72.0 Cg_endo -96.72 -120.08 0.0 OUTLIER 'Cis proline' 0 CA--C 1.536 0.59 0 C-N-CA 124.016 -1.243 . . . . 0.0 113.156 2.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.511 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 64.8 mttm 67.42 22.37 9.41 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.331 175.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -91.84 -178.95 5.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.587 0.708 . . . . 0.0 112.151 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -178.31 157.71 21.87 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.393 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.6 tp -54.19 -40.24 67.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.792 0.296 . . . . 0.0 111.618 -177.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.43 -38.26 74.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.061 0.458 . . . . 0.0 111.015 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -71.87 -45.85 59.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.161 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.3 tp -59.19 -46.81 87.43 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.343 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' MET . . . . . 0.519 ' HE1' ' HB3' ' A' ' 138' ' ' MET . 7.8 tmm? -62.38 -47.69 83.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.215 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.75 -38.79 73.51 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -176.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.499 HD22 HG23 ' A' ' 10' ' ' VAL . 95.9 mt -86.87 -17.95 32.09 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -175.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -112.55 -66.63 0.5 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.296 -0.954 . . . . 0.0 113.041 -177.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.589 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 54.9 tp -66.45 -42.85 87.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.664 0.269 . . . . 0.0 111.031 -175.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -51.75 -61.94 6.0 Favored Glycine 0 CA--C 1.523 0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.63 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . 0.476 ' O ' HG21 ' A' ' 148' ' ' VAL . 33.9 Cg_endo -65.63 -31.86 49.05 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.314 2.009 . . . . 0.0 112.702 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 33.5 t90 -64.5 -33.74 76.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.694 0.283 . . . . 0.0 111.0 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 90.4 mt -58.55 -40.65 83.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.953 0.406 . . . . 0.0 110.167 177.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.0 -2.12 29.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.306 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . 0.476 HG21 ' O ' ' A' ' 144' ' ' PRO . 90.8 t -104.85 -55.19 5.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.529 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -95.74 -32.48 12.71 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -173.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.604 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 40.2 mm -56.45 -41.19 89.88 Favored Pre-proline 0 CA--C 1.54 0.565 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -176.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.604 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 1.2 Cg_endo -46.18 -40.56 21.59 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 122.395 2.063 . . . . 0.0 112.792 171.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -61.93 -49.31 76.65 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.041 0.448 . . . . 0.0 110.097 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.788 ' HG ' HD21 ' A' ' 102' ' ' LEU . 3.7 mm? -60.52 -42.81 97.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.086 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.94 -53.3 31.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.038 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -65.31 -36.34 83.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.389 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . 0.541 ' HZ1' ' HB3' ' A' ' 156' ' ' LYS . 5.8 ttpm? -70.99 -16.53 62.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.986 0.422 . . . . 0.0 110.42 -178.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.71 17.69 63.19 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.333 172.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 29.1 m -87.54 -19.99 7.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.861 0.331 . . . . 0.0 110.969 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.508 HG13 ' HB3' ' A' ' 153' ' ' LEU . 44.5 mt . . . . . 0 C--N 1.328 -0.363 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.483 ' O ' HG22 ' A' ' 9' ' ' VAL . . . . . . . . 0 CA--C 1.525 0.009 0 CA-C-O 120.859 0.362 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.2 m -61.12 -42.63 98.88 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.517 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -64.41 -38.35 90.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.442 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -62.97 -40.37 97.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.06 178.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 5' ' ' ALA . 96.3 t -58.53 -47.36 88.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 120.93 0.395 . . . . 0.0 110.448 178.012 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.2 t -67.17 -25.72 34.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.868 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.6 m -81.71 -40.71 22.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.375 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.479 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 34.9 mt-10 -79.1 -12.21 60.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.655 0.264 . . . . 0.0 111.372 -179.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.7 mt -105.35 89.76 3.44 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 172.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.479 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 87.8 Cg_exo -45.52 151.2 1.15 Allowed 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 124.058 3.172 . . . . 0.0 114.25 -172.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.581 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 20.0 m -86.05 145.21 8.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.716 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.733 HD22 ' HG2' ' A' ' 35' ' ' GLU . 8.2 mp -85.11 134.58 34.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.893 -178.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -82.07 -32.87 30.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.721 0.772 . . . . 0.0 109.545 174.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.473 HG21 HD12 ' A' ' 27' ' ' LEU . 25.4 m -85.03 135.21 34.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.427 -175.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -135.24 93.23 2.96 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.388 178.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -162.42 161.38 27.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.516 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -103.77 -176.61 25.85 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.397 -179.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.51 -6.54 13.86 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 123.454 2.769 . . . . 0.0 113.051 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.414 ' HG3' HG22 ' A' ' 88' ' ' ILE . 45.7 mtp180 -71.31 -24.63 62.16 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.566 0.222 . . . . 0.0 111.239 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -113.83 96.42 5.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.514 ' O ' HG22 ' A' ' 29' ' ' VAL . 87.6 mtm180 -64.44 -32.95 74.78 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -173.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -68.41 -45.53 72.39 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.418 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.473 HD12 HG21 ' A' ' 18' ' ' THR . 4.5 mm? -71.7 -26.95 62.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.208 0.528 . . . . 0.0 110.203 174.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.411 ' HH2' HG23 ' A' ' 86' ' ' ILE . 63.7 t-105 -64.1 -41.84 97.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.297 178.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 25' ' ' ARG . 96.5 t -60.08 -37.84 74.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.158 0.504 . . . . 0.0 110.174 175.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.45 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 38.7 mt-30 -67.07 -43.49 82.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.14 178.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.459 HH11 ' HG3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -62.41 -30.51 71.27 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.35 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 2.1 mm? -65.29 -49.45 69.48 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.225 177.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.431 ' HG2' ' HA ' ' A' ' 30' ' ' GLN . 19.7 ptpt -66.37 -38.59 87.92 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 120.826 -0.349 . . . . 0.0 110.961 -178.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.5 ' HB3' ' HG ' ' A' ' 16' ' ' LEU . 26.4 mm-40 -61.88 -51.1 69.57 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.973 0.416 . . . . 0.0 110.392 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.733 ' HG2' HD22 ' A' ' 16' ' ' LEU . 6.0 mm-40 -63.36 -42.06 98.85 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.578 177.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.49 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -58.85 -45.02 91.06 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.281 -178.241 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.42 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 84.3 mm-40 -58.99 -43.09 91.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.027 0.442 . . . . 0.0 110.438 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.436 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 18.0 m -66.54 -40.58 89.16 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.763 177.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 35' ' ' GLU . 95.9 mt -62.95 -49.01 76.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.014 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.444 HG13 ' O ' ' A' ' 36' ' ' TYR . 85.8 mt -55.59 -47.44 78.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 O-C-N 123.163 0.289 . . . . 0.0 110.582 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -61.52 -41.07 96.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.375 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.486 ' HE2' ' HZ ' ' A' ' 54' ' ' PHE . 80.0 t80 -72.1 -46.21 57.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.22 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.435 ' O ' ' HG3' ' A' ' 47' ' ' LYS . 85.3 t -62.91 -37.34 78.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.068 0.461 . . . . 0.0 110.295 179.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.7 -50.56 70.65 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 175.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -53.72 -48.66 69.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.52 177.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -62.49 -39.36 93.21 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -178.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 32.2 mtmm -68.88 -37.28 78.93 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.312 177.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -66.5 -34.91 78.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.713 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -85.86 -1.61 57.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.256 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.9 t70 61.62 29.68 18.3 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.667 0.746 . . . . 0.0 110.48 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -122.9 55.1 1.2 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.575 -175.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -93.7 106.59 18.55 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 65.0 p-90 -125.5 5.16 7.6 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -174.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.486 ' HZ ' ' HE2' ' A' ' 42' ' ' TYR . 19.7 p90 -154.64 147.0 23.91 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.077 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.524 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 23.0 tpt180 -126.57 123.32 37.42 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.575 178.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.1 mt -121.52 124.6 44.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.002 0.43 . . . . 0.0 110.112 175.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -134.78 152.37 51.7 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.178 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.6 m -126.23 159.35 33.27 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 120.771 0.32 . . . . 0.0 111.553 -171.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -75.74 173.2 11.41 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -69.14 -12.73 61.94 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -170.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -85.35 -25.53 27.04 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.831 0.348 . . . . 0.0 110.373 175.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.39 17.74 77.85 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.984 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.9 p -83.73 -30.28 26.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.953 0.406 . . . . 0.0 111.757 -177.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 50.3 mtp180 -128.72 128.32 43.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.239 179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -110.91 126.43 54.71 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.436 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.427 ' HA ' ' HA ' ' A' ' 83' ' ' GLU . 39.7 p90 -136.46 167.05 22.08 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.524 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 168.33 -138.77 5.31 Favored Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.011 -1.09 . . . . 0.0 112.544 178.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.498 ' HA ' ' HA ' ' A' ' 81' ' ' ASP . 20.7 ttmm -153.03 134.73 14.53 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -172.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 64.5 m -119.67 122.66 42.0 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 174.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.572 ' HB3' ' HG2' ' A' ' 79' ' ' GLU . 41.5 p90 -124.43 129.98 51.65 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.284 0.564 . . . . 0.0 110.399 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -121.01 133.96 55.28 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 -179.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 43.3 mm -96.9 121.47 47.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.411 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -147.15 116.87 7.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.035 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 57.24 58.4 3.93 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.918 0.761 . . . . 0.0 111.224 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.1 mt 72.65 -38.64 0.42 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.385 0.674 . . . . 0.0 112.641 175.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.35 137.14 55.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.318 0.58 . . . . 0.0 112.068 -175.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -108.55 102.37 11.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.667 175.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 17.8 p90 -104.6 119.71 39.62 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.185 0.517 . . . . 0.0 110.6 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.572 ' HG2' ' HB3' ' A' ' 70' ' ' TRP . 57.4 mt-10 -105.77 136.44 45.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.328 -178.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -121.25 112.57 18.79 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.498 ' HA ' ' HA ' ' A' ' 68' ' ' LYS . 2.3 m-20 -83.34 112.97 20.39 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 38.2 pt -114.62 173.76 3.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.266 -173.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 66' ' ' PHE . 10.0 pt-20 -162.44 157.71 22.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.785 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.554 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 36.0 p90 -160.91 148.15 15.43 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.084 0.469 . . . . 0.0 111.077 176.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -93.34 164.0 13.38 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.831 177.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.412 ' HA ' ' HD2' ' A' ' 87' ' ' PRO . 39.7 mm -107.45 91.98 7.75 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.631 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 1.3 Cg_endo -40.79 148.22 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 124.181 3.254 . . . . 0.0 113.807 -178.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.414 HG22 ' HG3' ' A' ' 23' ' ' ARG . 50.2 mm -58.52 -39.42 75.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.957 -174.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.3 p -83.19 40.5 0.71 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.213 0.53 . . . . 0.0 112.064 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.558 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 25.0 t80 -77.76 147.65 74.75 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.483 177.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.558 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 19.9 Cg_endo -94.76 13.35 44.72 Favored 'Cis proline' 0 N--CA 1.453 -0.856 0 C-N-CA 124.513 -1.036 . . . . 0.0 112.883 -2.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 22.5 m -62.28 -35.84 80.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.33 0.586 . . . . 0.0 110.191 178.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.6 m -105.77 119.66 39.71 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.641 173.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -81.41 152.05 69.79 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.528 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.54 ' HG2' HD13 ' A' ' 134' ' ' LEU . 50.9 Cg_exo -55.31 136.47 73.66 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.891 2.394 . . . . 0.0 112.163 174.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.478 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 19.9 mt-10 -79.74 -22.68 42.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.201 -173.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.554 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 62.8 mt 65.95 116.24 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-O 121.363 0.601 . . . . 0.0 111.665 -178.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.693 ' HB1' ' HG2' ' A' ' 114' ' ' LYS . . . -119.62 138.38 53.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.357 0.599 . . . . 0.0 111.84 -177.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 16.7 t -124.43 86.18 55.26 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.713 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.91 -21.71 65.6 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.333 2.689 . . . . 0.0 114.138 -172.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.65 -29.81 56.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.208 0.528 . . . . 0.0 110.375 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.468 HD21 ' HD2' ' A' ' 105' ' ' LYS . 75.2 mt -89.92 4.05 51.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.309 -176.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -62.26 110.57 1.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 87.02 -2.55 87.08 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.26 -178.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.551 ' HZ2' ' HB2' ' A' ' 105' ' ' LYS . 4.2 ttmp? -101.9 -5.87 24.2 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 121.433 0.635 . . . . 0.0 110.045 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 t . . . . . 0 C--N 1.324 -0.521 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.648 177.941 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.197 0 N-CA-C 112.229 -0.348 . . . . 0.0 112.229 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.693 ' HG2' ' HB1' ' A' ' 98' ' ' ALA . 95.0 mttt -91.8 137.54 32.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 176.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.5 pt -82.13 167.55 2.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.376 0.607 . . . . 0.0 112.32 -168.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 17.6 p -114.27 116.71 29.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.054 176.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.8 mt -85.7 -175.14 5.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.183 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 31.5 m -59.86 131.93 52.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.092 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -63.57 -32.33 73.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.82 -177.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -75.18 -22.11 58.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.09 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -71.5 -33.57 69.36 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.35 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.414 ' HB3' ' CD ' ' A' ' 123' ' ' PRO . 28.1 ttpp -55.69 -56.75 26.46 Favored Pre-proline 0 CA--C 1.542 0.647 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.975 -178.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.414 ' CD ' ' HB3' ' A' ' 122' ' ' LYS . 36.3 Cg_endo -67.28 -31.28 35.75 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.589 1.526 . . . . 0.0 112.104 175.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 54.5 tp -61.33 -44.8 96.59 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.414 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.54 ' O ' HG23 ' A' ' 129' ' ' VAL . 49.9 t-105 -59.84 -54.61 44.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.309 178.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.12 -16.13 63.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.968 -176.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -86.35 -21.6 27.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.958 0.408 . . . . 0.0 110.591 178.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -110.11 25.61 11.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.972 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 125' ' ' TRP . 87.2 t -102.13 135.23 19.69 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.641 174.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.488 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 88.3 Cg_endo -89.05 -153.33 0.64 Allowed 'Cis proline' 0 N--CA 1.462 -0.344 0 C-N-CA 124.085 -1.215 . . . . 0.0 112.851 1.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.581 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 53.5 mtmt 76.28 7.1 3.54 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.836 0.855 . . . . 0.0 111.759 -176.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.2 171.25 7.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 173.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -169.94 176.02 43.85 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.43 -0.89 . . . . 0.0 112.244 -174.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.54 HD13 ' HG2' ' A' ' 95' ' ' PRO . 60.9 tp -61.97 -37.09 83.46 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 122.784 0.433 . . . . 0.0 111.49 -174.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.683 ' HA ' ' HE3' ' A' ' 138' ' ' MET . . . -57.54 -39.58 76.93 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.403 0.62 . . . . 0.0 110.591 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -69.93 -36.1 75.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.065 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.493 HD23 ' HD2' ' A' ' 95' ' ' PRO . 57.3 tp -66.42 -53.49 35.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.414 -179.087 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' MET . . . . . 0.683 ' HE3' ' HA ' ' A' ' 135' ' ' ALA . 26.2 ptt? -62.18 -35.64 79.44 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.522 -175.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.34 -41.76 69.4 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.7 mt -95.61 -12.12 26.15 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -172.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -112.91 -53.9 0.47 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.155 -1.022 . . . . 0.0 113.739 -175.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.491 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 52.0 tp -64.36 -42.54 96.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.715 0.258 . . . . 0.0 111.479 -173.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.05 -61.69 7.22 Favored Glycine 0 CA--C 1.522 0.471 0 C-N-CA 121.244 -0.503 . . . . 0.0 113.068 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -58.38 -29.01 86.92 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.733 2.288 . . . . 0.0 113.081 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -66.87 -37.46 84.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.744 0.307 . . . . 0.0 110.818 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 91.8 mt -55.21 -38.13 68.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.316 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.57 -6.11 46.66 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 57.5 t -82.14 -40.1 17.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.734 0.302 . . . . 0.0 111.584 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -125.01 -39.78 2.22 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -173.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.468 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 48.2 mm -55.02 -52.56 70.0 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -169.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.468 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.6 Cg_endo -54.27 -33.86 77.38 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.102 1.868 . . . . 0.0 112.921 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.485 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 20.7 t70 -87.14 -29.67 21.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.9 0.381 . . . . 0.0 110.371 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.622 ' HA ' ' HE2' ' A' ' 156' ' ' LYS . 24.2 tp -56.96 -39.65 74.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.589 179.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 60.4 mt -64.18 -40.32 88.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.361 176.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -66.93 -34.62 78.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.223 -178.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 153' ' ' LEU . 54.4 mttm -55.6 -30.76 61.45 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.087 0.47 . . . . 0.0 110.962 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.88 13.64 71.69 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.688 -0.768 . . . . 0.0 111.756 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 28.7 m -79.7 -17.12 12.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.136 0.494 . . . . 0.0 110.78 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 61.8 mt . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.007 178.343 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.407 ' O ' HG22 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 121.106 0.479 . . . . 0.0 109.856 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 25.0 m -66.94 -43.5 83.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.42 177.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.08 -49.19 78.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.696 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.441 ' HG3' ' N ' ' A' ' 9' ' ' VAL . 12.4 ptm180 -65.44 -45.3 84.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.437 -175.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.441 ' N ' ' HG3' ' A' ' 8' ' ' ARG . 88.4 t -61.73 -43.65 97.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 C-N-CA 121.124 -0.231 . . . . 0.0 111.047 -177.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.7 t -63.96 -31.35 52.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.915 0.388 . . . . 0.0 110.696 178.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.1 m -83.18 -17.33 43.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.257 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -93.08 -4.3 52.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.328 0.585 . . . . 0.0 110.095 175.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.1 mt -116.63 89.07 26.82 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.619 176.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -40.67 139.52 1.24 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.058 3.172 . . . . 0.0 113.687 -176.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.58 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.5 m -81.23 151.46 4.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.325 -177.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.6 mp -83.98 169.53 14.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.436 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.401 ' N ' ' HD2' ' A' ' 17' ' ' LYS . 2.6 mptp? -122.64 -48.39 2.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.959 0.409 . . . . 0.0 110.235 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.8 m -84.32 95.54 8.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.407 0.623 . . . . 0.0 110.957 -177.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -89.22 79.46 7.11 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.444 0.64 . . . . 0.0 110.089 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -122.68 168.23 12.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.075 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.512 ' HA3' ' O ' ' A' ' 90' ' ' TYR . . . -125.38 177.89 16.79 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.247 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.503 ' HB2' HG22 ' A' ' 88' ' ' ILE . 18.0 Cg_exo -66.45 -4.46 10.81 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 123.317 2.678 . . . . 0.0 112.959 -175.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.403 ' HD2' HG23 ' A' ' 88' ' ' ILE . 15.0 mmm180 -64.65 -35.44 81.02 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.946 0.403 . . . . 0.0 109.948 174.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -110.25 106.41 15.8 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.582 ' O ' HG22 ' A' ' 29' ' ' VAL . 74.6 mtm180 -61.6 -39.46 91.32 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.807 -173.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -70.02 -47.47 61.97 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.899 0.38 . . . . 0.0 110.958 -175.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.96 -28.43 67.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.373 177.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 59.6 t-105 -64.59 -39.46 93.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.891 174.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.582 HG22 ' O ' ' A' ' 25' ' ' ARG . 72.4 t -55.8 -44.27 76.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.489 175.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -64.46 -50.74 66.31 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.369 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.405 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 22.8 ttt180 -62.47 -36.59 82.95 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.07 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.81 -40.86 69.95 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 178.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.545 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 66.9 mttm -65.86 -44.65 84.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.3 177.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -64.71 -41.46 95.97 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.531 -178.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -58.87 -43.33 90.82 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.2 0.524 . . . . 0.0 109.661 175.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -65.74 -31.35 72.3 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.451 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.545 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 28.9 mm-40 -61.01 -47.44 86.45 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.806 0.336 . . . . 0.0 110.419 178.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.0 m -63.04 -40.62 98.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.491 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.468 ' O ' HG22 ' A' ' 43' ' ' VAL . 95.7 mt -63.78 -55.43 23.13 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.229 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 97.9 mt -56.63 -43.08 78.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 O-C-N 123.29 0.368 . . . . 0.0 111.267 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.1 tpp85 -57.99 -47.19 83.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.605 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -69.82 -37.69 76.31 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.782 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.468 HG22 ' O ' ' A' ' 39' ' ' LEU . 75.3 t -60.56 -40.24 83.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.878 0.37 . . . . 0.0 110.675 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.58 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 40.7 mt-10 -70.32 -37.86 74.81 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.979 177.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -57.69 -42.61 83.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.426 0.631 . . . . 0.0 109.698 172.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.591 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 15.3 m-20 -62.55 -57.56 10.68 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.708 -1.133 . . . . 0.0 112.008 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.58 ' HG2' ' HA ' ' A' ' 44' ' ' GLU . 21.7 ptmt -66.6 -25.64 66.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.483 -175.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -76.42 -21.02 56.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.951 0.405 . . . . 0.0 110.692 176.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -97.95 4.04 49.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.059 175.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.4 t70 60.06 26.38 15.71 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.956 0.884 . . . . 0.0 110.908 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -134.67 87.55 2.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.005 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.591 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 41.9 t0 -83.06 156.71 23.21 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.053 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.554 ' HB3' ' CD2' ' A' ' 54' ' ' PHE . 1.2 m95 -100.25 -56.9 2.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.863 -170.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.554 ' CD2' ' HB3' ' A' ' 53' ' ' TRP . 44.5 p90 -161.51 157.52 25.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.327 0.584 . . . . 0.0 111.87 -172.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -108.46 123.72 49.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 168.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.0 tp -130.92 124.12 30.41 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.061 0.458 . . . . 0.0 110.683 -173.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -101.9 158.51 16.08 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.465 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.2 m -141.84 149.92 40.93 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.753 0.311 . . . . 0.0 110.687 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.0 p-10 -79.27 169.97 17.33 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 172.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.615 ' HD3' ' H ' ' A' ' 60' ' ' LYS . 1.9 mppt? -63.31 -24.04 67.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.764 0.316 . . . . 0.0 111.534 -175.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -82.0 -22.41 36.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.911 -177.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.25 21.93 79.26 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.783 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.507 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . 15.4 p -99.42 -28.09 13.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.176 0.512 . . . . 0.0 111.182 -177.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.699 HH22 ' HB3' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -119.27 109.11 15.44 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.462 -178.399 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 1.008 ' HB2' ' HB2' ' A' ' 84' ' ' PHE . 27.1 m95 -107.51 140.18 40.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.138 177.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -152.35 142.42 22.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.789 0.328 . . . . 0.0 110.687 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 173.71 -149.82 11.33 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -142.02 138.61 31.95 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.894 0.347 . . . . 0.0 110.596 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.41 ' HA ' ' HB3' ' A' ' 54' ' ' PHE . 49.0 t -122.34 150.93 41.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.008 -178.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.689 ' HB3' ' HA ' ' A' ' 79' ' ' GLU . 47.5 p90 -159.9 159.98 33.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.817 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -149.2 139.64 22.44 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 172.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 26.1 mm -84.03 114.4 24.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.011 0.434 . . . . 0.0 110.938 -173.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -127.11 122.19 33.55 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.476 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.405 ' C ' ' H ' ' A' ' 76' ' ' LEU . 0.8 OUTLIER 62.3 34.07 16.09 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 123.667 0.604 . . . . 0.0 110.075 178.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.544 ' O ' HD12 ' A' ' 75' ' ' LEU . 1.8 tm? 75.36 -20.03 0.37 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.927 -178.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.405 ' H ' ' C ' ' A' ' 74' ' ' ASP . 62.4 mt -66.2 115.79 6.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.737 0.303 . . . . 0.0 110.86 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -94.34 106.97 18.95 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.472 ' HD1' ' HE1' ' A' ' 80' ' ' PHE . 6.7 p90 -121.8 117.69 27.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.129 0.49 . . . . 0.0 110.432 177.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.689 ' HA ' ' HB3' ' A' ' 70' ' ' TRP . 0.9 OUTLIER -110.72 138.98 46.42 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.867 -177.424 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.472 ' HE1' ' HD1' ' A' ' 78' ' ' TYR . 65.5 m-85 -127.83 129.79 47.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.63 -177.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -73.65 125.0 27.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.226 0.536 . . . . 0.0 110.206 174.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.445 HG22 HG12 ' A' ' 99' ' ' VAL . 38.3 pt -127.92 155.34 39.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.659 -175.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.699 ' HB3' HH22 ' A' ' 64' ' ' ARG . 44.7 mt-10 -127.37 163.0 24.98 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.771 175.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 1.008 ' HB2' ' HB2' ' A' ' 65' ' ' TRP . 93.2 m-85 -134.94 143.32 46.82 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.435 176.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -121.56 137.96 54.51 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.507 ' HB ' ' HA ' ' A' ' 63' ' ' THR . 51.0 mm -108.3 89.38 5.79 Favored Pre-proline 0 C--N 1.312 -1.057 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.463 -178.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -56.98 150.31 56.55 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.101 1.867 . . . . 0.0 110.531 175.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.503 HG22 ' HB2' ' A' ' 22' ' ' PRO . 2.1 mt -79.16 1.48 2.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.544 0.688 . . . . 0.0 109.996 -174.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.1 p -88.02 -4.94 58.74 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.737 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.747 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 33.5 t80 -65.39 145.51 99.06 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.528 175.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.747 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 98.1 Cg_endo -95.75 5.53 45.67 Favored 'Cis proline' 0 N--CA 1.455 -0.753 0 C-N-CA 124.453 -1.061 . . . . 0.0 113.029 0.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 10.2 m -62.13 -33.7 74.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.537 0.684 . . . . 0.0 109.653 178.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.0 m -111.59 135.47 52.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.065 171.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.56 146.16 98.99 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.051 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.534 ' HD3' ' CE1' ' A' ' 90' ' ' TYR . 57.3 Cg_endo -73.74 159.07 46.16 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.54 2.16 . . . . 0.0 111.697 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.414 ' CD ' ' HZ2' ' A' ' 114' ' ' LYS . 21.0 mt-10 -104.5 129.8 52.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.187 0.518 . . . . 0.0 111.178 -175.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.473 HD13 HD13 ' A' ' 142' ' ' LEU . 54.4 mt -101.64 123.64 54.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.215 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -113.08 135.0 54.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.115 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.445 HG12 HG22 ' A' ' 82' ' ' ILE . 18.7 t -121.09 87.74 44.21 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-O 120.588 0.233 . . . . 0.0 111.407 -176.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.45 -20.63 71.08 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.993 2.462 . . . . 0.0 112.347 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.408 ' O ' ' HE2' ' A' ' 105' ' ' LYS . 9.8 tp10 -71.75 -29.03 64.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.204 0.526 . . . . 0.0 110.602 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.0 mt -98.28 -31.43 12.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -50.86 109.64 0.34 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 123.724 0.64 . . . . 0.0 111.554 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 92.23 -36.75 3.57 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.747 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.408 ' HE2' ' O ' ' A' ' 101' ' ' GLU . 37.2 ttpt -81.45 -26.55 35.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.081 0.467 . . . . 0.0 111.031 -175.191 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 5.8 t . . . . . 0 C--N 1.325 -0.475 0 CA-C-O 120.838 0.352 . . . . 0.0 110.596 178.745 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.193 0 N-CA-C 112.419 -0.272 . . . . 0.0 112.419 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 97' ' ' ILE . 17.1 ptpt -101.87 158.68 15.95 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.457 HD11 HD11 ' A' ' 97' ' ' ILE . 38.6 pt -72.28 147.98 9.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.958 0.409 . . . . 0.0 111.323 -176.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 2.0 p -97.97 116.98 31.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.523 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 96.7 mt -92.77 158.69 15.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.988 0.423 . . . . 0.0 111.28 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.2 t -87.62 157.39 19.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.207 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.28 -53.35 59.16 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 -172.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -71.59 -10.01 59.11 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -173.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -71.06 -33.96 70.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.928 0.394 . . . . 0.0 110.238 178.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -62.14 -55.39 41.04 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.632 -177.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -62.42 -34.84 75.27 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.584 1.523 . . . . 0.0 111.917 175.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 49.2 tp -59.35 -46.41 88.7 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.368 177.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 57.3 t-105 -59.33 -56.03 27.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.707 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.33 -36.51 82.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.159 -175.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -67.72 -31.89 72.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.301 -177.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -95.96 20.97 9.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.455 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.46 HG13 ' HA ' ' A' ' 130' ' ' PRO . 90.4 t -91.28 137.6 26.11 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 172.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.46 ' HA ' HG13 ' A' ' 129' ' ' VAL . 97.5 Cg_endo -93.36 -152.88 0.37 Allowed 'Cis proline' 0 N--CA 1.46 -0.493 0 C-N-CA 124.265 -1.139 . . . . 0.0 113.58 2.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.58 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 9.6 mtmp? 77.21 -5.96 2.08 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.955 0.902 . . . . 0.0 111.614 -176.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -80.74 152.22 28.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.291 174.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.405 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -156.72 179.17 32.74 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.797 -0.716 . . . . 0.0 111.977 -174.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.601 ' HG ' ' HE2' ' A' ' 138' ' ' MET . 53.9 tp -64.73 -40.76 95.87 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 122.57 0.348 . . . . 0.0 111.197 -174.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.42 -35.91 76.92 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.499 0.666 . . . . 0.0 110.751 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . 0.4 ' HE1' ' HA ' ' A' ' 15' ' ' VAL . 47.7 m80 -71.23 -33.02 69.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.166 178.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 62.0 tp -66.49 -33.81 76.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.321 176.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' MET . . . . . 0.601 ' HE2' ' HG ' ' A' ' 134' ' ' LEU . 23.7 mmt -56.87 -55.65 31.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.098 0.475 . . . . 0.0 110.173 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.17 -40.77 82.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.674 -0.693 . . . . 0.0 112.657 -177.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.1 mt -86.36 -28.97 23.31 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -171.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -115.61 -57.13 0.34 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.285 -0.959 . . . . 0.0 113.165 -175.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.473 HD13 HD13 ' A' ' 97' ' ' ILE . 10.2 tt -62.48 -49.51 75.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.64 0.257 . . . . 0.0 111.208 -174.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.25 -61.45 7.38 Favored Glycine 0 CA--C 1.524 0.65 0 CA-C-N 116.178 -0.465 . . . . 0.0 113.49 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.83 -35.77 89.39 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.891 2.394 . . . . 0.0 113.059 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -65.22 -40.93 94.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.613 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 80.1 mt -59.95 -33.58 72.11 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.805 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.73 -13.87 62.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.663 -177.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 44.8 t -103.17 -35.85 3.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.091 0.472 . . . . 0.0 110.641 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -85.71 -51.89 6.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.027 -174.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.546 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 40.8 mm -60.67 -52.11 74.9 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -170.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.546 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 56.2 Cg_exo -53.74 -34.71 75.74 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 122.18 1.92 . . . . 0.0 112.707 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -67.14 -41.03 86.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.595 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 57.8 tp -68.81 -35.72 77.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.082 0.468 . . . . 0.0 110.371 176.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 150' ' ' ILE . 77.2 mt -62.4 -48.3 88.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.363 177.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -66.01 -26.06 67.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.842 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . 0.535 ' HE3' HG22 ' A' ' 158' ' ' VAL . 34.8 ttpt -74.0 -16.03 61.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.987 0.422 . . . . 0.0 110.268 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 83.62 18.32 64.16 Favored Glycine 0 C--O 1.229 -0.164 0 C-N-CA 121.078 -0.582 . . . . 0.0 113.607 172.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . 0.535 HG22 ' HE3' ' A' ' 156' ' ' LYS . 41.1 t -88.4 -18.59 8.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.526 0.679 . . . . 0.0 110.751 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.469 HD12 HG12 ' A' ' 154' ' ' ILE . 66.0 mt . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.463 ' HA ' ' NE ' ' A' ' 8' ' ' ARG . . . . . . . . 0 CA--C 1.521 -0.144 0 CA-C-O 120.907 0.384 . . . . 0.0 110.745 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.433 ' O ' HG21 ' A' ' 10' ' ' VAL . 24.8 m -56.62 -49.53 74.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.186 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.6 ptt180 -67.79 -38.24 83.07 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -173.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.463 ' NE ' ' HA ' ' A' ' 5' ' ' ALA . 17.3 ptt180 -71.17 -32.23 68.65 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.535 -177.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.409 HG21 ' O ' ' A' ' 5' ' ' ALA . 79.1 t -68.64 -45.59 81.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.433 HG21 ' O ' ' A' ' 6' ' ' THR . 57.4 t -67.89 -26.5 34.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.891 0.377 . . . . 0.0 110.899 178.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.3 t -70.03 -50.79 37.83 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.741 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.432 ' O ' ' HD2' ' A' ' 41' ' ' ARG . 50.2 mt-10 -83.94 -8.96 59.04 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -176.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.425 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 54.0 mt -104.74 88.2 2.16 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 170.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.6 Cg_endo -49.42 146.09 14.83 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.919 3.079 . . . . 0.0 113.657 -170.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.0 m -77.55 160.8 4.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.255 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.482 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 6.1 mp -110.05 148.99 30.65 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.161 -176.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -110.24 -20.96 12.47 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 -174.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 32.7 m -88.44 115.86 26.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.771 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -112.49 104.34 12.45 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -151.07 157.94 43.44 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.266 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.17 -177.05 29.04 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.152 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.95 5.68 5.15 Favored 'Trans proline' 0 CA--C 1.531 0.348 0 C-N-CA 122.913 2.409 . . . . 0.0 113.103 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.765 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 0.4 OUTLIER -92.52 -46.61 7.55 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 177.598 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -80.16 75.9 6.93 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 174.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.53 ' HA ' ' HB3' ' A' ' 28' ' ' TRP . 93.8 mtt180 -71.22 -25.06 62.34 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -168.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.529 ' HG3' HD23 ' A' ' 27' ' ' LEU . 7.5 pt-20 -63.53 -35.78 81.61 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.371 171.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.529 HD23 ' HG3' ' A' ' 26' ' ' GLU . 3.8 mm? -81.29 -29.52 34.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.046 0.451 . . . . 0.0 109.954 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.53 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 64.5 t-105 -61.16 -39.18 89.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.445 177.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.505 HG21 ' O ' ' A' ' 25' ' ' ARG . 87.2 t -59.55 -40.96 83.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 121.107 0.479 . . . . 0.0 110.414 175.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -66.86 -41.76 86.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.226 0.536 . . . . 0.0 109.678 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.538 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 11.8 tpt180 -62.23 -36.54 82.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.805 176.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 61.9 mt -57.8 -54.9 41.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.215 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.462 ' HB2' ' HE3' ' A' ' 33' ' ' LYS . 19.1 ptmt -61.23 -37.02 81.57 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.572 -176.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -59.31 -50.87 72.32 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.133 0.492 . . . . 0.0 110.68 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.454 ' HA ' HD22 ' A' ' 16' ' ' LEU . 8.5 tp10 -65.44 -42.05 92.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.138 -178.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.477 ' O ' HG13 ' A' ' 40' ' ' ILE . 23.5 m-85 -60.53 -45.36 94.11 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.165 178.284 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -60.66 -40.63 92.77 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.655 0.264 . . . . 0.0 110.848 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.3 t -64.73 -46.89 80.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.97 177.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.484 ' O ' HG23 ' A' ' 43' ' ' VAL . 64.0 mt -56.07 -53.92 51.26 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.293 177.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.516 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 82.5 mt -55.98 -40.67 64.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.883 -175.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.465 ' O ' ' HD3' ' A' ' 41' ' ' ARG . 0.0 OUTLIER -61.33 -44.34 97.35 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.704 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -65.91 -36.99 84.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.11 178.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 39' ' ' LEU . 94.9 t -64.89 -42.46 94.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.62 177.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.516 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 42.1 mt-10 -53.51 -56.21 18.9 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 123.315 0.384 . . . . 0.0 111.289 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -52.22 -41.85 63.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.146 0.498 . . . . 0.0 111.075 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.603 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 83.3 m-20 -72.47 -51.07 21.73 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.602 -176.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 31.9 mmmt -59.08 -38.93 80.61 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.557 0.218 . . . . 0.0 111.14 176.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -63.57 -41.46 98.38 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.499 178.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.18 3.69 22.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.865 0.364 . . . . 0.0 110.495 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.1 t70 67.9 9.38 7.1 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.681 0.792 . . . . 0.0 111.23 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.603 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 5.9 t30 -98.78 77.3 2.24 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.77 102.5 0.59 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.386 0.613 . . . . 0.0 109.848 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.571 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -67.04 -57.16 7.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.66 -1.155 . . . . 0.0 112.437 -168.808 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.571 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 37.1 p90 -156.72 161.44 39.82 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.27 0.557 . . . . 0.0 111.152 -171.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.489 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 18.4 tpp85 -121.46 123.42 42.02 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 171.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 19.4 tp -124.03 122.68 38.54 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.031 0.443 . . . . 0.0 110.401 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -105.59 156.06 18.61 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.442 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.8 p -135.54 159.72 40.73 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.767 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -73.1 176.32 5.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.104 173.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -57.56 -43.08 84.21 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.915 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -81.22 -20.47 40.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.718 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.82 25.97 65.93 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.646 -0.787 . . . . 0.0 111.314 -173.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.7 p -85.71 -4.89 59.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.972 0.415 . . . . 0.0 112.014 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 56.0 ttt180 -155.95 129.86 8.58 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -121.22 142.09 50.24 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 -177.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -155.0 160.99 41.48 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 -177.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.489 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 163.68 -160.09 32.83 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.537 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -115.21 147.07 40.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.811 0.339 . . . . 0.0 110.91 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.573 ' SG ' ' HB2' ' A' ' 80' ' ' PHE . 5.3 p -117.49 134.26 55.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.134 172.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.459 ' CD1' ' HG2' ' A' ' 79' ' ' GLU . 13.6 m-90 -114.24 128.65 56.46 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.221 0.534 . . . . 0.0 111.559 -175.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -136.21 120.6 18.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.088 175.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.418 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.7 mp -105.61 123.73 60.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.981 0.419 . . . . 0.0 110.486 -176.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -128.46 108.31 10.44 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.717 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.27 57.69 4.33 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.674 0.609 . . . . 0.0 111.31 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.8 mt 70.11 -0.6 2.72 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.355 -0.839 . . . . 0.0 113.141 175.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 66.5 mt -91.91 113.69 26.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.999 0.428 . . . . 0.0 110.571 177.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.3 tttt -99.95 96.3 7.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.181 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.543 ' HH ' HG23 ' A' ' 150' ' ' ILE . 2.8 p90 -104.54 125.96 51.18 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.053 0.454 . . . . 0.0 110.182 176.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.459 ' HG2' ' CD1' ' A' ' 70' ' ' TRP . 28.4 mt-10 -106.88 135.41 48.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.186 -174.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.573 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . 84.7 m-85 -120.9 129.97 53.71 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.679 0.276 . . . . 0.0 110.871 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -88.09 121.09 30.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.859 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 40.1 pt -125.34 157.19 34.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.541 -178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -158.57 158.99 35.0 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.723 174.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 30.5 p90 -159.14 153.79 24.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.349 177.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.416 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 8.7 p-10 -99.41 166.6 11.1 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.89 -177.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.3 mm -111.95 89.68 12.0 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.201 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.416 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 11.0 Cg_exo -66.02 164.66 26.62 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.551 2.167 . . . . 0.0 112.12 -177.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 58.0 mt -66.49 -22.14 29.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.36 0.6 . . . . 0.0 110.052 177.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -82.23 3.38 27.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.041 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.642 ' HH ' ' HB2' ' A' ' 134' ' ' LEU . 70.6 t80 -77.94 142.72 65.17 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -96.23 10.51 41.76 Favored 'Cis proline' 0 N--CA 1.457 -0.645 0 C-N-CA 124.178 -1.176 . . . . 0.0 113.126 -1.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.506 ' HA ' HG11 ' A' ' 129' ' ' VAL . 15.9 m -56.51 -35.3 67.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.32 0.581 . . . . 0.0 110.99 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.4 m -130.66 127.62 39.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.886 175.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.38 143.44 82.81 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.824 -179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -83.63 134.0 6.31 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.69 2.26 . . . . 0.0 112.226 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.59 ' HB2' ' HD2' ' A' ' 114' ' ' LYS . 2.9 mp0 -62.24 132.64 53.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.149 176.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.488 ' O ' HG12 ' A' ' 115' ' ' ILE . 57.7 mt -75.64 143.47 13.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.391 -178.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.503 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -107.45 124.1 49.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.792 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 25.6 t -119.98 87.22 38.25 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.016 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -70.73 6.2 1.74 Allowed 'Trans proline' 0 N--CA 1.474 0.379 0 C-N-CA 123.5 2.8 . . . . 0.0 114.046 -173.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -103.95 -44.03 5.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.836 0.351 . . . . 0.0 110.84 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.795 ' HA ' ' HD3' ' A' ' 105' ' ' LYS . 91.4 mt -83.47 0.33 46.78 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -172.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -64.6 -15.1 60.6 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -171.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -114.8 2.71 23.03 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.56 -0.828 . . . . 0.0 113.633 -177.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.795 ' HD3' ' HA ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -127.96 -20.34 3.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.688 0.744 . . . . 0.0 112.37 -178.466 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.55 HG23 ' O ' ' A' ' 102' ' ' LEU . 7.7 t . . . . . 0 C--N 1.331 -0.238 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.382 173.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . 0.503 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . . . . . . 0 N--CA 1.449 -0.475 0 N-CA-C 112.292 -0.323 . . . . 0.0 112.292 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.59 ' HD2' ' HB2' ' A' ' 96' ' ' GLU . 64.1 mmtt -70.03 111.77 5.94 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 122.422 0.289 . . . . 0.0 110.978 -179.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 97' ' ' ILE . 34.9 pt -81.65 164.17 3.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.312 -178.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 53.0 t -99.85 119.89 38.9 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.058 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 96.1 mt -79.17 177.07 9.1 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.859 175.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.65 140.18 58.84 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.561 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.09 -46.56 61.83 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -171.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.6 m170 -92.91 -5.93 49.73 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.414 -174.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -71.38 -41.18 69.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.357 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.552 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 79.2 tttt -65.79 -49.89 57.11 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.68 -177.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.552 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 34.6 Cg_exo -60.99 -32.15 92.08 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.839 1.693 . . . . 0.0 111.83 175.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 52.3 tp -60.82 -46.98 88.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.984 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.479 ' O ' HG23 ' A' ' 129' ' ' VAL . 17.7 t-105 -54.23 -56.66 16.18 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.565 177.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -58.23 -35.21 71.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.648 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 6.1 ttp180 -68.31 -36.31 79.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.066 0.46 . . . . 0.0 110.801 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -79.76 -31.4 40.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.513 -173.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.506 HG11 ' HA ' ' A' ' 92' ' ' THR . 94.8 t -53.5 137.24 51.75 Favored Pre-proline 0 N--CA 1.468 0.433 0 O-C-N 123.394 0.434 . . . . 0.0 110.545 176.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.483 ' HA ' HG12 ' A' ' 129' ' ' VAL . 86.5 Cg_endo -90.43 -147.55 0.28 Allowed 'Cis proline' 0 C--N 1.349 0.572 0 C-N-CA 124.28 -1.133 . . . . 0.0 113.204 5.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.482 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 33.1 ttpt 67.5 4.69 3.93 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.409 0.684 . . . . 0.0 111.439 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -101.56 159.96 14.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.789 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.538 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -136.78 158.25 24.07 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.947 -174.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.642 ' HB2' ' HH ' ' A' ' 90' ' ' TYR . 53.6 tp -63.84 -38.76 92.29 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.23 0.612 . . . . 0.0 111.198 -177.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.59 -31.03 56.24 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.407 0.622 . . . . 0.0 111.165 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -71.2 -31.46 67.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.514 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 63.1 tp -61.73 -48.34 81.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.943 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' MET . . . . . 0.471 ' HE3' ' HG ' ' A' ' 134' ' ' LEU . 5.4 mpp? -66.25 -41.03 90.52 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.738 0.304 . . . . 0.0 111.206 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.18 -49.99 44.83 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 87.8 mt -88.86 -21.71 23.54 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -172.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -106.77 -62.58 0.59 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.01 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.491 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 53.9 tp -64.75 -42.15 95.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 -175.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.03 -61.87 6.49 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 121.248 -0.501 . . . . 0.0 112.991 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . 0.468 ' O ' HG22 ' A' ' 148' ' ' VAL . 48.9 Cg_exo -58.66 -33.84 98.52 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.635 2.223 . . . . 0.0 112.699 176.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 39.9 t90 -59.72 -44.31 93.78 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.994 0.426 . . . . 0.0 110.258 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 76.8 mt -62.75 -37.75 87.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.719 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.9 -11.84 61.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.907 -176.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . 0.468 HG22 ' O ' ' A' ' 144' ' ' PRO . 59.5 t -89.13 -46.66 15.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.787 0.327 . . . . 0.0 110.828 178.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . 0.417 ' O ' HD22 ' A' ' 153' ' ' LEU . 59.2 mm-40 -83.8 -43.14 15.72 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -173.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.543 HG23 ' HH ' ' A' ' 78' ' ' TYR . 1.6 mp -54.21 -50.97 81.63 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -170.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 11.6 Cg_endo -54.91 -34.0 84.31 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 122.108 1.872 . . . . 0.0 113.055 -178.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 15.9 t70 -87.5 -43.2 12.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.98 0.419 . . . . 0.0 110.75 -177.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.417 HD22 ' O ' ' A' ' 149' ' ' GLU . 4.2 mm? -60.44 -35.58 76.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.639 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . 0.51 ' HA ' ' HB ' ' A' ' 159' ' ' ILE . 67.9 mt -65.25 -40.32 88.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.066 0.46 . . . . 0.0 110.187 175.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -66.14 -34.75 78.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.564 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 58.8 mtpt -65.29 -17.93 64.9 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.28 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 81.19 22.03 61.61 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.7 178.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 28.5 m -103.2 -21.16 5.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.855 0.359 . . . . 0.0 110.797 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.51 ' HB ' ' HA ' ' A' ' 154' ' ' ILE . 45.0 mm . . . . . 0 C--N 1.326 -0.417 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 176.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.47 ' O ' HG22 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 120.903 0.383 . . . . 0.0 110.856 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.1 m -58.88 -51.14 71.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.609 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -65.26 -38.07 89.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.702 -174.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.1 ppt_? -75.16 -23.5 57.78 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.247 -177.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.47 HG22 ' O ' ' A' ' 5' ' ' ALA . 76.1 t -75.56 -50.68 22.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.826 0.346 . . . . 0.0 110.217 175.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.8 t -62.29 -30.4 48.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.876 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.8 t -64.31 -21.89 66.76 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.386 -178.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -95.98 2.37 53.41 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.975 0.416 . . . . 0.0 110.812 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.471 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 32.1 mt -118.93 88.0 35.1 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.471 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 6.4 Cg_endo -46.76 148.64 3.63 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 124.398 3.399 . . . . 0.0 114.382 -170.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.4 m -83.36 152.88 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.237 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.751 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 6.1 mp -103.21 136.15 43.53 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.382 -175.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.47 ' HD2' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -94.76 -45.62 7.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.188 0.518 . . . . 0.0 110.779 -173.434 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.448 HG23 ' HB3' ' A' ' 30' ' ' GLN . 0.6 OUTLIER -88.86 83.35 6.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.224 -174.681 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.461 ' OD1' ' HD2' ' A' ' 31' ' ' ARG . 84.9 m-20 -124.62 127.37 47.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.413 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.411 ' HB1' ' HB3' ' A' ' 27' ' ' LEU . . . -140.45 -65.5 0.45 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.866 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 158.85 166.71 18.43 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.873 -0.679 . . . . 0.0 111.694 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.9 -10.87 29.47 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.061 2.508 . . . . 0.0 111.89 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.509 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 4.8 mmp_? -63.63 -44.47 93.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.417 176.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.531 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 10.3 t0 -91.74 111.28 22.73 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 -178.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.447 ' O ' HG21 ' A' ' 29' ' ' VAL . 18.1 mtp180 -55.14 -51.28 66.95 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.026 -178.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.77 -44.02 94.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.901 0.381 . . . . 0.0 111.345 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.531 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 4.4 mm? -70.55 -29.39 65.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.204 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.533 ' CH2' HG22 ' A' ' 86' ' ' ILE . 75.6 t-105 -73.99 -42.0 61.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 177.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' ' 25' ' ' ARG . 72.1 t -60.97 -42.51 93.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.982 0.42 . . . . 0.0 110.082 176.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.448 ' HB3' HG23 ' A' ' 18' ' ' THR . 2.4 mm100 -62.15 -52.43 63.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.604 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.505 HH12 HD22 ' A' ' 16' ' ' LEU . 1.8 ttt85 -56.62 -39.37 73.49 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.144 0.278 . . . . 0.0 111.338 178.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.511 ' HG ' ' CE2' ' A' ' 36' ' ' TYR . 18.1 tp -57.34 -47.57 81.26 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.773 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -67.5 -38.97 85.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.863 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 6.7 mm-40 -55.76 -50.67 69.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.232 0.539 . . . . 0.0 110.312 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.535 ' HA ' HD23 ' A' ' 16' ' ' LEU . 12.6 tp10 -65.53 -37.85 87.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.424 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.511 ' CE2' ' HG ' ' A' ' 32' ' ' LEU . 10.7 m-85 -59.78 -38.28 81.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.145 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -60.59 -45.12 95.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.993 0.425 . . . . 0.0 110.252 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.7 t -63.77 -47.04 82.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.552 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 35' ' ' GLU . 94.7 mt -58.78 -48.08 82.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.093 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 36' ' ' TYR . 80.0 mt -57.86 -47.14 86.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.778 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -63.43 -40.25 96.67 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.704 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -59.76 -48.87 79.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.505 HG12 ' HE2' ' A' ' 47' ' ' LYS . 94.3 t -59.19 -38.41 74.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.781 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.63 -50.31 74.31 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 173.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.2 -40.47 81.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.918 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.419 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 16.2 m120 -55.72 -55.28 34.14 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.916 176.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.505 ' HE2' HG12 ' A' ' 43' ' ' VAL . 53.8 mttm -66.21 -34.81 78.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.973 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -68.41 -28.32 66.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.704 0.287 . . . . 0.0 111.384 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -93.81 2.16 56.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.754 0.312 . . . . 0.0 110.788 177.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.1 t0 64.24 20.14 12.06 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.827 0.822 . . . . 0.0 110.677 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -118.39 72.96 0.89 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.627 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.419 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 14.8 t70 -91.85 88.81 6.78 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.172 -179.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.42 ' HB2' ' O ' ' A' ' 70' ' ' TRP . 24.1 p-90 -117.28 2.95 12.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.986 -173.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -119.23 129.88 55.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.498 0.666 . . . . 0.0 112.195 -167.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -140.45 124.23 17.24 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.906 -1.043 . . . . 0.0 108.376 174.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.7 tp -134.49 127.99 32.52 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.764 0.316 . . . . 0.0 110.259 -178.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -128.39 160.42 32.28 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.5 p -142.23 172.72 12.31 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.997 0.427 . . . . 0.0 111.019 -176.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 33.1 p30 -89.66 163.55 15.09 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 168.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.404 ' HB2' ' HE2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -66.27 -21.39 66.28 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -172.825 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -74.38 -25.94 59.8 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.572 175.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.03 22.36 78.0 Favored Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.162 -177.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 26.8 p -89.97 -26.94 20.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.864 0.364 . . . . 0.0 111.336 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.3 mtt180 -127.58 132.99 49.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.034 0.445 . . . . 0.0 110.553 175.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -115.82 128.21 55.65 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.244 175.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.7 p90 -130.4 129.32 42.91 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -131.24 166.84 22.67 Favored Glycine 0 N--CA 1.435 -1.401 0 C-N-CA 119.838 -1.173 . . . . 0.0 113.28 -172.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -124.24 131.23 53.51 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.0 p -128.64 131.6 48.07 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.418 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.42 ' O ' ' HB2' ' A' ' 53' ' ' TRP . 6.7 p90 -133.26 121.47 22.5 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.261 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.416 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 14.5 t80 -117.82 129.44 55.66 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.896 -172.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.456 ' N ' HD12 ' A' ' 72' ' ' ILE . 4.0 mp -93.83 113.79 29.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -138.21 118.68 13.83 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.653 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 56.79 45.21 22.09 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.58 0.55 . . . . 0.0 110.84 -176.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.429 HD13 ' HA ' ' A' ' 75' ' ' LEU . 4.4 mm? 67.26 4.74 3.83 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.479 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 99.2 mt -96.96 113.14 24.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.106 0.479 . . . . 0.0 110.126 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -96.44 93.47 6.84 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.32 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.416 ' CE1' ' HB3' ' A' ' 71' ' ' TYR . 14.2 p90 -99.66 150.13 22.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.597 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -124.37 136.27 53.95 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.499 -174.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -133.5 137.96 45.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.948 176.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -102.75 137.1 41.41 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.011 0.434 . . . . 0.0 110.051 176.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.448 HG22 HG22 ' A' ' 99' ' ' VAL . 40.8 pt -136.41 158.16 37.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.396 -176.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -155.79 156.4 34.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.245 0.545 . . . . 0.0 110.829 175.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.556 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 42.4 p90 -155.46 149.81 25.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.23 177.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -102.36 163.52 12.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.503 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.533 HG22 ' CH2' ' A' ' 28' ' ' TRP . 50.8 mm -105.66 91.49 5.12 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.189 -178.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.04 164.01 10.86 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.677 2.251 . . . . 0.0 112.798 -179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 73.4 mt -66.33 -33.39 63.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.196 -177.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.9 p -85.19 17.57 2.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.25 0.548 . . . . 0.0 111.64 -176.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.537 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 69.0 t80 -79.15 143.4 60.86 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 176.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.537 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.4 Cg_endo -96.7 14.74 36.42 Favored 'Cis proline' 0 N--CA 1.459 -0.509 0 C-N-CA 124.497 -1.043 . . . . 0.0 113.689 2.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.5 m -65.57 -26.93 68.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.543 0.687 . . . . 0.0 109.972 178.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.3 m -114.01 131.57 56.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.543 172.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.451 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -70.73 144.92 91.6 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.804 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 5.7 Cg_exo -72.8 143.41 37.14 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.8 2.334 . . . . 0.0 112.307 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' A' ' 114' ' ' LYS . 48.0 mt-10 -86.63 101.17 13.0 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.993 0.425 . . . . 0.0 110.046 179.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.556 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 61.6 mt -74.35 125.42 33.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.781 -178.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -105.58 134.14 49.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.54 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.448 HG22 HG22 ' A' ' 82' ' ' ILE . 42.5 t -127.78 86.84 57.33 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.54 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.04 -24.53 73.93 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.861 2.374 . . . . 0.0 112.664 -175.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -63.58 -38.9 92.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.574 176.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 98.7 mt -108.99 34.16 3.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.312 -177.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -63.01 -16.98 61.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.03 -175.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -171.74 30.17 0.12 Allowed Glycine 0 C--N 1.314 -0.65 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.145 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -100.08 8.2 44.11 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -175.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.2 t . . . . . 0 C--N 1.324 -0.507 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 174.994 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.208 0 N-CA-C 112.302 -0.319 . . . . 0.0 112.302 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.494 ' HD3' ' HB3' ' A' ' 96' ' ' GLU . 59.4 mttp -109.36 139.18 44.64 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 35.4 pt -68.02 146.69 12.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.149 0.499 . . . . 0.0 112.314 -173.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.2 t -104.53 100.07 9.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.885 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 97.3 mt -88.16 171.84 9.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.334 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 10.2 t -64.83 142.07 58.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.795 0.331 . . . . 0.0 110.161 178.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -65.42 -25.09 67.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.521 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -79.93 -6.67 57.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.734 0.302 . . . . 0.0 111.61 -177.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -71.71 -36.44 70.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.707 0.289 . . . . 0.0 110.529 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.448 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 99.8 mttt -68.21 -50.51 29.46 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.987 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.448 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 10.3 Cg_endo -55.29 -37.81 94.2 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 121.932 1.755 . . . . 0.0 111.88 172.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.77 -46.05 87.01 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.721 0.296 . . . . 0.0 110.27 176.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.57 ' O ' HG21 ' A' ' 129' ' ' VAL . 17.9 t-105 -53.16 -57.6 9.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.624 176.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.43 -27.35 68.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.647 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 -74.44 -25.29 59.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.958 0.409 . . . . 0.0 110.945 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -104.01 15.12 29.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.858 -175.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.57 HG21 ' O ' ' A' ' 125' ' ' TRP . 95.9 t -98.57 137.26 20.63 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.467 ' HA ' HG13 ' A' ' 129' ' ' VAL . 82.0 Cg_endo -89.98 -158.25 1.02 Allowed 'Cis proline' 0 N--CA 1.46 -0.473 0 C-N-CA 123.871 -1.304 . . . . 0.0 113.243 -0.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.751 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 57.8 mttp 75.51 0.79 3.5 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.898 0.879 . . . . 0.0 111.73 -174.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -79.08 169.77 17.68 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -149.32 160.48 28.45 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.652 -176.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.492 HD13 ' HH ' ' A' ' 90' ' ' TYR . 49.3 tp -69.85 -38.45 76.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 122.678 0.391 . . . . 0.0 110.368 -177.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.9 -30.82 64.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.246 0.546 . . . . 0.0 110.809 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -70.38 -31.9 69.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.45 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.4 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 49.5 tp -60.52 -51.96 67.22 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.137 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' MET . . . . . 0.404 ' HE1' ' HG ' ' A' ' 134' ' ' LEU . 5.4 mpp? -67.19 -33.61 75.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.732 0.301 . . . . 0.0 111.141 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.7 -48.39 47.68 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.976 -178.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 84.5 mt -97.97 -2.94 39.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -173.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -119.13 -64.82 0.29 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.316 -0.945 . . . . 0.0 112.586 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.457 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 52.6 tp -62.3 -51.86 66.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.47 0.176 . . . . 0.0 111.37 -176.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -50.7 -61.07 6.32 Favored Glycine 0 CA--C 1.523 0.581 0 CA-C-N 116.181 -0.463 . . . . 0.0 113.298 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . 0.556 ' O ' HG21 ' A' ' 148' ' ' VAL . 72.6 Cg_exo -53.49 -40.42 78.79 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.724 2.283 . . . . 0.0 112.73 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -63.47 -41.82 98.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.709 0.29 . . . . 0.0 110.616 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.49 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 89.7 mt -59.99 -39.28 85.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.091 0.472 . . . . 0.0 110.092 176.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.63 -18.66 64.34 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.736 -179.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . 0.556 HG21 ' O ' ' A' ' 144' ' ' PRO . 86.4 t -71.61 -56.68 9.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -175.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -134.5 0.53 3.04 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -172.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.569 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 33.4 mm -68.2 -52.18 23.22 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.157 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.569 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 38.2 Cg_exo -61.42 -29.36 85.24 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.734 1.623 . . . . 0.0 111.516 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -69.84 -40.98 75.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.008 178.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.51 HD23 HD13 ' A' ' 159' ' ' ILE . 24.7 tp -68.11 -30.93 70.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.499 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . 0.522 HG13 ' O ' ' A' ' 150' ' ' ILE . 74.3 mt -62.14 -44.86 99.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.073 0.463 . . . . 0.0 110.077 175.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 54.3 tp60 -69.16 -14.66 63.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.081 -178.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . 0.545 ' HE2' ' HA ' ' A' ' 156' ' ' LYS . 11.2 mmpt? -68.3 -20.94 64.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.95 0.405 . . . . 0.0 110.228 174.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 88.96 13.15 62.75 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.722 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 27.5 m -100.11 -16.31 7.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.844 0.354 . . . . 0.0 111.645 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.51 HD13 HD23 ' A' ' 153' ' ' LEU . 55.6 mt . . . . . 0 C--N 1.327 -0.38 0 CA-C-O 121.12 0.486 . . . . 0.0 110.391 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.474 ' O ' HG22 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 120.608 0.242 . . . . 0.0 110.625 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.513 ' O ' HG21 ' A' ' 10' ' ' VAL . 17.4 m -57.43 -48.63 78.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.59 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.402 ' HA ' ' HD3' ' A' ' 7' ' ' ARG . 24.0 mmt180 -64.11 -38.98 93.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.79 0.328 . . . . 0.0 110.658 -178.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 8' ' ' ARG . 44.5 ttp180 -65.2 -40.02 93.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.286 177.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.474 HG22 ' O ' ' A' ' 5' ' ' ALA . 52.3 t -63.96 -44.14 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.04 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.513 HG21 ' O ' ' A' ' 6' ' ' THR . 46.7 t -68.38 -20.15 25.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 121.103 0.478 . . . . 0.0 110.613 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.1 m -81.54 -47.61 12.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.786 176.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -69.85 -27.88 65.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.896 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.545 HG23 ' HB2' ' A' ' 38' ' ' SER . 39.6 mt -106.56 88.67 3.54 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.827 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -65.69 179.32 1.77 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.981 2.454 . . . . 0.0 113.109 -174.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.576 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.8 m -88.85 162.98 2.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.102 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.801 HD21 ' HB3' ' A' ' 35' ' ' GLU . 9.1 mp -92.07 156.09 17.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.448 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -71.45 -33.06 69.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.151 0.5 . . . . 0.0 110.267 178.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.542 HG22 ' HB3' ' A' ' 31' ' ' ARG . 3.0 t -146.74 152.36 38.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.629 -176.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -132.1 36.32 3.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.084 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.63 149.48 48.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.439 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.38 176.78 54.58 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.327 -179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.8 -3.44 6.88 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.364 2.709 . . . . 0.0 112.587 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HD2' HG22 ' A' ' 88' ' ' ILE . 0.3 OUTLIER -64.11 -29.5 70.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.7 176.944 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -109.33 110.55 21.74 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 57.9 mtp85 -56.61 -51.59 68.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.647 -174.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -65.6 -52.82 49.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.68 0.276 . . . . 0.0 111.197 -174.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.497 HD12 HG21 ' A' ' 18' ' ' THR . 4.4 mm? -63.67 -33.42 75.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.002 -177.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.454 ' CZ2' HG22 ' A' ' 86' ' ' ILE . 63.7 t-105 -63.19 -52.05 63.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.633 176.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.6 t -64.7 -34.34 69.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.975 0.417 . . . . 0.0 110.662 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -71.58 -44.48 64.42 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.053 -178.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.542 ' HB3' HG22 ' A' ' 18' ' ' THR . 6.8 ptm180 -68.37 -28.54 67.2 Favored 'General case' 0 CA--C 1.523 -0.095 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -43.72 76.08 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.046 174.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -67.51 -40.48 85.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.536 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -61.12 -45.05 96.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.233 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.801 ' HB3' HD21 ' A' ' 16' ' ' LEU . 22.0 pt-20 -77.41 -29.29 52.99 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.953 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.0 OUTLIER -57.35 -47.1 82.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.92 0.39 . . . . 0.0 110.404 171.747 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -63.98 -37.92 89.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.732 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.561 ' OG ' ' HA ' ' A' ' 35' ' ' GLU . 0.6 OUTLIER -72.18 -31.38 65.86 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.732 177.068 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 56.9 mt -62.28 -49.28 76.3 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 170.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.3 mt -58.32 -40.66 78.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.837 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.427 ' NE ' ' HA ' ' A' ' 41' ' ' ARG . 4.5 mmp_? -53.42 -52.54 59.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.75 0.31 . . . . 0.0 111.192 176.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -63.16 -47.2 83.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.697 -177.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.8 t -62.67 -41.38 92.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.545 ' OE2' ' HD3' ' A' ' 47' ' ' LYS . 6.7 tp10 -61.72 -51.34 68.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.354 0.597 . . . . 0.0 110.318 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -59.31 -39.45 83.1 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.89 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -66.9 -47.42 71.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.573 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.545 ' HD3' ' OE2' ' A' ' 44' ' ' GLU . 22.8 ptmt -66.59 -28.75 68.75 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.207 -0.197 . . . . 0.0 110.887 -178.053 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.98 -24.72 61.63 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.245 0.545 . . . . 0.0 110.302 176.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -88.17 7.06 33.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.266 176.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.7 t70 72.81 3.87 4.81 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.469 176.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.504 ' C ' HD21 ' A' ' 51' ' ' ASN . 0.2 OUTLIER -117.81 86.11 2.46 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.129 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.27 136.07 51.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.088 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -88.79 -78.78 0.33 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.906 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -150.95 171.25 17.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.124 0.488 . . . . 0.0 111.453 -170.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 -132.48 124.05 27.81 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.043 172.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.534 HD12 ' HE3' ' A' ' 138' ' ' MET . 9.0 mt -126.69 127.12 44.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.94 0.4 . . . . 0.0 111.378 -178.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -133.22 163.32 29.55 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.354 173.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -129.54 166.72 19.11 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.737 0.303 . . . . 0.0 110.738 -173.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.481 ' HB3' ' OE1' ' A' ' 61' ' ' GLU . 4.3 m-20 -58.71 159.71 6.42 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 167.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -67.19 -17.94 65.04 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 -177.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.481 ' OE1' ' HB3' ' A' ' 59' ' ' ASN . 1.4 mp0 -85.78 -17.66 35.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.021 0.438 . . . . 0.0 110.519 174.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.03 11.55 83.89 Favored Glycine 0 C--O 1.227 -0.311 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.542 -177.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.4 p -77.37 -36.7 53.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.884 0.373 . . . . 0.0 111.808 -177.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.7 mtt180 -123.07 144.22 49.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.095 0.474 . . . . 0.0 110.857 175.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.958 ' HB2' ' HB2' ' A' ' 84' ' ' PHE . 22.8 m95 -118.89 150.33 40.05 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.196 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -154.12 150.61 28.34 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 174.27 -165.1 36.5 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.297 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -138.29 142.3 39.8 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.446 ' SG ' HD12 ' A' ' 82' ' ' ILE . 78.1 m -115.9 129.63 56.49 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.065 177.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.624 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 28.9 m-90 -100.5 125.85 46.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.949 0.404 . . . . 0.0 109.963 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 38.5 t80 -117.37 120.32 37.81 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.131 0.491 . . . . 0.0 110.367 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 50.8 mm -94.9 118.44 41.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.7 178.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.418 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 10.2 t60 -141.56 121.43 13.57 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.69 41.49 15.01 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.465 0.65 . . . . 0.0 110.156 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.8 mt 71.92 -4.89 1.83 Allowed 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.214 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.7 mt -91.95 144.6 25.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.666 0.27 . . . . 0.0 110.762 -177.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.589 ' HB2' ' HZ1' ' A' ' 77' ' ' LYS . 3.8 ttmp? -109.34 117.42 34.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.508 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -130.28 128.68 42.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.782 0.325 . . . . 0.0 110.14 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.624 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 9.6 pt-20 -102.29 145.24 29.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.158 -177.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -123.48 135.78 54.24 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.874 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -92.14 129.82 38.0 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.803 -178.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.505 HG22 HG21 ' A' ' 99' ' ' VAL . 42.5 pt -126.78 149.58 31.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.734 -174.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -131.15 163.44 27.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.981 174.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.958 ' HB2' ' HB2' ' A' ' 65' ' ' TRP . 44.9 m-85 -150.11 148.66 29.25 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.854 -179.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -129.85 148.13 51.69 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 169.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.454 HG22 ' CZ2' ' A' ' 28' ' ' TRP . 47.9 mm -109.68 91.7 10.94 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -172.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 15.0 Cg_endo -56.19 159.02 13.48 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.533 2.155 . . . . 0.0 111.715 174.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.51 HG22 ' HD2' ' A' ' 23' ' ' ARG . 23.3 mm -71.99 -14.58 17.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.373 0.606 . . . . 0.0 110.702 -175.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.2 p -89.69 1.98 55.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.634 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.626 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 65.6 t80 -80.62 146.87 61.73 Favored Pre-proline 0 C--N 1.328 -0.336 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 176.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.626 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 85.1 Cg_endo -95.18 16.41 39.24 Favored 'Cis proline' 0 C--N 1.351 0.671 0 C-N-CA 124.519 -1.034 . . . . 0.0 113.608 1.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -64.04 -37.06 86.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.591 0.71 . . . . 0.0 109.586 176.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.4 m -111.16 124.73 52.78 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.799 176.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -71.58 144.43 88.73 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.811 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -89.48 -164.44 0.16 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.907 2.405 . . . . 0.0 112.04 177.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -123.89 127.15 47.59 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.595 HG12 ' CZ ' ' A' ' 84' ' ' PHE . 47.6 mt -66.05 115.76 4.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -89.54 112.38 23.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.026 -176.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.505 HG21 HG22 ' A' ' 82' ' ' ILE . 34.0 t -125.28 85.34 58.45 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.804 176.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -73.58 -9.62 22.91 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.795 2.33 . . . . 0.0 112.59 -175.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -73.68 -43.13 60.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.398 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.4 ' O ' HG23 ' A' ' 106' ' ' THR . 90.3 mt -82.36 -30.19 30.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.836 -178.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.488 ' HB2' ' HA2' ' A' ' 113' ' ' GLY . 16.6 t70 -53.66 124.91 16.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.949 178.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 106.37 -27.25 17.55 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.214 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.773 ' HG2' HG13 ' A' ' 158' ' ' VAL . 10.5 mptt -101.25 -42.4 6.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.016 0.436 . . . . 0.0 110.424 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.543 ' HB ' HD21 ' A' ' 153' ' ' LEU . 5.7 t . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.386 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . 0.488 ' HA2' ' HB2' ' A' ' 103' ' ' ASP . . . . . . . . 0 N--CA 1.448 -0.52 0 CA-C-O 120.408 -0.106 . . . . 0.0 113.014 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.16 136.91 43.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.901 0.381 . . . . 0.0 111.056 -178.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 43.4 pt -69.19 162.18 3.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.878 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 53.1 t -113.63 105.32 13.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.847 0.356 . . . . 0.0 110.345 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.1 mt -93.74 -178.33 4.65 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.842 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.8 t -85.14 158.81 20.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.002 -176.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -75.32 -12.88 60.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.069 0.462 . . . . 0.0 110.741 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 61.1 m-70 -80.79 -12.26 59.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.264 0.554 . . . . 0.0 110.201 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -70.75 -45.18 65.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.346 -172.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.442 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 14.7 mmmm -60.53 -52.23 74.26 Favored Pre-proline 0 C--O 1.236 0.392 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -175.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.442 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 26.5 Cg_endo -63.85 -31.87 67.31 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 121.769 1.646 . . . . 0.0 112.205 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 47.4 tp -66.1 -45.09 82.42 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.9 0.381 . . . . 0.0 110.171 177.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 41.8 t-105 -56.88 -49.3 75.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.482 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.14 -21.85 65.81 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.727 -176.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -84.64 -35.16 22.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.125 0.488 . . . . 0.0 110.3 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -73.85 -42.43 60.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.076 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.482 HG11 ' HA ' ' A' ' 130' ' ' PRO . 98.7 t -60.28 141.07 91.25 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.482 ' HA ' HG11 ' A' ' 129' ' ' VAL . 65.6 Cg_endo -84.29 -159.47 1.82 Allowed 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 124.909 -0.871 . . . . 0.0 114.061 6.49 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.576 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 73.7 mmtt 71.36 11.25 6.7 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.631 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -94.65 163.27 13.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.208 0.528 . . . . 0.0 111.742 -171.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -159.43 162.63 32.98 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.064 -0.814 . . . . 0.0 111.064 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.7 tp -60.39 -29.14 68.75 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -173.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.13 -39.12 66.19 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.187 0.518 . . . . 0.0 111.781 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.0 m80 -71.47 -32.48 68.34 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.95 -178.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 49.3 tp -63.28 -44.05 96.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 110.746 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' MET . . . . . 0.534 ' HE3' HD12 ' A' ' 56' ' ' LEU . 14.4 mmt -64.11 -52.69 57.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.512 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.08 -34.16 77.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.548 -175.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.1 mt -98.39 -17.9 18.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -174.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -111.72 -64.04 0.49 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.981 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.457 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 38.5 tp -63.16 -41.31 99.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 -171.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.95 -61.79 6.98 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.084 -179.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -58.74 -28.69 87.46 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.766 2.311 . . . . 0.0 112.908 177.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 64.7 t90 -72.05 -45.64 60.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.052 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.462 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 96.7 mt -60.16 -34.99 74.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.079 0.466 . . . . 0.0 111.16 -178.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.23 -2.81 20.29 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.989 -176.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 60.5 t -92.82 -55.28 6.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -109.82 -12.49 14.59 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -170.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.582 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 1.4 mp -55.58 -45.52 99.86 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.689 178.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.582 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 11.0 Cg_endo -55.77 -32.36 84.07 Favored 'Trans proline' 0 C--N 1.357 1.02 0 C-N-CA 122.026 1.817 . . . . 0.0 112.73 174.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.597 ' HA ' ' HG2' ' A' ' 155' ' ' GLN . 31.6 t70 -71.29 -36.48 71.68 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 120.589 0.233 . . . . 0.0 110.645 -179.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.543 HD21 ' HB ' ' A' ' 106' ' ' THR . 4.3 mm? -65.7 -31.63 72.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.9 0.381 . . . . 0.0 110.362 176.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 66.0 mt -72.51 -47.11 53.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.616 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.597 ' HG2' ' HA ' ' A' ' 152' ' ' ASP . 13.3 pt20 -71.16 -20.84 62.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.805 0.336 . . . . 0.0 110.723 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -72.68 -32.39 65.77 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.105 0.479 . . . . 0.0 109.762 175.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 99.58 10.08 48.29 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.176 177.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . 0.773 HG13 ' HG2' ' A' ' 105' ' ' LYS . 42.1 t -91.62 -14.06 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.356 0.598 . . . . 0.0 110.485 -178.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 37.4 mm . . . . . 0 C--N 1.323 -0.548 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.139 176.681 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.487 ' O ' HG21 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 120.813 0.34 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.436 ' O ' HG21 ' A' ' 10' ' ' VAL . 7.4 m -58.53 -50.38 73.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.979 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -72.92 -25.28 60.99 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.042 -0.263 . . . . 0.0 111.136 -177.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -69.98 -43.74 70.83 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.487 HG21 ' O ' ' A' ' 5' ' ' ALA . 73.8 t -58.37 -44.99 89.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.613 177.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.436 HG21 ' O ' ' A' ' 6' ' ' THR . 50.5 t -67.04 -24.21 31.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.183 0.516 . . . . 0.0 110.815 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t -80.01 -43.1 22.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.657 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.582 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 42.5 mt-10 -75.45 -27.27 58.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.844 0.354 . . . . 0.0 110.94 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 47.9 mt -104.92 89.19 2.73 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.235 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.582 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 33.1 Cg_exo -59.23 165.06 9.55 Favored 'Trans proline' 0 N--CA 1.475 0.385 0 C-N-CA 123.538 2.826 . . . . 0.0 113.811 -173.102 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.454 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 30.3 m -83.59 162.42 3.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.166 178.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.563 HD22 ' HB2' ' A' ' 35' ' ' GLU . 7.0 mp -93.44 134.55 35.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.407 177.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -36.61 74.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.702 0.287 . . . . 0.0 111.293 -176.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.445 ' O ' ' HG3' ' A' ' 31' ' ' ARG . 6.2 p -107.61 139.67 41.8 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.725 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -132.56 77.11 1.73 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.409 0.623 . . . . 0.0 109.547 176.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -115.86 174.68 5.9 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.276 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.29 -179.69 23.15 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.331 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -69.29 2.39 3.31 Favored 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 123.015 2.477 . . . . 0.0 112.847 -178.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.405 ' HD2' HG23 ' A' ' 88' ' ' ILE . 26.3 mtp-105 -74.76 -44.68 48.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.617 0.722 . . . . 0.0 109.775 176.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.514 ' HB3' HD23 ' A' ' 27' ' ' LEU . 11.8 m-20 -94.62 101.54 13.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.653 -1.158 . . . . 0.0 109.925 -174.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.555 ' O ' HG23 ' A' ' 29' ' ' VAL . 60.2 mtm180 -57.63 -52.84 63.76 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -170.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.6 -41.6 92.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.049 0.452 . . . . 0.0 110.902 -175.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.514 HD23 ' HB3' ' A' ' 24' ' ' ASP . 3.3 mm? -67.63 -34.46 77.02 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.976 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.575 ' CH2' HG22 ' A' ' 86' ' ' ILE . 76.4 t-105 -67.66 -43.35 80.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.406 177.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 25' ' ' ARG . 84.1 t -61.09 -47.21 94.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 O-C-N 123.186 0.304 . . . . 0.0 111.501 -178.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.496 ' HA ' ' HG2' ' A' ' 33' ' ' LYS . 3.8 pt20 -72.03 -32.49 67.17 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.72 -178.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.445 ' HG3' ' O ' ' A' ' 18' ' ' THR . 18.8 ttp85 -66.22 -39.8 89.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.55 0.691 . . . . 0.0 109.301 174.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -63.69 -47.69 80.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.192 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.496 ' HG2' ' HA ' ' A' ' 30' ' ' GLN . 19.4 ptpt -64.38 -38.42 90.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.672 0.272 . . . . 0.0 111.204 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 12.7 mm-40 -69.54 -32.52 71.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.018 0.437 . . . . 0.0 110.366 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.563 ' HB2' HD22 ' A' ' 16' ' ' LEU . 37.6 tt0 -70.59 -35.98 73.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.435 176.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.422 ' O ' HG13 ' A' ' 40' ' ' ILE . 4.5 m-30 -59.71 -49.14 78.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.74 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -59.4 -41.46 89.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.943 0.401 . . . . 0.0 110.602 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.5 t -58.33 -44.8 88.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.346 177.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.449 ' O ' HG21 ' A' ' 43' ' ' VAL . 88.1 mt -64.16 -52.64 58.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.274 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 36' ' ' TYR . 86.3 mt -54.58 -41.45 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.473 -176.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -56.8 -45.98 81.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.938 0.399 . . . . 0.0 110.85 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -73.56 -35.71 65.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.672 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.449 HG21 ' O ' ' A' ' 39' ' ' LEU . 80.9 t -62.68 -45.95 97.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.993 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -34.27 75.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.193 -179.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -60.88 -44.43 97.09 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 174.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.52 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 62.0 m-20 -63.55 -36.97 85.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.837 177.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -60.97 -49.68 76.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.727 0.299 . . . . 0.0 110.712 177.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.97 -41.06 95.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.264 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -86.09 5.9 31.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.757 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 56.03 33.2 21.38 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 122.127 0.965 . . . . 0.0 109.816 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -117.66 24.85 10.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.068 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.52 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 29.9 t70 -67.5 100.14 0.83 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.973 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 58.5 p-90 -114.33 2.93 14.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.282 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -162.29 169.6 20.37 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.554 -178.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -160.99 124.33 3.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.3 168.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.486 HD12 ' HA3' ' A' ' 67' ' ' GLY . 3.4 mm? -90.24 123.99 34.5 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.304 -178.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -110.22 147.17 34.3 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 176.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.7 p -128.94 157.1 42.58 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 120.981 0.419 . . . . 0.0 111.31 -171.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -79.31 168.56 19.36 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 172.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -57.1 -49.33 76.23 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -174.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -68.76 -19.54 64.33 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.849 0.357 . . . . 0.0 111.551 178.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.43 16.49 80.32 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.774 -174.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.5 p -88.46 -39.55 14.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.171 0.51 . . . . 0.0 111.078 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -101.57 128.46 47.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.075 174.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 54.9 m95 -116.04 145.15 43.23 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.011 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -152.36 86.06 1.28 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.688 0.756 . . . . 0.0 109.674 -177.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.486 ' HA3' HD12 ' A' ' 56' ' ' LEU . . . -104.8 146.55 16.14 Favored Glycine 0 N--CA 1.439 -1.104 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.074 -176.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 81' ' ' ASP . 1.5 ptpp? -100.18 130.93 46.37 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 54.8 m -131.48 127.99 38.47 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.089 -177.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.717 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 8.2 p90 -119.32 138.51 52.99 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.07 0.462 . . . . 0.0 110.948 -177.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -117.54 120.45 38.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.786 -178.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.438 HD11 ' N ' ' A' ' 72' ' ' ILE . 4.1 mp -91.39 121.03 41.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.996 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -147.97 124.6 11.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.011 175.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.1 t70 59.95 50.13 7.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.034 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.4 mt 74.46 -33.43 0.25 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 114.767 -1.106 . . . . 0.0 112.642 178.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 51.1 mt -76.0 139.61 41.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.038 0.447 . . . . 0.0 111.548 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -121.38 106.86 11.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.966 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.404 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 79.9 m-85 -96.26 121.53 38.15 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.255 178.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.717 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 0.0 OUTLIER -108.38 135.83 49.03 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.418 0.628 . . . . 0.0 111.208 -179.903 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -128.41 120.25 26.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.158 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.403 ' HA ' ' HA ' ' A' ' 68' ' ' LYS . 2.4 m-20 -78.24 119.12 21.17 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 171.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.4 pt -114.46 130.31 69.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.337 0.589 . . . . 0.0 110.416 -179.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -120.06 149.4 42.24 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.538 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.576 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 45.7 p90 -158.14 162.8 37.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.338 0.589 . . . . 0.0 110.934 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -106.64 154.78 20.43 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.176 -177.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.575 HG22 ' CH2' ' A' ' 28' ' ' TRP . 43.7 mm -104.19 90.46 3.13 Favored Pre-proline 0 C--N 1.324 -0.517 0 C-N-CA 122.734 0.413 . . . . 0.0 110.676 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -70.99 175.9 8.46 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.797 2.332 . . . . 0.0 112.182 -177.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.405 HG23 ' HD2' ' A' ' 23' ' ' ARG . 51.6 mm -68.47 -22.66 27.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.147 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.63 -13.74 61.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.219 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.542 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 63.5 t80 -87.47 143.75 34.61 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.542 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 23.0 Cg_endo -96.34 26.17 20.36 Favored 'Cis proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.825 -0.906 . . . . 0.0 112.883 0.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.1 m -69.57 -34.99 74.95 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.528 0.68 . . . . 0.0 110.129 178.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -131.32 145.64 51.95 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.16 175.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.12 144.3 99.02 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.437 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -80.61 161.08 22.03 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.79 2.327 . . . . 0.0 112.342 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -93.17 101.56 13.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.24 0.543 . . . . 0.0 110.537 -177.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.576 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 63.2 mt -72.38 136.72 25.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.783 -177.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -102.28 116.66 33.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.788 0.328 . . . . 0.0 110.864 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.428 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 5.8 p -124.04 87.74 53.05 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-O 121.889 0.852 . . . . 0.0 110.659 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' A' ' 99' ' ' VAL . 18.8 Cg_endo -59.97 -36.35 90.3 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 123.287 2.658 . . . . 0.0 114.056 -172.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -82.65 17.87 1.7 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -171.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.453 ' O ' HG21 ' A' ' 106' ' ' THR . 42.3 mt -106.09 -15.69 14.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.274 0.559 . . . . 0.0 109.751 169.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.68 144.01 54.57 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.101 -176.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 77.74 -8.64 34.5 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.601 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.9 mtmm -117.22 -48.92 2.61 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.71 -0.288 . . . . 0.0 111.473 -176.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.453 HG21 ' O ' ' A' ' 102' ' ' LEU . 14.1 t . . . . . 0 C--N 1.326 -0.455 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.219 0 N-CA-C 112.767 -0.133 . . . . 0.0 112.767 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -141.44 -171.9 3.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.408 HD11 ' HB ' ' A' ' 97' ' ' ILE . 46.3 pt -123.7 152.36 28.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.891 0.377 . . . . 0.0 111.115 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.8 t -112.09 111.06 21.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.473 173.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.35 165.32 20.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.604 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 2.7 m -55.1 133.67 48.96 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.856 179.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -56.91 -49.42 75.62 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -172.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -79.03 -15.43 58.25 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.991 -0.284 . . . . 0.0 111.703 -177.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -71.37 -33.69 69.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.134 0.493 . . . . 0.0 110.145 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.576 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 54.0 mtpt -59.88 -51.22 82.28 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.427 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.576 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 25.9 Cg_exo -64.63 -35.62 46.33 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.761 1.641 . . . . 0.0 111.862 171.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.5 tp -59.6 -37.34 78.3 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.881 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.498 ' O ' HG22 ' A' ' 129' ' ' VAL . 48.0 t-105 -54.83 -50.44 68.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.417 176.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.21 -18.31 65.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.708 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -83.78 -20.4 33.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.005 0.431 . . . . 0.0 110.894 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -104.07 10.1 36.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.797 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.498 HG22 ' O ' ' A' ' 125' ' ' TRP . 94.9 t -93.79 139.69 22.79 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 174.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.463 ' HA ' HG13 ' A' ' 129' ' ' VAL . 69.5 Cg_endo -95.98 -154.7 0.35 Allowed 'Cis proline' 0 N--CA 1.456 -0.677 0 C-N-CA 124.165 -1.181 . . . . 0.0 113.49 1.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.454 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 54.8 mtmt 71.99 12.06 6.07 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.834 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -90.51 177.44 6.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.073 176.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -169.35 172.56 43.52 Favored Glycine 0 C--O 1.236 0.236 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.243 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.651 HD11 ' HE1' ' A' ' 138' ' ' MET . 45.1 tp -60.41 -36.15 77.46 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.815 0.446 . . . . 0.0 111.66 -175.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.52 -41.78 73.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.29 0.567 . . . . 0.0 111.124 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -71.84 -34.86 69.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.536 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 69.3 tp -67.3 -41.14 85.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.19 -178.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' MET . . . . . 0.651 ' HE1' HD11 ' A' ' 134' ' ' LEU . 24.7 mmt -69.05 -40.68 78.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.82 0.343 . . . . 0.0 111.017 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.07 -47.37 62.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.766 -177.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 86.9 mt -84.34 -29.1 26.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.005 0.431 . . . . 0.0 111.419 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' A' ' 145' ' ' TRP . . . -96.41 -77.93 1.38 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.852 -0.689 . . . . 0.0 113.092 -176.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.8 tp -55.07 -47.92 74.22 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -170.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.6 -63.15 5.48 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.995 -0.621 . . . . 0.0 113.522 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.6 -27.31 53.4 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.42 2.08 . . . . 0.0 112.085 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . 0.407 ' HB2' ' O ' ' A' ' 141' ' ' GLY . 56.6 t90 -62.2 -45.05 95.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.74 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 96.4 mt -67.37 -34.18 76.75 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.132 0.492 . . . . 0.0 110.549 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.97 -5.05 36.08 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.954 -176.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 84.7 t -70.26 -55.13 15.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . 0.501 ' O ' HD21 ' A' ' 153' ' ' LEU . 0.0 OUTLIER -135.08 -12.82 2.16 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.709 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.546 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 32.1 mm -55.76 -50.66 85.83 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-N 118.059 0.39 . . . . 0.0 111.836 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.546 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.3 Cg_endo -53.58 -34.75 74.36 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 122.203 1.935 . . . . 0.0 112.533 177.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -78.22 -39.31 40.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.771 -177.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.501 HD21 ' O ' ' A' ' 149' ' ' GLU . 4.0 mm? -58.35 -37.78 75.87 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.705 177.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 71.7 mt -63.02 -47.19 93.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.685 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 151' ' ' PRO . 22.3 mt-30 -68.46 -27.92 66.58 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.774 -178.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -63.85 -27.43 69.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.432 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 87.13 6.24 79.06 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.846 176.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.9 p -78.45 -26.61 14.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.294 0.569 . . . . 0.0 110.386 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 54.7 mt . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.0 177.199 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.433 ' O ' HG22 ' A' ' 9' ' ' VAL . . . . . . . . 0 CA--C 1.528 0.102 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.2 m -59.78 -55.44 34.21 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.095 0.474 . . . . 0.0 111.297 -175.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.99 -22.04 64.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.292 -177.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.443 HH11 ' HD2' ' A' ' 8' ' ' ARG . 21.6 ttt180 -71.16 -39.23 72.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.377 178.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.433 HG22 ' O ' ' A' ' 5' ' ' ALA . 99.4 t -63.73 -43.37 97.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.196 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.9 t -60.32 -39.13 79.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.398 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.3 m -61.86 -37.78 85.78 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -177.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -88.11 8.58 26.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.836 0.351 . . . . 0.0 111.475 -177.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 54.1 mt -121.87 86.93 46.35 Favored Pre-proline 0 C--O 1.237 0.404 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 172.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -48.85 146.29 11.88 Favored 'Trans proline' 0 C--O 1.238 0.484 0 C-N-CA 123.674 2.916 . . . . 0.0 114.047 -173.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.428 ' HB ' ' O ' ' A' ' 131' ' ' LYS . 33.0 m -81.04 162.79 3.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.611 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.753 HD21 ' HB2' ' A' ' 35' ' ' GLU . 10.0 mp -96.19 146.15 24.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.814 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -75.03 -39.54 60.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.41 -176.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.557 HG22 HD11 ' A' ' 27' ' ' LEU . 62.8 m -124.02 128.48 49.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.735 -173.196 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -91.71 118.36 30.59 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 173.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -161.2 156.75 24.67 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.578 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.29 -164.55 15.85 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.65 177.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.91 5.69 2.86 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.78 2.32 . . . . 0.0 113.232 -176.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 51.6 mtm180 -70.74 -62.67 1.3 Allowed 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -84.33 97.87 9.7 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.656 HH22 ' HG2' ' A' ' 61' ' ' GLU . 15.1 mtp180 -63.26 -33.2 74.99 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.213 -173.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -70.93 -50.73 31.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.558 0.218 . . . . 0.0 111.034 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.557 HD11 HG22 ' A' ' 18' ' ' THR . 4.3 mm? -66.91 -28.74 68.55 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.218 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.569 ' CH2' HG22 ' A' ' 86' ' ' ILE . 72.0 t-105 -60.53 -45.48 93.7 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.889 172.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.549 HG22 ' O ' ' A' ' 25' ' ' ARG . 70.2 t -61.07 -42.9 94.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.231 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.416 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 12.1 mt-30 -58.19 -53.92 52.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.388 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -67.34 -28.75 68.23 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.737 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.4 tp -62.59 -46.56 87.76 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 8.4 mtpm? -56.46 -58.81 6.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.056 176.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 18.3 mm-40 -62.13 -39.31 92.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.523 -174.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.753 ' HB2' HD21 ' A' ' 16' ' ' LEU . 39.6 tt0 -67.36 -38.29 84.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.389 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.542 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.1 m-85 -64.17 -30.45 71.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.527 176.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 90.2 mm-40 -68.3 -42.59 79.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.141 176.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.3 m -61.23 -39.72 91.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.984 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.496 HD11 ' HA ' ' A' ' 36' ' ' TYR . 76.6 mt -60.66 -49.35 77.85 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.884 177.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.542 HG13 ' O ' ' A' ' 36' ' ' TYR . 84.3 mt -51.98 -44.7 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 120.79 0.329 . . . . 0.0 110.603 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.514 ' O ' ' HB2' ' A' ' 45' ' ' ASN . 18.6 tpt180 -58.71 -51.18 71.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.222 177.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -66.62 -42.93 86.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.648 0.261 . . . . 0.0 111.066 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 94.8 t -61.83 -47.85 91.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.548 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -63.57 -42.86 98.29 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.528 0.68 . . . . 0.0 109.705 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.514 ' HB2' ' O ' ' A' ' 41' ' ' ARG . 1.0 OUTLIER -53.77 -49.29 68.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.398 178.202 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -69.7 -43.25 72.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.439 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -66.49 -43.84 84.28 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -177.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -70.98 -23.85 62.29 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.987 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.52 8.41 7.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.732 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.4 t0 62.77 41.39 9.03 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.597 0.713 . . . . 0.0 110.515 177.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -141.52 87.44 2.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.508 174.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -101.46 101.81 12.48 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.542 ' HA ' ' CD1' ' A' ' 70' ' ' TRP . 52.6 p-90 -123.72 -1.37 8.46 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -173.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -154.21 158.16 39.88 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.96 -172.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.89 130.34 2.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.977 168.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.3 tp -124.53 131.47 53.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.427 -173.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -126.26 175.95 7.44 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.949 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.0 m -154.46 166.96 31.62 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.729 0.299 . . . . 0.0 110.826 -178.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -79.54 172.37 13.88 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 169.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -64.31 -26.04 68.31 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -174.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.656 ' HG2' HH22 ' A' ' 25' ' ' ARG . 37.4 mt-10 -80.25 -23.53 40.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.87 0.367 . . . . 0.0 110.834 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.69 17.91 73.48 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.962 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -86.11 -6.54 58.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.227 0.536 . . . . 0.0 110.969 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 50.5 mtm180 -142.0 120.77 12.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.469 176.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 24.9 m95 -106.11 130.06 54.08 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -146.45 137.76 24.45 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.274 0.559 . . . . 0.0 110.527 -175.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.93 -152.63 6.77 Favored Glycine 0 N--CA 1.442 -0.933 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.158 -178.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.697 ' HD3' ' CZ3' ' A' ' 70' ' ' TRP . 34.9 tttp -143.02 143.16 31.78 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -177.206 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.6 p -144.84 148.42 33.96 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.697 ' CZ3' ' HD3' ' A' ' 68' ' ' LYS . 0.7 OUTLIER -138.29 151.38 47.54 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.939 0.4 . . . . 0.0 110.902 179.119 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -117.71 138.09 52.25 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.383 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.2 mm -107.22 123.99 62.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.186 -176.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -159.5 123.17 3.73 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.393 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 57.26 55.55 5.79 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.809 0.693 . . . . 0.0 112.057 177.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 69.46 1.64 3.4 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.789 175.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 76.8 mt -107.18 138.14 43.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.085 0.469 . . . . 0.0 111.509 -174.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.1 ttmm -119.57 109.0 15.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.246 175.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -107.04 116.0 31.16 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.599 ' HB2' ' HE3' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -105.29 144.97 31.33 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.253 0.549 . . . . 0.0 111.519 -177.215 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -135.04 151.09 50.46 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.335 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.71 118.66 37.12 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.0 pt -113.31 147.04 17.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.63 0 CA-C-O 121.109 0.481 . . . . 0.0 111.187 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -150.69 153.06 34.9 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.242 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.567 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 39.1 p90 -158.27 155.46 28.92 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.406 176.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.475 ' O ' ' HB3' ' A' ' 95' ' ' PRO . 7.8 p-10 -95.06 156.86 16.14 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.015 -176.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.569 HG22 ' CH2' ' A' ' 28' ' ' TRP . 46.8 mm -109.76 90.43 9.07 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.988 175.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 11.7 Cg_endo -53.62 155.31 13.8 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.932 2.421 . . . . 0.0 112.751 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 39.6 mm -67.75 -21.12 26.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.515 0.674 . . . . 0.0 110.031 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.1 p -85.71 10.55 13.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.89 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.557 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 51.6 t80 -72.64 145.54 87.37 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.557 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 95.3 Cg_endo -94.75 11.99 46.46 Favored 'Cis proline' 0 C--N 1.35 0.608 0 C-N-CA 124.318 -1.117 . . . . 0.0 113.328 -0.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 23.7 m -62.75 -31.22 72.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.488 0.661 . . . . 0.0 110.304 178.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 32.0 m -114.01 134.18 55.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.016 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.49 145.05 78.65 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.454 -178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.475 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 19.3 Cg_exo -66.7 151.79 81.92 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.156 2.57 . . . . 0.0 112.395 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -93.34 100.48 12.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.353 -178.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.567 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.4 mt -71.97 121.67 22.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.815 -178.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -118.71 125.47 49.74 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.106 0.479 . . . . 0.0 111.114 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 24.3 t -118.32 87.2 29.44 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.428 175.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.74 -25.21 74.9 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 123.288 2.659 . . . . 0.0 113.761 -172.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.03 -17.86 60.92 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.88 -43.59 95.61 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 38.6 t70 55.06 26.35 8.04 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.825 0.703 . . . . 0.0 112.127 170.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 68.56 16.1 69.28 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.961 -0.637 . . . . 0.0 113.045 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.528 ' HZ2' ' HB2' ' A' ' 105' ' ' LYS . 4.6 ttmp? -76.16 -18.03 59.29 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.001 0.429 . . . . 0.0 110.783 -178.059 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.415 ' OG1' HD13 ' A' ' 153' ' ' LEU . 2.9 t . . . . . 0 CA--C 1.542 0.635 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.982 -177.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.613 0 N-CA-C 112.215 -0.354 . . . . 0.0 112.215 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.1 mtpp -76.73 120.81 22.42 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.6 pt -75.64 155.15 6.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.959 0.409 . . . . 0.0 110.811 -178.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 7.9 p -97.54 114.85 26.83 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.009 -178.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.8 mt -100.12 142.56 31.43 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 174.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.5 t -71.1 156.31 39.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.075 0.464 . . . . 0.0 111.261 -176.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -66.48 -42.93 86.76 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -172.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.435 ' C ' ' HD2' ' A' ' 123' ' ' PRO . 12.6 m-70 -62.25 -14.68 40.92 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -178.224 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -66.87 -33.92 76.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.952 0.406 . . . . 0.0 110.141 176.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.593 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 37.9 mtpt -62.7 -52.39 65.04 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.073 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.593 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 31.2 Cg_exo -59.74 -35.56 94.17 Favored 'Trans proline' 0 C--N 1.359 1.096 0 C-N-CA 121.697 1.598 . . . . 0.0 112.028 173.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 59.1 tp -63.55 -44.54 93.89 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.551 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.4 ' O ' HG21 ' A' ' 129' ' ' VAL . 47.3 t-105 -57.94 -57.46 12.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.894 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.72 -29.96 71.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.719 -176.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 13.3 ttm180 -64.53 -30.94 71.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.221 -178.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -102.14 16.48 25.98 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.336 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.4 HG21 ' O ' ' A' ' 125' ' ' TRP . 93.9 t -106.49 134.46 19.79 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 172.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -83.27 -162.77 2.93 Favored 'Cis proline' 0 C--N 1.347 0.45 0 C-N-CA 124.208 -1.164 . . . . 0.0 114.001 3.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.428 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 68.1 mttm 74.67 7.73 4.39 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.441 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -89.99 175.47 7.17 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 177.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -164.9 155.37 26.73 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.107 -177.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.423 HD22 ' CE2' ' A' ' 84' ' ' PHE . 43.3 tp -65.4 -30.98 71.85 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 122.78 0.432 . . . . 0.0 111.068 -175.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.428 ' O ' ' HG2' ' A' ' 138' ' ' MET . . . -56.81 -33.02 66.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.411 0.624 . . . . 0.0 110.936 176.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -71.46 -32.25 68.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.367 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.6 tp -67.44 -40.13 85.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.258 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 135' ' ' ALA . 23.5 ptp -72.09 -36.54 69.52 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.866 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -75.07 -45.69 39.71 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 88.6 mt -93.97 -23.72 17.94 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -174.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -101.17 -65.83 0.79 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.851 -177.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.6 tp -59.26 -57.14 14.33 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -173.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.82 -61.98 6.32 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-N 116.156 -0.475 . . . . 0.0 113.819 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . 0.419 ' O ' HG22 ' A' ' 148' ' ' VAL . 53.2 Cg_exo -57.29 -35.07 98.85 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.717 2.278 . . . . 0.0 113.137 -179.011 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 45.9 t90 -64.31 -49.58 71.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.058 0.456 . . . . 0.0 109.917 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.39 -32.31 73.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.8 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.22 -12.57 60.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.993 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . 0.419 HG22 ' O ' ' A' ' 144' ' ' PRO . 67.2 t -88.57 -56.14 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.672 0.272 . . . . 0.0 110.916 178.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . 0.517 ' O ' ' HG ' ' A' ' 153' ' ' LEU . 7.7 mm-40 -80.49 -52.79 7.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -173.24 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.588 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 48.9 mm -55.21 -54.46 50.34 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -170.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.588 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 31.6 Cg_exo -60.4 -33.76 93.89 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.99 1.793 . . . . 0.0 112.314 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -75.03 -43.49 53.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.331 -177.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 149' ' ' GLU . 23.3 mt -56.98 -34.58 68.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.247 178.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 150' ' ' ILE . 73.0 mt -62.59 -49.59 83.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.552 177.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -68.96 -34.43 75.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.489 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -73.83 -16.95 61.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.879 0.371 . . . . 0.0 111.054 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.14 24.62 47.45 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.215 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 51.4 t -83.17 -33.29 10.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.557 0.694 . . . . 0.0 109.294 178.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 72.8 mt . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.241 174.021 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.326 0 CA-C-O 121.059 0.457 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.421 ' O ' HG22 ' A' ' 10' ' ' VAL . 22.6 m -62.76 -46.25 88.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.182 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -66.77 -29.68 69.69 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.117 -176.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.5 ttm180 -62.6 -47.98 81.41 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.425 ' O ' HG13 ' A' ' 13' ' ' ILE . 58.5 t -57.34 -46.36 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.721 178.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.421 HG22 ' O ' ' A' ' 6' ' ' THR . 67.5 t -60.16 -36.9 70.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.183 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.4 m -76.08 -37.99 57.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.73 -176.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -82.37 8.58 11.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.201 0.524 . . . . 0.0 110.593 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.464 HG12 ' HB2' ' A' ' 42' ' ' TYR . 71.1 mt -114.2 89.56 17.66 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.387 171.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -40.04 143.04 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.268 3.312 . . . . 0.0 114.202 -175.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 m -83.23 162.85 3.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.732 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.813 HD22 ' HB3' ' A' ' 35' ' ' GLU . 6.8 mp -95.96 134.77 38.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.68 -177.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -86.32 -30.84 21.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.275 0.559 . . . . 0.0 109.868 174.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 27.5 m -96.83 125.89 41.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.29 -176.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -132.04 104.2 6.69 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.129 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -149.76 173.65 13.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.019 -178.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.94 166.16 17.75 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.112 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -66.86 -1.87 6.77 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 123.322 2.682 . . . . 0.0 113.327 -177.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -72.48 -18.23 61.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.583 0.23 . . . . 0.0 111.471 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -116.6 112.19 20.94 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 175.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 29' ' ' VAL . 48.8 mtt180 -58.57 -51.48 69.71 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -173.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -72.62 -35.89 67.94 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.379 -0.528 . . . . 0.0 111.667 -173.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.05 -34.32 75.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.991 0.424 . . . . 0.0 110.207 174.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.417 ' O ' HD22 ' A' ' 32' ' ' LEU . 44.9 t-105 -66.01 -48.08 72.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.878 176.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 25' ' ' ARG . 80.0 t -63.2 -35.95 74.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 178.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.512 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 5.9 tt0 -66.94 -39.05 87.21 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.925 178.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.489 HH12 ' HG3' ' A' ' 91' ' ' PRO . 25.2 ttt85 -68.61 -38.28 80.45 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.17 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.59 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 1.7 mm? -52.68 -51.97 57.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.476 176.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 18.7 ptpt -67.52 -25.53 65.88 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.621 0.248 . . . . 0.0 111.132 -179.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 28.3 mm-40 -64.47 -62.53 1.54 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.766 175.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.813 ' HB3' HD22 ' A' ' 16' ' ' LEU . 12.1 pt-20 -73.1 -26.02 61.09 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.332 -177.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.59 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -52.42 -45.81 66.1 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 169.092 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.3 mm-40 -61.01 -42.4 98.37 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.524 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.8 m -59.03 -45.04 91.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.445 176.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.428 ' O ' HG23 ' A' ' 43' ' ' VAL . 77.7 mt -60.47 -55.45 33.36 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.798 178.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 79.9 mt -60.26 -39.24 80.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.049 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 41' ' ' ARG . 6.9 tpp85 -66.69 -41.22 88.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.647 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.464 ' HB2' HG12 ' A' ' 13' ' ' ILE . 86.5 t80 -66.27 -44.77 82.66 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.091 177.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 39' ' ' LEU . 92.3 t -59.76 -38.62 76.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.329 176.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -57.13 -59.87 4.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.263 0.554 . . . . 0.0 110.061 176.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -58.8 -35.49 72.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.356 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -68.45 -46.1 70.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.461 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -67.29 -28.52 68.08 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.148 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -67.64 -14.28 62.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.89 0.376 . . . . 0.0 110.89 177.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -101.34 14.88 30.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.216 174.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.6 t70 70.54 5.83 5.55 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.504 0.721 . . . . 0.0 111.487 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.503 ' OD1' ' HD1' ' A' ' 53' ' ' TRP . 23.7 t-20 -102.28 142.37 33.62 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.862 -0.524 . . . . 0.0 110.984 -176.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -158.09 111.43 2.44 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.503 ' HD1' ' OD1' ' A' ' 51' ' ' ASN . 56.1 p-90 -130.04 -3.03 4.55 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -172.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -152.42 156.52 39.67 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.072 -0.651 . . . . 0.0 111.67 -174.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -161.92 126.79 3.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.565 171.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.514 HD12 ' HA3' ' A' ' 67' ' ' GLY . 3.8 mm? -100.54 130.38 46.6 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.242 -174.5 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -120.83 160.41 23.47 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 172.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 p -154.34 174.9 14.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 120.964 0.411 . . . . 0.0 111.163 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -83.04 170.73 14.54 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 172.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -65.65 -24.89 67.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.681 0.276 . . . . 0.0 111.544 -176.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -71.4 -24.72 62.11 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.805 0.336 . . . . 0.0 110.686 176.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.67 23.53 77.91 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.539 -0.625 . . . . 0.0 111.539 -176.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.2 p -95.2 -39.23 10.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.139 0.495 . . . . 0.0 111.397 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.1 mmt-85 -110.12 116.82 32.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.25 177.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 39.1 m95 -110.34 133.93 52.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.346 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -129.84 128.56 42.53 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.072 176.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.514 ' HA3' HD12 ' A' ' 56' ' ' LEU . . . -126.62 138.4 10.62 Favored Glycine 0 N--CA 1.441 -0.978 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.255 -175.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -101.25 131.98 47.0 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 177.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 38.0 m -120.14 136.45 54.61 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.733 -176.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 24.8 m-90 -126.35 122.74 36.27 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.331 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -128.24 119.11 24.52 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.24 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.487 HD12 ' HA ' ' A' ' 77' ' ' LYS . 31.7 mm -101.76 113.92 39.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.96 175.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 23.4 t60 -154.18 140.58 18.71 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -176.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.3 t70 62.73 27.26 16.03 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.34 0.591 . . . . 0.0 109.898 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 66.42 12.4 8.64 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.837 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.8 mt -105.93 135.73 46.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.122 0.487 . . . . 0.0 110.956 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.487 ' HA ' HD12 ' A' ' 72' ' ' ILE . 63.4 tttp -97.98 119.25 36.28 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.742 177.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -141.1 143.45 34.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.098 0.475 . . . . 0.0 110.53 174.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -135.69 148.7 49.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.994 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -138.63 144.16 39.6 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -108.57 128.38 54.77 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 121.106 0.479 . . . . 0.0 109.73 174.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 29.2 pt -117.7 151.04 19.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.583 -175.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -139.21 153.82 47.94 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 174.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.536 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 31.2 p90 -156.38 151.35 26.22 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.481 177.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.544 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 29.5 t70 -98.73 145.29 27.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.998 -177.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.0 mm -107.7 89.97 5.74 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.627 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.544 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 22.4 Cg_exo -64.49 164.04 24.89 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.554 2.169 . . . . 0.0 111.982 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 57.2 mt -69.2 -18.5 22.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.38 0.61 . . . . 0.0 110.322 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -79.95 9.02 5.85 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.392 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.614 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 78.2 t80 -77.94 139.46 61.65 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.614 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 44.2 Cg_endo -95.82 13.09 41.28 Favored 'Cis proline' 0 C--N 1.349 0.573 0 C-N-CA 124.314 -1.119 . . . . 0.0 113.856 1.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 38.1 m -58.5 -31.91 68.31 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.356 0.598 . . . . 0.0 110.496 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 35.6 m -123.63 124.4 42.7 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.785 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.475 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -69.0 143.93 95.04 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.518 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 17.2 Cg_exo -68.22 155.53 69.05 Favored 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 123.31 2.673 . . . . 0.0 112.687 179.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -102.3 116.87 33.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.926 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.536 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 4.2 mp -88.46 117.95 33.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.429 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -90.24 -44.0 10.02 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.816 -175.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.418 ' CG1' ' HG ' ' A' ' 102' ' ' LEU . 17.9 t 63.52 86.58 0.14 Allowed Pre-proline 0 CA--C 1.535 0.399 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.889 -176.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -61.15 -28.14 85.02 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.957 2.438 . . . . 0.0 112.969 -175.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.92 -37.08 83.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.855 0.36 . . . . 0.0 110.876 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.445 ' HA ' ' HB3' ' A' ' 105' ' ' LYS . 60.8 mt -82.33 -10.78 58.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.741 -173.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -61.84 112.45 2.3 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 81.02 -12.29 37.71 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.34 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 102' ' ' LEU . 3.6 tppp? -86.33 -60.7 1.93 Allowed 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.629 HG21 HD13 ' A' ' 153' ' ' LEU . 66.4 m . . . . . 0 C--N 1.322 -0.602 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.707 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.422 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 98' ' ' ALA . 16.5 ptpt -164.61 164.47 21.54 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -175.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.5 pt -73.46 135.24 28.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 120.966 0.412 . . . . 0.0 110.419 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.6 t -96.83 117.92 32.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.34 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.7 mt -98.21 164.19 12.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.337 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 3.5 t -72.14 152.09 42.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.078 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -68.41 -26.93 65.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.101 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -70.43 -18.51 63.01 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.64 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -67.12 -33.62 75.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.054 0.454 . . . . 0.0 110.035 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.4 ' HB2' ' CD ' ' A' ' 123' ' ' PRO . 41.8 mtpt -58.6 -58.94 15.47 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.842 -178.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.4 ' CD ' ' HB2' ' A' ' 122' ' ' LYS . 27.9 Cg_endo -63.94 -26.76 66.6 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 121.874 1.716 . . . . 0.0 112.451 178.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 64.5 tp -66.31 -47.24 74.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.968 0.414 . . . . 0.0 110.24 175.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -67.19 -51.42 53.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.624 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.05 -15.37 59.35 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.19 -176.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -78.55 -40.91 33.59 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.95 0.405 . . . . 0.0 110.786 177.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -105.16 70.53 0.9 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.105 0.479 . . . . 0.0 110.949 -173.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 68.2 t -130.9 128.69 22.43 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.267 176.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.46 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 78.0 Cg_endo -87.92 -139.83 0.15 OUTLIER 'Cis proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.728 -1.363 . . . . 0.0 112.91 1.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 50.6 mtmt 75.54 -7.62 1.75 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.496 0.718 . . . . 0.0 111.533 -178.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.7 m-30 -95.65 141.17 29.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.29 171.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -145.98 -174.06 17.79 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 42.7 tp -57.14 -38.31 73.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.78 0.29 . . . . 0.0 111.415 -176.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.56 -43.63 89.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.005 0.431 . . . . 0.0 111.173 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 20.2 m80 -70.99 -36.66 72.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.313 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.8 tp -60.31 -47.89 84.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.249 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' MET . . . . . 0.785 ' HE1' ' HA ' ' A' ' 138' ' ' MET . 18.2 mmt -63.96 -43.17 96.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.034 -178.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.14 75.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.951 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.8 mt -86.86 -33.31 19.84 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -176.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -98.6 -64.89 0.86 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.4 -0.905 . . . . 0.0 113.109 -176.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.7 tp -66.21 -44.26 84.34 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -173.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -51.8 -61.59 6.32 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.371 -0.442 . . . . 0.0 113.566 -178.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -62.42 -31.46 80.98 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.571 2.18 . . . . 0.0 112.37 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 52.3 t90 -62.66 -46.17 89.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.022 0.439 . . . . 0.0 110.097 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 86.8 mt -63.94 -33.11 74.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.784 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.6 -18.1 64.86 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.476 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 64.7 t -104.36 -54.5 6.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.493 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -77.21 -35.18 55.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -171.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.555 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 31.9 mm -59.62 -51.84 78.25 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 111.79 0.292 . . . . 0.0 111.79 -178.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.555 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 50.6 Cg_exo -55.12 -34.53 87.87 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.974 1.783 . . . . 0.0 112.129 175.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.87 -45.04 87.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.725 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.629 HD13 HG21 ' A' ' 106' ' ' THR . 4.2 mm? -67.94 -30.25 69.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.231 178.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 150' ' ' ILE . 65.5 mt -70.93 -42.1 77.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.139 0.495 . . . . 0.0 110.172 175.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -63.42 -42.61 98.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.904 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 43.0 tttp -67.98 -31.83 71.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.125 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 79.99 33.67 32.5 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.904 174.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.2 t -97.37 -14.76 7.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.021 0.439 . . . . 0.0 110.934 -177.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.7 mt . . . . . 0 C--N 1.328 -0.365 0 CA-C-O 121.389 0.614 . . . . 0.0 109.658 177.338 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.41 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.227 0 CA-C-O 121.279 0.562 . . . . 0.0 109.965 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.2 m -64.68 -45.7 85.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.488 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.52 -30.0 70.71 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.282 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -66.64 -41.65 87.93 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 5' ' ' ALA . 71.9 t -58.74 -46.1 90.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.319 177.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.1 t -66.42 -28.85 44.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.752 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.8 t -76.87 -36.27 56.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.946 -178.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -86.13 -4.31 59.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.429 . . . . 0.0 110.879 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 61.6 mt -119.06 86.36 31.69 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 173.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.15 149.51 27.67 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.665 2.91 . . . . 0.0 113.768 -172.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.8 m -76.23 175.1 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.037 178.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.416 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 6.3 mp -100.27 163.59 12.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.485 -179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.63 -39.7 5.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 172.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.613 ' HB ' ' HG3' ' A' ' 34' ' ' GLU . 23.0 m -88.92 135.86 33.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.148 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -150.02 121.44 7.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.51 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.617 ' H ' ' HD2' ' A' ' 31' ' ' ARG . . . -156.28 -178.99 7.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.277 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.5 168.56 19.76 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.058 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.74 -7.48 18.37 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 123.2 2.6 . . . . 0.0 113.2 -177.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.417 ' HE ' ' HB2' ' A' ' 23' ' ' ARG . 11.0 mtm180 -70.28 -51.26 31.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.638 0.732 . . . . 0.0 109.723 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.6 93.77 3.65 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.133 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.408 ' O ' HG21 ' A' ' 29' ' ' VAL . 97.9 mtt180 -55.75 -52.17 64.85 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -168.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.501 ' HG3' HD21 ' A' ' 27' ' ' LEU . 10.0 pt-20 -71.37 -33.93 69.99 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -174.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.501 HD21 ' HG3' ' A' ' 26' ' ' GLU . 4.2 mm? -75.48 -33.31 60.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.967 0.413 . . . . 0.0 110.341 178.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.498 ' CH2' HG23 ' A' ' 86' ' ' ILE . 64.1 t-105 -65.32 -50.67 64.76 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.126 177.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.408 HG21 ' O ' ' A' ' 25' ' ' ARG . 84.3 t -60.17 -32.68 51.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 121.123 0.487 . . . . 0.0 110.49 177.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.508 ' HB3' HG23 ' A' ' 18' ' ' THR . 16.2 tt0 -67.32 -49.21 65.06 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.249 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.617 ' HD2' ' H ' ' A' ' 20' ' ' ALA . 2.9 ptm180 -70.31 -27.58 64.5 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.374 -0.53 . . . . 0.0 110.066 178.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.426 ' HA ' HD23 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -62.84 -44.77 95.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.231 -0.441 . . . . 0.0 109.866 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.487 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 18.5 ptpt -73.38 -31.09 63.71 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.349 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.613 ' HG3' ' HB ' ' A' ' 18' ' ' THR . 6.1 mm-40 -57.35 -51.51 69.11 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.381 0.61 . . . . 0.0 109.69 172.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.543 ' OE1' ' HA3' ' A' ' 133' ' ' GLY . 5.3 tp10 -64.66 -39.64 94.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.075 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.423 ' O ' HG13 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -61.85 -42.18 98.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.798 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 15.4 mm100 -64.43 -39.2 93.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.899 0.38 . . . . 0.0 110.314 177.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.7 t -61.74 -43.14 99.43 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.884 175.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.415 ' O ' HG23 ' A' ' 43' ' ' VAL . 61.9 mt -59.86 -52.29 66.09 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.84 175.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 36' ' ' TYR . 77.7 mt -59.06 -33.28 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.87 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 41' ' ' ARG . 6.8 tpp180 -61.1 -44.6 97.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.275 177.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -68.6 -43.17 77.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.422 177.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.491 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 86.6 t -59.42 -42.02 86.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.655 178.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.44 -47.26 86.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.756 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -54.57 -41.51 69.94 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.371 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.484 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 89.3 m-20 -67.5 -41.28 84.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.141 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 74.0 mmtt -68.09 -27.57 66.59 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.244 -0.182 . . . . 0.0 110.808 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.18 -41.65 79.7 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.946 178.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -107.83 3.88 24.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.81 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.6 t70 59.14 31.46 21.29 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.5 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -97.17 16.04 20.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.469 -177.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.484 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 20.7 t0 -57.75 138.93 55.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.202 -178.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 59.7 p-90 -143.33 -0.25 1.11 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.167 -0.47 . . . . 0.0 112.104 -172.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -140.44 135.26 31.84 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 119.893 -0.723 . . . . 0.0 112.019 -170.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -130.33 125.04 33.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.056 174.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.1 126.91 49.43 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.873 0.368 . . . . 0.0 110.274 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -118.08 160.35 21.67 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.633 177.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.4 p -158.67 168.74 26.07 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.766 0.317 . . . . 0.0 110.834 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -75.72 172.88 11.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.025 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -71.93 -14.85 62.04 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -175.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.25 -18.22 29.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.853 0.358 . . . . 0.0 110.239 176.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.22 23.94 70.2 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 116.042 -0.527 . . . . 0.0 112.244 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.8 p -90.97 -4.35 56.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.025 0.441 . . . . 0.0 111.436 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -152.47 128.42 10.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -120.59 136.97 54.65 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.865 0.364 . . . . 0.0 110.69 -176.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.4 p90 -141.01 139.25 34.14 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.326 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -165.1 -177.73 37.81 Favored Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 119.427 -1.368 . . . . 0.0 113.128 -177.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.49 ' HD2' ' CZ2' ' A' ' 70' ' ' TRP . 22.7 ttmm -130.65 133.05 45.8 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 -177.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.414 ' O ' ' HA ' ' A' ' 79' ' ' GLU . 6.9 p -112.6 130.13 56.13 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.321 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.666 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 16.6 m-90 -103.64 131.11 51.09 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.57 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -118.22 119.51 34.89 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 175.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.416 HD11 ' HG3' ' A' ' 77' ' ' LYS . 15.7 mm -101.89 119.78 50.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.221 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -140.36 107.32 5.42 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.254 177.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.5 t70 55.07 64.75 1.69 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.548 173.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 67.12 2.08 2.62 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.658 175.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -107.4 137.45 45.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.762 0.315 . . . . 0.0 110.401 177.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.416 ' HG3' HD11 ' A' ' 72' ' ' ILE . 21.4 ttpt -118.0 113.87 22.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.263 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -112.4 122.19 47.0 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.666 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 8.2 pt-20 -115.26 140.13 49.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.988 0.423 . . . . 0.0 110.904 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -127.8 126.18 41.22 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.153 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -87.23 126.06 34.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.862 177.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 41.1 pt -125.25 153.42 32.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.92 -175.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -147.82 155.12 41.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.798 0.333 . . . . 0.0 110.502 176.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.408 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 44.2 p90 -165.21 159.28 17.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.288 177.093 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -104.28 170.15 8.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.259 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.498 HG23 ' CH2' ' A' ' 28' ' ' TRP . 47.7 mm -114.91 90.89 24.27 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.936 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 11.0 Cg_endo -53.52 159.74 6.02 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.249 2.633 . . . . 0.0 112.89 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.1 mm -71.66 -18.5 19.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.509 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 m -88.52 9.31 24.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.05 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.503 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 47.7 t80 -81.37 146.05 56.9 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.31 -0.404 . . . . 0.0 109.914 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.503 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 10.9 Cg_endo -92.99 12.81 51.03 Favored 'Cis proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.48 -1.05 . . . . 0.0 112.696 -2.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.4 m -59.38 -28.83 67.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.389 0.614 . . . . 0.0 110.61 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 74.0 m -128.51 132.52 48.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.557 173.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.62 144.67 69.87 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.214 -178.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -85.82 173.98 6.81 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.826 2.351 . . . . 0.0 112.332 178.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.626 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 45.1 mt-10 -109.09 116.99 33.01 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.296 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.408 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.8 mt -76.24 132.43 33.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.457 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.718 ' HA ' ' HA3' ' A' ' 113' ' ' GLY . . . -107.15 128.88 54.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.926 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 10.6 t -122.83 86.06 50.12 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -63.13 -17.94 62.61 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.855 2.37 . . . . 0.0 112.829 -175.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -81.09 -27.54 35.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.96 0.41 . . . . 0.0 111.006 -178.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 72.9 mt -88.42 -17.82 29.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.978 0.418 . . . . 0.0 110.13 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -57.54 112.59 1.48 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.031 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 82.93 -11.84 52.05 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.092 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.632 ' HZ3' ' HB2' ' A' ' 105' ' ' LYS . 4.9 ttmp? -93.47 -44.51 8.21 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 120.802 0.334 . . . . 0.0 110.789 -177.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.0 m . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.194 178.919 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . 0.718 ' HA3' ' HA ' ' A' ' 98' ' ' ALA . . . . . . . . 0 N--CA 1.437 -1.257 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.626 ' HA ' ' HB3' ' A' ' 96' ' ' GLU . 7.4 mtpm? 49.03 39.55 15.1 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 122.782 0.433 . . . . 0.0 111.389 178.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.6 pt -72.15 135.51 27.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.295 0.569 . . . . 0.0 110.957 -177.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 2.8 p -108.58 153.2 23.71 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.004 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.418 ' HB2' ' CD1' ' A' ' 121' ' ' PHE . 64.7 mt -91.37 -171.39 2.93 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.008 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.7 t -61.1 145.68 50.07 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -58.41 -30.69 67.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.492 -173.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -54.77 -30.98 58.1 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.169 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.418 ' CD1' ' HB2' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -69.19 -33.04 72.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.469 -175.561 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.432 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 10.0 tmtt? -58.77 -57.08 29.49 Favored Pre-proline 0 CA--C 1.541 0.618 0 CA-C-O 119.714 -0.184 . . . . 0.0 111.393 -173.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.432 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 35.6 Cg_endo -66.95 -34.95 27.91 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 121.672 1.581 . . . . 0.0 111.982 175.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 43.9 tp -60.98 -37.91 84.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.927 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.479 ' CZ3' HD13 ' A' ' 137' ' ' LEU . 63.7 t-105 -61.21 -54.71 40.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.484 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.48 -33.27 74.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.303 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 31.6 mtt180 -63.7 -37.12 86.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.465 177.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -83.47 -61.24 1.89 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -175.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.456 HG12 ' HA ' ' A' ' 130' ' ' PRO . 94.6 t -47.49 132.93 10.35 Favored Pre-proline 0 N--CA 1.471 0.602 0 O-C-N 123.627 0.579 . . . . 0.0 111.407 -175.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.476 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 91.7 Cg_endo -77.61 -164.65 4.04 Favored 'Cis proline' 0 C--N 1.35 0.643 0 C-N-CA 124.259 -1.142 . . . . 0.0 114.298 7.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 30.8 mttm 73.66 -9.87 1.15 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.867 -178.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.496 ' HZ ' HD13 ' A' ' 140' ' ' LEU . 6.0 t80 -106.68 151.36 25.21 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.543 ' HA3' ' OE1' ' A' ' 35' ' ' GLU . . . -166.96 -158.18 11.13 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 119.629 -1.272 . . . . 0.0 113.759 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 48.6 tp -63.22 -44.93 93.89 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.746 0.646 . . . . 0.0 112.746 -169.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.04 87.51 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.944 0.878 . . . . 0.0 110.002 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -72.7 -32.48 65.79 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.533 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.479 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 65.8 tp -66.66 -48.74 68.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.308 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 20.3 ptm -65.34 -34.83 79.24 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 121.071 -0.252 . . . . 0.0 111.073 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.18 -45.66 72.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.708 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.496 HD13 ' HZ ' ' A' ' 132' ' ' PHE . 76.2 mt -91.0 -16.06 28.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.825 -174.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -110.43 -67.34 0.56 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.259 -176.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.5 tp -60.97 -46.11 92.03 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 -174.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.5 -62.18 6.47 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.061 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.61 -33.84 96.71 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.705 2.27 . . . . 0.0 112.962 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 18.7 t90 -57.66 -52.67 64.48 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.241 0.543 . . . . 0.0 109.772 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 88.9 mt -67.47 -36.13 80.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.892 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.21 -24.15 67.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.362 -174.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 57.7 t -104.23 -54.72 6.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.78 -0.368 . . . . 0.0 111.905 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -73.99 -34.08 64.07 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -170.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.478 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.0 mm -66.52 -49.77 50.21 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -176.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.478 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 79.1 Cg_exo -50.21 -39.52 52.09 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 122.225 1.95 . . . . 0.0 112.95 177.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -70.6 -42.27 71.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.71 0.291 . . . . 0.0 110.491 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 23.2 tp -59.51 -35.71 74.67 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.071 0.462 . . . . 0.0 110.438 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 150' ' ' ILE . 69.2 mt -70.34 -53.69 21.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.692 177.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -64.47 -26.65 68.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.854 -175.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -70.77 -14.32 62.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.721 -178.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 90.92 16.66 54.01 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.764 176.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 59.9 t -80.95 -62.74 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.944 0.402 . . . . 0.0 110.284 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 13.2 pt . . . . . 0 C--N 1.324 -0.54 0 CA-C-O 121.356 0.598 . . . . 0.0 111.261 179.905 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.444 ' O ' HG22 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.453 -0.288 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.5 m -57.98 -44.17 86.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.424 177.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 51.3 mmm-85 -59.4 -48.17 82.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.952 -178.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.3 -46.16 77.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.065 -177.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.444 HG22 ' O ' ' A' ' 5' ' ' ALA . 79.5 t -59.45 -48.07 88.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.304 -178.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 92.5 t -66.74 -26.99 38.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.966 0.412 . . . . 0.0 110.803 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -77.26 -54.22 6.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.424 -177.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -80.56 0.49 33.68 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.976 0.417 . . . . 0.0 111.708 -173.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.64 HG12 ' HB2' ' A' ' 42' ' ' TYR . 60.9 mt -108.97 87.96 5.1 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 169.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.494 ' HG2' ' HG3' ' A' ' 41' ' ' ARG . 80.7 Cg_exo -48.48 140.46 21.31 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 123.978 3.119 . . . . 0.0 114.006 -170.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.489 ' HB ' ' HG2' ' A' ' 131' ' ' LYS . 35.6 m -73.43 163.4 4.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.942 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mp -106.94 154.8 20.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.092 -175.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HB2' ' NZ ' ' A' ' 17' ' ' LYS . 9.0 mtmp? -99.91 -47.27 5.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.905 177.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.514 HG23 HD13 ' A' ' 27' ' ' LEU . 72.7 m -82.97 116.59 22.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.424 -177.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.477 ' OD1' ' HG3' ' A' ' 91' ' ' PRO . 38.4 t-20 -148.16 99.06 3.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.08 -58.08 0.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.508 -174.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 151.68 170.16 18.11 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.961 176.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.73 -13.36 17.96 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 123.042 2.494 . . . . 0.0 112.294 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.438 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 1.7 mmp_? -65.76 -33.85 76.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.758 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -93.43 107.34 19.2 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.478 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 mmp_? -58.22 -43.41 87.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.876 -176.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.43 -45.2 66.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.846 0.355 . . . . 0.0 110.681 -174.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.514 HD13 HG23 ' A' ' 18' ' ' THR . 4.5 mm? -73.18 -23.56 60.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.774 178.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 51.7 t-105 -70.66 -45.66 64.7 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 25' ' ' ARG . 99.5 t -60.78 -38.66 79.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.094 0.473 . . . . 0.0 110.029 175.244 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.57 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 0.7 OUTLIER -61.33 -37.27 82.67 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.459 174.813 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.561 HH22 ' HA2' ' A' ' 133' ' ' GLY . 2.4 mtp180 -64.5 -37.4 87.41 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.119 177.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -56.7 -42.69 79.57 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 175.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -60.12 -47.84 84.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.468 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.57 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 11.0 mm-40 -59.57 -49.77 76.46 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.836 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -62.07 -44.73 96.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.802 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.421 ' O ' HG13 ' A' ' 40' ' ' ILE . 8.4 m-30 -57.67 -46.66 83.97 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.452 0.168 . . . . 0.0 111.308 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -58.56 -46.78 86.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 0.0 110.684 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.8 t -66.84 -44.42 81.08 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.468 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.429 ' O ' HG23 ' A' ' 43' ' ' VAL . 58.5 mt -60.52 -53.88 52.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.216 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 36' ' ' TYR . 79.9 mt -57.71 -39.8 72.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.48 0.181 . . . . 0.0 110.702 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.494 ' HG3' ' HG2' ' A' ' 14' ' ' PRO . 5.9 mmp_? -59.63 -56.88 16.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.911 176.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.64 ' HB2' HG12 ' A' ' 13' ' ' ILE . 36.4 t80 -57.44 -50.07 74.2 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.355 -179.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.485 HG12 ' HE2' ' A' ' 47' ' ' LYS . 91.1 t -63.56 -37.52 79.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.162 -176.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 40' ' ' ILE . 2.7 tp10 -63.22 -49.82 72.66 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.342 0.591 . . . . 0.0 109.99 179.193 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -59.29 -36.59 75.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.568 177.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.451 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 65.6 t30 -73.2 -40.06 65.05 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.411 -177.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.485 ' HE2' HG12 ' A' ' 43' ' ' VAL . 66.5 mttm -63.04 -46.38 87.83 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.802 -178.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -71.8 -14.71 62.06 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.853 -175.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -89.81 -2.82 58.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.825 0.345 . . . . 0.0 110.452 175.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.2 t0 60.78 40.25 16.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.277 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -122.99 17.83 10.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.923 0.868 . . . . 0.0 109.505 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.451 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 22.4 t70 -62.3 101.47 0.23 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.827 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.42 ' HB2' ' O ' ' A' ' 70' ' ' TRP . 15.9 p-90 -111.13 -40.98 4.3 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -167.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.507 ' H ' ' HD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -124.1 162.34 23.75 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 121.776 -0.577 . . . . 0.0 111.762 -174.235 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -156.28 129.03 7.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.848 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -112.61 144.14 42.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.252 0.549 . . . . 0.0 111.759 -173.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -109.25 162.99 13.77 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 173.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.1 m -153.19 155.4 36.59 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.808 0.337 . . . . 0.0 110.904 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -81.49 168.73 17.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 169.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -73.87 -6.5 47.56 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.805 -174.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -84.8 -25.58 28.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.98 0.419 . . . . 0.0 110.258 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.04 18.23 74.43 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.2 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.0 p -90.38 -4.35 57.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -176.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 64' ' ' ARG . 12.8 ttp180 -151.99 128.37 10.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.788 0.328 . . . . 0.0 110.17 172.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -111.54 126.56 55.11 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.36 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -137.25 138.04 39.68 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.212 -175.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -172.66 -155.94 12.0 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.676 -0.774 . . . . 0.0 112.051 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -138.66 153.61 48.58 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.771 0.319 . . . . 0.0 110.406 -178.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.8 p -128.19 123.97 35.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.841 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.588 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 17.0 m-90 -102.11 121.56 42.43 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 175.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.411 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 11.1 t80 -118.99 124.5 47.14 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.175 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 41.6 mm -97.9 114.8 36.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -177.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -146.57 118.42 8.15 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.403 177.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.6 t0 62.1 41.95 10.32 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.333 0.587 . . . . 0.0 110.828 175.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mm? 70.44 5.04 5.19 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.693 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.2 mt -88.48 106.12 18.06 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.998 0.427 . . . . 0.0 110.199 176.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -94.28 93.61 7.84 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.411 ' CE1' ' HB3' ' A' ' 71' ' ' TYR . 30.1 p90 -118.22 138.85 52.05 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.067 0.46 . . . . 0.0 111.087 -177.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.588 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 0.7 OUTLIER -115.21 141.87 47.43 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.74 179.734 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -123.85 136.95 54.69 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.174 174.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -85.48 110.91 19.52 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.411 ' HA ' HG21 ' A' ' 99' ' ' VAL . 32.0 pt -115.16 155.62 16.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.016 -172.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -166.08 159.64 15.61 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.593 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 52.3 p90 -159.39 147.73 17.71 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.55 178.242 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -98.98 159.45 14.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.307 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.7 mm -106.6 90.32 4.91 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.328 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.18 148.5 18.09 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 123.102 2.535 . . . . 0.0 112.591 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 38.8 mm -71.66 -14.31 17.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.559 0.695 . . . . 0.0 110.091 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 2.9 p -84.21 7.65 18.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.423 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.721 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 63.5 t80 -69.63 144.65 94.2 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.721 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 37.8 Cg_endo -92.7 3.01 60.17 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 124.186 -1.173 . . . . 0.0 114.133 1.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.9 m -58.02 -41.71 83.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.459 0.647 . . . . 0.0 110.09 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.5 m -103.93 120.92 42.04 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.206 172.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.61 145.07 95.61 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.479 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.439 ' HD2' HD23 ' A' ' 137' ' ' LEU . 25.7 Cg_exo -62.63 115.38 2.87 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.64 2.227 . . . . 0.0 111.221 175.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.559 ' CB ' ' HD2' ' A' ' 114' ' ' LYS . 30.6 mt-10 -74.44 117.33 16.13 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.83 -175.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.593 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.5 mt -66.6 127.76 28.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 175.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.98 -78.0 0.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.142 -170.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.411 HG21 ' HA ' ' A' ' 82' ' ' ILE . 8.1 t 51.69 75.79 0.61 Allowed Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.598 -175.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.88 -21.16 56.14 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 123.096 2.531 . . . . 0.0 112.798 -175.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -63.61 -28.49 69.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.368 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 97.8 mt -77.62 -22.53 50.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.288 -177.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -68.67 -16.38 63.81 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.557 0.694 . . . . 0.0 110.726 -178.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -108.5 10.37 35.74 Favored Glycine 0 C--N 1.316 -0.535 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.891 176.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -115.49 -68.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.679 0.276 . . . . 0.0 111.497 -177.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.486 -173.814 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 112.018 -0.433 . . . . 0.0 112.018 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.559 ' HD2' ' CB ' ' A' ' 96' ' ' GLU . 38.6 mmtt -138.89 143.49 38.75 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -178.208 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.406 HG12 ' HB ' ' A' ' 97' ' ' ILE . 39.4 pt -76.34 152.9 5.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.825 179.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 39.0 t -88.71 106.54 18.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.461 -179.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.9 mt -92.68 -175.49 3.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.7 t -84.36 155.52 22.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.716 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -73.53 -24.58 60.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.701 -178.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -82.64 -2.73 54.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.088 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -69.83 -40.94 75.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.023 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.426 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 31.6 mmtp -63.77 -53.7 48.0 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.792 -177.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 16.1 Cg_endo -59.46 -32.08 95.79 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 121.738 1.626 . . . . 0.0 112.419 176.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.6 tp -69.43 -47.97 62.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.993 0.425 . . . . 0.0 110.312 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -61.12 -51.88 67.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.878 -177.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.24 -28.97 70.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.459 -177.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -68.88 -38.73 79.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.089 0.471 . . . . 0.0 110.241 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -66.78 -54.97 17.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.71 -176.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 59.3 t -42.22 125.29 2.76 Favored Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 124.188 0.93 . . . . 0.0 111.983 -173.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.444 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 85.4 Cg_endo -81.92 -132.45 0.09 OUTLIER 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.079 -1.217 . . . . 0.0 113.027 4.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.489 ' HG2' ' HB ' ' A' ' 15' ' ' VAL . 7.1 ttmm 70.34 -45.0 0.58 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 176.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -74.12 155.82 38.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.949 0.405 . . . . 0.0 110.837 -177.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.561 ' HA2' HH22 ' A' ' 31' ' ' ARG . . . -144.97 174.17 25.15 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.435 -175.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.434 HD12 ' CE2' ' A' ' 84' ' ' PHE . 47.8 tp -69.59 -37.17 76.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.781 0.324 . . . . 0.0 110.913 -175.47 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.09 -37.88 64.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.429 0.633 . . . . 0.0 110.695 174.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -71.23 -32.73 69.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.419 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.439 HD23 ' HD2' ' A' ' 95' ' ' PRO . 61.7 tp -65.6 -48.91 70.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.197 -178.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 22.9 ptp -67.25 -34.78 78.17 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.992 -177.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -75.47 -53.47 8.61 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.91 -17.31 44.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.821 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -95.49 -71.59 1.11 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.434 -0.889 . . . . 0.0 112.897 -177.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.476 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 44.5 tp -67.6 -36.51 81.0 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -172.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.88 -62.22 6.31 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.093 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -65.53 -26.63 54.38 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.601 2.201 . . . . 0.0 112.6 177.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -65.47 -39.37 91.89 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.921 0.391 . . . . 0.0 110.651 -178.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 96.3 mt -59.03 -32.88 70.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.828 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.78 1.68 14.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.785 -177.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 61.4 t -101.18 -55.86 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.854 0.359 . . . . 0.0 111.187 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -84.57 -46.63 11.37 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -174.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.474 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 48.0 mm -58.69 -54.46 56.01 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -169.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 12.2 Cg_endo -54.93 -38.98 92.66 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 122.299 1.999 . . . . 0.0 113.202 -175.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.505 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 38.6 t70 -81.68 -34.29 30.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.725 0.298 . . . . 0.0 110.275 -178.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.421 ' HG ' ' HB ' ' A' ' 158' ' ' VAL . 20.2 tp -59.95 -39.15 84.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.032 0.444 . . . . 0.0 110.481 178.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . 0.444 HG13 ' O ' ' A' ' 150' ' ' ILE . 60.5 mt -64.37 -44.02 97.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.223 0.535 . . . . 0.0 110.06 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -68.32 -28.82 67.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.127 -177.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 30.7 mtpp -71.86 -9.51 58.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.729 0.299 . . . . 0.0 110.959 176.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.45 26.2 40.28 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.379 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . 0.421 ' HB ' ' HG ' ' A' ' 153' ' ' LEU . 40.8 t -94.69 -28.91 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 0.0 110.23 179.016 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 58.8 mt . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.707 178.778 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.787 0.327 . . . . 0.0 110.495 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.451 ' O ' HG23 ' A' ' 10' ' ' VAL . 89.7 m -55.82 -52.94 62.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.261 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -61.74 -32.53 72.77 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.864 0.364 . . . . 0.0 110.873 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -63.89 -41.23 97.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.649 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.2 t -78.61 -42.48 25.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.128 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 6' ' ' THR . 82.5 t -59.62 -36.96 68.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.592 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.1 m -64.42 -25.15 67.89 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.029 0.442 . . . . 0.0 111.022 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.55 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 37.7 mt-10 -91.99 -13.99 30.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.429 -177.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 52.4 mt -107.69 89.91 5.68 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.616 0.246 . . . . 0.0 110.752 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.55 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 38.9 Cg_exo -55.73 158.34 13.8 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.545 2.83 . . . . 0.0 113.373 -174.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.547 ' HB ' ' O ' ' A' ' 131' ' ' LYS . 28.4 m -100.24 170.98 1.42 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.181 -178.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.532 ' HG ' ' HB3' ' A' ' 34' ' ' GLU . 9.4 mp -91.58 -177.71 4.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.538 -178.194 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -137.04 6.75 2.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.705 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.548 HG22 HD11 ' A' ' 27' ' ' LEU . 27.0 m -154.21 96.33 1.93 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.869 0.366 . . . . 0.0 110.834 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -111.24 110.08 20.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.942 0.401 . . . . 0.0 110.901 -177.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.443 ' O ' ' HD3' ' A' ' 91' ' ' PRO . . . -143.91 -178.37 5.89 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.345 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.15 165.5 54.05 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.988 -175.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -69.3 -15.94 39.14 Favored 'Trans proline' 0 CA--C 1.529 0.259 0 C-N-CA 123.368 2.712 . . . . 0.0 112.526 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.0 mtp-105 -83.32 -14.01 53.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.185 0.517 . . . . 0.0 110.072 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -80.48 64.35 5.25 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 170.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.4 mtm-85 -54.23 -43.35 70.79 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.876 -167.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.411 ' HG3' HD23 ' A' ' 27' ' ' LEU . 7.4 pt-20 -60.13 -45.27 93.59 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.651 0.263 . . . . 0.0 111.614 -178.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.548 HD11 HG22 ' A' ' 18' ' ' THR . 4.1 mm? -81.94 -19.92 39.73 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.949 0.404 . . . . 0.0 110.978 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.435 ' HE3' HH21 ' A' ' 31' ' ' ARG . 62.3 t-105 -65.76 -39.81 91.43 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.772 177.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 88.0 t -61.3 -42.37 93.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.091 176.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.503 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 26.6 tt0 -67.09 -42.56 84.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.367 0.603 . . . . 0.0 110.187 176.053 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.452 ' HD3' ' O ' ' A' ' 18' ' ' THR . 15.9 ttp-105 -63.56 -32.69 74.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.07 -179.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -59.7 -47.33 86.07 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.344 178.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 10.3 ptmm? -65.52 -33.63 76.37 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.462 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.532 ' HB3' ' HG ' ' A' ' 16' ' ' LEU . 29.8 mm-40 -64.56 -48.98 73.0 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.837 0.351 . . . . 0.0 110.23 177.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -59.88 -44.47 94.18 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.461 ' O ' HG13 ' A' ' 40' ' ' ILE . 11.0 m-85 -59.38 -46.54 88.37 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.213 178.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -65.25 -37.79 88.32 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.468 0.173 . . . . 0.0 111.468 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.7 t -61.58 -43.39 98.95 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.746 -0.465 . . . . 0.0 109.746 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.472 ' O ' HG23 ' A' ' 43' ' ' VAL . 92.4 mt -64.84 -52.53 56.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.998 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.5 mt -55.84 -37.63 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.177 -177.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -57.27 -47.71 80.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.857 0.361 . . . . 0.0 110.96 177.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -68.62 -38.57 80.66 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.5 t -60.31 -43.27 93.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.865 178.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -57.42 -53.41 58.43 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 120.737 0.303 . . . . 0.0 110.437 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -54.22 -45.7 72.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.34 0.59 . . . . 0.0 111.07 176.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.556 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 26.3 t30 -71.62 -45.95 60.56 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.012 -0.994 . . . . 0.0 112.045 -170.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -72.9 -31.19 64.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.481 0.182 . . . . 0.0 111.297 -175.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -71.67 -26.99 62.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.904 0.383 . . . . 0.0 110.497 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -89.18 -5.23 57.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.882 0.372 . . . . 0.0 110.494 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 t70 67.44 16.26 9.97 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.438 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -91.96 8.79 35.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.718 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.556 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 24.5 t70 -51.44 110.87 0.5 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.006 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 67.7 p-90 -123.97 8.22 8.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.22 -170.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -158.02 143.55 16.94 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.063 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.417 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -125.44 124.37 41.28 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 173.889 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.492 HD21 ' HA3' ' A' ' 67' ' ' GLY . 65.5 mt -135.69 133.65 38.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.0 111.621 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -138.31 157.18 46.75 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 171.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.525 ' HB3' ' CE2' ' A' ' 65' ' ' TRP . 30.9 p -103.67 164.78 11.45 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 120.661 0.267 . . . . 0.0 110.41 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -79.88 -179.14 6.8 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 171.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -68.83 -21.05 64.32 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.818 -171.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -88.25 -21.81 24.29 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.795 0.331 . . . . 0.0 110.818 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.63 2.09 84.5 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.127 -0.558 . . . . 0.0 112.407 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.48 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . 20.8 p -90.45 -7.25 53.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.756 0.312 . . . . 0.0 111.493 -177.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -136.41 129.63 31.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.039 0.447 . . . . 0.0 110.891 173.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.525 ' CE2' ' HB3' ' A' ' 58' ' ' SER . 38.3 m95 -112.87 138.03 50.33 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.747 176.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -137.87 145.06 41.74 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.01 -178.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.492 ' HA3' HD21 ' A' ' 56' ' ' LEU . . . -177.8 -150.69 8.72 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.183 -1.008 . . . . 0.0 112.651 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -147.1 139.21 24.5 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -174.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 23.2 p -125.84 138.31 53.81 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 175.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 13.9 p90 -157.4 135.74 11.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.812 0.339 . . . . 0.0 110.378 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -145.76 151.42 37.94 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.1 mm -88.24 121.4 38.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.019 0.438 . . . . 0.0 110.759 -175.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -129.69 112.52 13.74 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.031 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.47 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 0.8 OUTLIER 59.11 38.36 23.84 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.546 0.528 . . . . 0.0 111.229 179.508 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.4 mm? 75.4 -6.95 1.87 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.238 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.8 mt -79.98 107.49 12.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.914 0.388 . . . . 0.0 110.018 177.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -89.73 108.34 19.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.823 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -130.99 151.22 51.64 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.686 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -134.58 150.61 50.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.335 -178.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -131.99 119.84 21.62 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.032 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.402 ' O ' ' HD2' ' A' ' 100' ' ' PRO . 68.9 m-20 -72.16 119.06 15.81 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 172.099 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.457 HG23 HG21 ' A' ' 99' ' ' VAL . 30.7 pt -118.06 143.52 28.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 121.12 0.486 . . . . 0.0 111.819 -172.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -135.14 166.39 23.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.442 172.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.54 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 49.1 p90 -166.18 145.24 5.88 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.023 173.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -103.18 152.66 21.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.159 0.504 . . . . 0.0 110.664 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.48 ' HB ' ' HA ' ' A' ' 63' ' ' THR . 49.1 mm -104.37 90.82 3.47 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.855 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -62.54 166.63 13.0 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.671 2.247 . . . . 0.0 112.319 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 34.1 mt -70.1 -9.94 13.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.66 0.743 . . . . 0.0 110.582 -178.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.8 p -86.43 -13.62 45.68 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.332 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.575 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 72.2 t80 -73.51 143.5 82.48 Favored Pre-proline 0 C--N 1.326 -0.42 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.575 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 10.9 Cg_endo -94.1 14.96 44.12 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 124.703 -0.957 . . . . 0.0 113.172 0.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.5 m -65.81 -30.34 70.95 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.583 0.706 . . . . 0.0 109.738 177.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.3 m -122.06 150.64 41.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.521 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.24 144.68 92.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.427 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -77.61 156.23 31.82 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.66 2.24 . . . . 0.0 111.872 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -93.06 109.82 21.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.097 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.54 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 52.9 mt -76.01 128.82 37.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 177.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.38 -62.72 1.25 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.991 -173.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.457 HG21 HG23 ' A' ' 82' ' ' ILE . 21.2 t 60.39 83.15 0.21 Allowed Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.151 -173.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.402 ' HD2' ' O ' ' A' ' 81' ' ' ASP . 27.5 Cg_endo -62.17 -20.93 71.56 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.015 2.477 . . . . 0.0 113.462 -173.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -71.79 -25.32 61.96 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.858 0.361 . . . . 0.0 111.19 -178.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 86.8 mt -97.3 16.41 20.07 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.246 -0.284 . . . . 0.0 110.895 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -59.89 92.62 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.476 -177.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 68.44 21.86 74.57 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.939 -0.573 . . . . 0.0 113.346 174.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -98.56 -45.69 6.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.94 0.37 . . . . 0.0 110.821 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.519 ' HG1' HD22 ' A' ' 153' ' ' LEU . 33.6 m . . . . . 0 C--N 1.326 -0.418 0 CA-C-O 121.502 0.668 . . . . 0.0 110.524 178.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.63 0 N-CA-C 112.363 -0.295 . . . . 0.0 112.363 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -124.24 142.49 51.2 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.2 pt -80.48 159.15 4.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.917 0.389 . . . . 0.0 111.221 -177.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 20.8 p -99.94 118.81 37.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.501 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.4 mt -86.74 176.35 7.78 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.552 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.437 HG22 ' HB2' ' A' ' 121' ' ' PHE . 8.7 t -71.59 149.67 45.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.398 179.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -64.5 -38.33 90.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.362 -175.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -71.75 -9.35 58.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.457 -177.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.437 ' HB2' HG22 ' A' ' 118' ' ' THR . 70.6 t80 -69.72 -34.69 74.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.736 0.303 . . . . 0.0 111.036 -178.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.403 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 14.5 mmmm -61.94 -53.58 58.59 Favored Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -177.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.536 ' O ' ' HG3' ' A' ' 127' ' ' ARG . 19.7 Cg_endo -61.61 -37.09 71.95 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 121.701 1.601 . . . . 0.0 111.8 174.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 63.9 tp -57.2 -47.03 82.32 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.921 0.391 . . . . 0.0 110.589 178.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.543 ' O ' HG21 ' A' ' 129' ' ' VAL . 29.5 t-105 -60.29 -53.06 62.17 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.001 177.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -58.06 -38.87 77.12 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.319 -175.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 123' ' ' PRO . 98.1 mtt180 -63.24 -26.69 68.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.685 0.278 . . . . 0.0 111.581 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -108.85 21.71 16.87 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.121 0.486 . . . . 0.0 111.053 -174.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.543 HG21 ' O ' ' A' ' 125' ' ' TRP . 68.8 t -107.77 136.43 19.69 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.959 175.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.436 ' HA ' HG11 ' A' ' 129' ' ' VAL . 1.4 Cg_endo -86.35 -158.3 1.36 Allowed 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 124.193 -1.169 . . . . 0.0 112.948 0.188 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.547 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 55.5 mttp 75.77 -0.55 3.17 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.168 0.987 . . . . 0.0 111.956 -177.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.43 ' HZ ' HD11 ' A' ' 140' ' ' LEU . 4.3 t80 -72.53 163.95 27.2 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.158 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -151.67 165.38 30.54 Favored Glycine 0 C--O 1.236 0.265 0 C-N-CA 120.209 -0.996 . . . . 0.0 112.801 -174.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.422 HD23 HD13 ' A' ' 39' ' ' LEU . 48.2 tp -58.01 -46.74 84.76 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.52 0.728 . . . . 0.0 112.595 -172.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.46 -30.02 51.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.323 0.583 . . . . 0.0 111.8 -177.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -71.13 -31.23 67.47 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.566 -178.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 35.7 tp -58.79 -47.48 84.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.026 0.441 . . . . 0.0 110.815 178.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' MET . . . . . 0.449 ' HA ' ' HB3' ' A' ' 142' ' ' LEU . 1.3 mpt? -67.01 -39.35 87.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.903 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -69.86 -42.08 73.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.176 -177.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.43 HD11 ' HZ ' ' A' ' 132' ' ' PHE . 84.0 mt -95.01 -24.29 16.99 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -173.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -119.66 -63.69 0.27 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.098 -1.048 . . . . 0.0 113.755 -174.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.449 ' HB3' ' HA ' ' A' ' 138' ' ' MET . 1.4 tm? -57.99 -51.94 67.57 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -172.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.84 -61.17 7.75 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 121.312 -0.471 . . . . 0.0 113.134 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . 0.475 ' O ' HG22 ' A' ' 148' ' ' VAL . 77.3 Cg_exo -52.36 -36.58 69.31 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.884 2.389 . . . . 0.0 113.14 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -62.99 -49.0 76.42 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.788 0.328 . . . . 0.0 110.344 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 91.6 mt -60.1 -41.79 93.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.537 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.04 -8.61 46.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.316 -176.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . 0.475 HG22 ' O ' ' A' ' 144' ' ' PRO . 94.7 t -106.44 -55.59 5.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.651 0.263 . . . . 0.0 111.362 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -79.84 -42.83 23.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.907 -170.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.558 ' O ' HG13 ' A' ' 154' ' ' ILE . 49.0 mm -59.66 -52.67 72.34 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -172.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.53 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 70.3 Cg_exo -53.45 -34.56 72.23 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.349 2.033 . . . . 0.0 113.488 -178.068 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.591 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 9.2 m-20 -86.26 -27.07 24.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.947 0.403 . . . . 0.0 110.875 178.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.642 ' HG ' ' HB ' ' A' ' 158' ' ' VAL . 15.7 tp -70.5 -26.79 63.76 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.146 0.498 . . . . 0.0 110.193 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . 0.558 HG13 ' O ' ' A' ' 150' ' ' ILE . 69.1 mt -66.05 -49.56 75.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.736 175.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 1.4 pp0? -69.92 -20.17 63.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.188 -176.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 67.6 mttm -77.11 -16.64 59.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.077 0.465 . . . . 0.0 110.269 174.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 90.45 17.15 53.72 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.851 177.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . 0.642 ' HB ' ' HG ' ' A' ' 153' ' ' LEU . 58.7 t -88.71 -40.46 13.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.797 0.332 . . . . 0.0 110.705 -178.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.559 HD11 HD23 ' A' ' 153' ' ' LEU . 48.1 mm . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.325 178.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.447 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.56 0.219 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.432 ' O ' HG21 ' A' ' 10' ' ' VAL . 25.7 m -64.13 -35.63 81.41 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.576 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -62.42 -39.88 94.74 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 120.855 0.359 . . . . 0.0 110.285 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.419 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 44.0 ttt85 -65.7 -38.17 88.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.686 178.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 5' ' ' ALA . 97.5 t -60.48 -41.03 86.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.937 0.399 . . . . 0.0 110.546 177.138 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.432 HG21 ' O ' ' A' ' 6' ' ' THR . 59.7 t -69.16 -27.17 33.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 121.099 0.476 . . . . 0.0 110.354 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.3 t -73.55 -32.47 64.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.231 177.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 8' ' ' ARG . 44.3 mt-10 -81.49 -28.26 34.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.877 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 51.0 mt -104.73 87.56 1.86 Allowed Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 174.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -50.18 141.71 30.22 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.884 3.056 . . . . 0.0 113.636 -169.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.4 m -69.33 149.53 10.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.369 177.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.542 HD22 HH22 ' A' ' 31' ' ' ARG . 6.4 mp -99.98 153.95 18.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.196 0.522 . . . . 0.0 111.571 -175.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.2 mttt -98.22 -49.67 4.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.619 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.429 ' HG1' ' NE2' ' A' ' 30' ' ' GLN . 7.4 m -75.17 108.05 7.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.606 -170.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -105.7 90.41 3.39 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -145.04 145.63 31.55 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.492 -177.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.1 167.49 41.75 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.149 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.28 -13.47 38.33 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 123.217 2.611 . . . . 0.0 113.088 -176.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -74.14 -24.6 59.44 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.801 0.334 . . . . 0.0 110.869 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -89.4 94.27 9.83 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 25' ' ' ARG . 43.3 mtm105 -60.11 -51.58 69.02 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -164.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -73.75 -29.94 62.51 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.496 -175.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -76.6 -26.52 55.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.904 0.383 . . . . 0.0 110.199 175.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.52 ' CH2' HG21 ' A' ' 86' ' ' ILE . 55.3 t-105 -64.2 -44.73 91.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.982 175.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.52 -41.35 81.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.353 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.683 ' HG3' ' HE3' ' A' ' 33' ' ' LYS . 53.5 tt0 -64.63 -44.0 91.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.308 177.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.542 HH22 HD22 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -54.52 -45.08 73.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.721 177.16 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.6 mp -62.88 -46.24 88.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.592 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.683 ' HE3' ' HG3' ' A' ' 30' ' ' GLN . 20.7 pttp -68.26 -38.88 82.23 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.904 -176.12 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 6.6 mm-40 -68.26 -45.13 74.0 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.712 0.292 . . . . 0.0 110.634 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.519 ' HA ' HD23 ' A' ' 16' ' ' LEU . 10.0 tp10 -61.91 -42.51 99.17 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.084 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -63.84 -30.55 71.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.49 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.678 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 81.8 mm-40 -62.32 -49.51 75.33 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 m -63.72 -38.15 90.04 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.897 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.456 ' O ' HG23 ' A' ' 43' ' ' VAL . 92.8 mt -61.22 -55.92 26.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 177.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 87.2 mt -62.27 -36.22 73.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.78 -178.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -55.24 -47.17 75.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.991 175.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.514 ' CD2' ' HE2' ' A' ' 138' ' ' MET . 11.1 t80 -72.45 -41.03 66.56 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.354 -179.043 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.6 t -59.54 -39.05 78.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 120.736 0.303 . . . . 0.0 110.804 178.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -55.14 -54.83 38.31 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.4 -46.6 83.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.31 178.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -56.07 -51.41 67.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.623 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -63.16 -32.57 73.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.627 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -65.34 -36.73 84.9 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.006 0.431 . . . . 0.0 110.59 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -85.68 2.42 45.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.802 178.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.1 t70 64.51 23.02 12.83 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.844 0.831 . . . . 0.0 110.866 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -114.08 76.62 1.0 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.502 177.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -72.91 104.7 4.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.277 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.488 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -75.53 -61.22 1.99 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.458 -168.645 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.488 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 3.3 p90 -162.48 172.34 15.65 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.794 -173.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.503 ' NH2' ' HH2' ' A' ' 70' ' ' TRP . 4.5 ptp180 -141.79 133.32 26.82 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.5 tp -121.23 123.48 42.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.164 0.507 . . . . 0.0 110.545 -173.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -109.23 164.42 12.47 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.658 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.9 m -141.93 156.2 45.49 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 179.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -74.57 162.93 28.3 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 168.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -70.63 -4.8 25.16 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -171.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -98.57 -16.13 19.24 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.142 0.496 . . . . 0.0 110.471 173.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.69 15.61 75.75 Favored Glycine 0 CA--C 1.52 0.392 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.597 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.3 p -86.33 -3.37 58.97 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -158.76 120.31 3.44 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -105.22 145.59 30.43 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -178.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -153.34 158.92 42.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.457 -176.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 166.83 -150.53 17.61 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.564 -0.826 . . . . 0.0 112.078 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.561 ' HD3' ' HB2' ' A' ' 79' ' ' GLU . 38.9 ttmt -133.21 140.95 47.82 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 -178.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.5 t -134.56 138.12 44.34 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.759 ' HB3' ' HA ' ' A' ' 79' ' ' GLU . 22.5 p90 -148.12 159.4 43.97 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.225 -0.59 . . . . 0.0 111.06 178.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.416 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 64.3 t80 -124.34 129.47 50.77 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.877 -176.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 49.9 mm -100.01 118.56 46.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 179.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.428 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 82.4 t60 -146.5 119.1 8.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.07 -0.513 . . . . 0.0 109.646 -178.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.463 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 0.9 OUTLIER 63.84 31.93 13.72 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.418 0.449 . . . . 0.0 110.151 -175.687 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.2 mm? 71.84 -3.75 2.11 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.43 -176.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 73' ' ' HIS . 93.1 mt -65.12 123.75 20.34 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.726 0.298 . . . . 0.0 110.417 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -114.01 108.38 16.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.296 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.484 ' CE1' HG21 ' A' ' 150' ' ' ILE . 0.5 OUTLIER -129.94 109.83 11.19 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.22 177.368 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.759 ' HA ' ' HB3' ' A' ' 70' ' ' TRP . 11.4 pt-20 -96.64 143.71 27.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.091 -176.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -132.96 136.68 46.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.041 177.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -82.19 127.61 33.33 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 176.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 48.0 pt -126.52 158.38 36.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.121 0.486 . . . . 0.0 111.284 -175.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -159.26 170.16 22.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.793 174.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.537 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 39.4 p90 -167.93 146.59 4.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.118 0.485 . . . . 0.0 110.411 173.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -89.76 167.11 13.13 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.342 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.52 HG21 ' CH2' ' A' ' 28' ' ' TRP . 47.2 mm -114.36 89.46 17.87 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.572 -177.091 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -63.2 163.46 22.97 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.802 2.335 . . . . 0.0 111.925 175.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.425 HD12 ' N ' ' A' ' 88' ' ' ILE . 2.0 mp -62.31 -23.79 33.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-O 121.145 0.498 . . . . 0.0 110.938 -178.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.535 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 1.3 p -72.79 -12.75 61.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -178.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -73.02 141.0 81.02 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -97.55 8.63 36.05 Favored 'Cis proline' 0 N--CA 1.458 -0.564 0 C-N-CA 124.437 -1.068 . . . . 0.0 112.895 -0.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 25.2 m -60.6 -32.92 72.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.409 0.623 . . . . 0.0 110.429 -178.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.535 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 29.6 m -126.3 132.58 51.61 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 172.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.3 144.74 97.43 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.693 0.282 . . . . 0.0 111.509 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -82.51 158.35 16.81 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.693 2.262 . . . . 0.0 112.24 177.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -83.31 115.83 22.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.223 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.537 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 5.0 mp -73.9 131.38 35.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.294 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.431 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -100.72 123.0 44.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.933 0.396 . . . . 0.0 110.904 -179.022 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.0 t -129.33 87.09 54.56 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.37 178.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.75 -19.37 45.94 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 123.273 2.648 . . . . 0.0 113.917 -173.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.462 ' O ' ' HD3' ' A' ' 105' ' ' LYS . 7.8 tp10 -84.53 3.86 34.6 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.971 0.415 . . . . 0.0 110.985 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.7 mt -123.38 22.01 9.37 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 122.161 -0.337 . . . . 0.0 111.005 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -69.29 89.32 0.47 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.113 0.483 . . . . 0.0 111.146 -177.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 60.49 25.44 63.05 Favored Glycine 0 CA--C 1.52 0.358 0 CA-C-N 115.395 -0.821 . . . . 0.0 113.915 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 101' ' ' GLU . 19.8 ptmt -116.08 13.41 15.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.178 0.489 . . . . 0.0 111.835 -177.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.2 t . . . . . 0 C--N 1.325 -0.488 0 CA-C-O 121.095 0.474 . . . . 0.0 110.118 172.57 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.407 0 N-CA-C 111.859 -0.496 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 98' ' ' ALA . 17.5 ptpt -105.06 140.32 38.41 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 178.11 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 2.8 pp -101.03 161.58 3.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.516 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 73.3 m -138.47 161.93 35.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.019 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.4 mt -103.75 167.74 9.59 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.795 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.0 t -57.81 156.52 8.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.143 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -50.8 -36.33 36.6 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.282 -178.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.43 ' O ' ' HD2' ' A' ' 123' ' ' PRO . 19.4 m170 -67.06 -21.58 65.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.591 -172.046 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -68.65 -36.55 78.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.217 -178.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.565 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 26.8 ttpp -60.97 -49.52 88.74 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -174.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.565 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 20.7 Cg_exo -66.82 -39.41 14.86 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 121.662 1.575 . . . . 0.0 112.19 174.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 51.4 tp -59.69 -49.28 78.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.129 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.402 ' O ' HG21 ' A' ' 129' ' ' VAL . 58.9 t-105 -57.62 -52.21 66.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.908 -176.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.09 -13.29 62.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.597 -176.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -91.82 -26.73 18.38 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.944 0.402 . . . . 0.0 110.376 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -85.35 -44.46 12.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.209 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.491 HG13 ' HA ' ' A' ' 130' ' ' PRO . 91.9 t -51.97 138.9 34.07 Favored Pre-proline 0 N--CA 1.471 0.577 0 O-C-N 123.704 0.627 . . . . 0.0 111.093 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.491 ' HA ' HG13 ' A' ' 129' ' ' VAL . 4.7 Cg_exo -81.48 -152.38 0.78 Allowed 'Cis proline' 0 C--N 1.353 0.814 0 C-N-CA 124.574 -1.011 . . . . 0.0 113.118 3.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm 76.02 -20.67 0.35 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.657 0.783 . . . . 0.0 111.322 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.418 ' H ' ' C ' ' A' ' 130' ' ' PRO . 0.1 OUTLIER -81.8 -179.28 7.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.74 0.305 . . . . 0.0 110.546 179.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -179.86 -179.57 48.79 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.14 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 55.5 tp -66.75 -37.21 84.19 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 122.625 0.37 . . . . 0.0 111.204 -176.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.31 -38.8 77.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.406 0.622 . . . . 0.0 110.404 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -71.67 -32.45 67.89 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.009 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 57.5 tp -66.55 -45.57 78.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.454 -179.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' MET . . . . . 0.514 ' HE2' ' CD2' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -70.0 -35.94 74.77 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.119 -177.397 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -76.63 -50.47 13.69 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 86.9 mt -89.58 -14.06 35.89 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -173.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -108.16 -63.42 0.56 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.632 -179.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.493 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 60.9 tp -67.59 -40.83 84.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.471 0.177 . . . . 0.0 111.462 -175.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.08 -61.48 6.52 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.24 -0.505 . . . . 0.0 113.259 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . 0.43 ' O ' HG23 ' A' ' 148' ' ' VAL . 45.0 Cg_exo -59.17 -33.76 98.3 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.58 2.186 . . . . 0.0 112.568 177.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -62.7 -41.74 99.29 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.036 0.446 . . . . 0.0 110.424 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 97.9 mt -59.72 -36.14 75.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.628 177.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.79 -9.7 58.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.556 -178.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 144' ' ' PRO . 60.4 t -91.82 -56.04 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.668 0.271 . . . . 0.0 111.135 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -89.63 -41.59 11.88 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -172.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.555 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.9 mm -56.2 -52.86 69.53 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -172.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.555 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 51.0 Cg_exo -55.44 -40.87 83.13 Favored 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.04 1.827 . . . . 0.0 112.356 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -68.79 -39.99 79.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.234 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.558 HD12 ' HD2' ' A' ' 156' ' ' LYS . 21.7 tp -64.41 -28.93 70.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.983 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . 0.55 HG13 ' O ' ' A' ' 150' ' ' ILE . 78.8 mt -63.92 -53.28 46.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.571 177.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -69.64 -14.43 62.81 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.175 0.512 . . . . 0.0 110.22 -178.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . 0.558 ' HD2' HD12 ' A' ' 153' ' ' LEU . 28.1 ttmt -69.03 -13.55 62.51 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.769 -178.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 91.6 -16.7 58.54 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.275 173.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.9 p -73.45 -31.58 33.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.701 0.286 . . . . 0.0 110.932 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.541 HD11 HD23 ' A' ' 153' ' ' LEU . 57.4 mt . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.496 178.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.418 ' O ' HG22 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 120.726 0.298 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.47 ' O ' HG22 ' A' ' 10' ' ' VAL . 22.2 m -57.78 -54.74 43.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.355 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -62.53 -36.41 82.5 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.496 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.2 tpm_? -61.34 -44.5 97.08 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.794 0.331 . . . . 0.0 110.435 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.464 ' O ' HG13 ' A' ' 13' ' ' ILE . 92.0 t -67.5 -46.58 82.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.818 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.47 HG22 ' O ' ' A' ' 6' ' ' THR . 88.7 t -58.01 -45.28 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.885 -177.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.2 m -65.7 -19.37 65.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -103.59 13.22 33.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.655 0.264 . . . . 0.0 111.266 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 9' ' ' VAL . 52.1 mt -122.4 89.53 49.3 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.04 161.06 5.34 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.549 2.833 . . . . 0.0 113.723 -175.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.443 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 35.6 m -97.56 179.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.983 -179.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.97 HD22 ' HB3' ' A' ' 35' ' ' GLU . 7.1 mp -108.1 154.08 22.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.271 -176.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HG2' ' OE1' ' A' ' 34' ' ' GLU . 36.1 mmtm -78.85 -66.47 0.86 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.536 0.684 . . . . 0.0 109.176 171.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.4 m -75.68 126.64 31.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.686 -176.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -120.77 81.82 1.82 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.415 0.626 . . . . 0.0 109.887 171.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -125.83 -173.38 2.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.895 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -127.27 -177.19 14.75 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.204 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.453 ' HD2' ' O ' ' A' ' 88' ' ' ILE . 39.3 Cg_exo -61.94 -5.4 6.11 Favored 'Trans proline' 0 CA--C 1.533 0.45 0 C-N-CA 123.265 2.644 . . . . 0.0 113.254 -179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.3 mtm105 -67.22 -41.64 85.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.305 0.574 . . . . 0.0 110.015 175.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.524 ' HB3' HD22 ' A' ' 27' ' ' LEU . 5.6 m-20 -92.44 95.11 9.46 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.102 177.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -58.69 -47.17 85.44 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -170.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -72.33 -38.69 68.57 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.085 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 24' ' ' ASP . 3.6 mm? -68.58 -29.19 67.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.003 0.43 . . . . 0.0 110.252 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.492 ' O ' HD22 ' A' ' 32' ' ' LEU . 63.3 t-105 -62.24 -47.69 83.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.978 175.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 50.7 t -57.26 -35.1 47.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.644 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.2 -39.01 75.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.911 176.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.683 ' NH2' ' HG3' ' A' ' 91' ' ' PRO . 27.5 ttt-85 -64.26 -39.78 94.65 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.054 -0.351 . . . . 0.0 110.054 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.492 HD22 ' O ' ' A' ' 28' ' ' TRP . 4.0 mm? -52.72 -58.48 6.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.002 177.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -61.7 -35.48 78.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 121.248 -0.181 . . . . 0.0 111.105 -177.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.549 ' OE1' ' HG2' ' A' ' 17' ' ' LYS . 46.0 mm-40 -62.34 -54.63 37.68 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.484 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.97 ' HB3' HD22 ' A' ' 16' ' ' LEU . 15.5 pt-20 -77.57 -27.08 51.33 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.515 -177.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.551 ' O ' HG13 ' A' ' 40' ' ' ILE . 2.0 m-85 -55.06 -45.0 75.26 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 169.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -59.98 -41.58 92.31 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.86 0.362 . . . . 0.0 110.598 176.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.3 t -60.81 -43.7 97.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.938 176.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.464 ' O ' HG23 ' A' ' 43' ' ' VAL . 79.2 mt -61.35 -49.97 74.81 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.878 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.0 mt -53.1 -43.36 48.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.58 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.87 -44.26 97.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.682 0.277 . . . . 0.0 110.49 -179.297 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -66.8 -41.3 87.79 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.854 0.359 . . . . 0.0 110.204 177.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.5 HG12 ' HE2' ' A' ' 47' ' ' LYS . 80.4 t -59.92 -42.93 91.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.731 178.385 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 44.0 mt-10 -55.83 -54.08 48.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.506 177.213 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -61.13 -50.26 73.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.662 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.657 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 10.5 t30 -72.39 -32.46 66.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.285 -169.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.5 ' HE2' HG12 ' A' ' 43' ' ' VAL . 42.8 mtmt -71.33 -45.53 62.78 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.845 176.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -69.61 -18.73 63.63 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.236 0.541 . . . . 0.0 110.226 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.13 -2.3 47.88 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.806 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.5 t70 59.62 37.7 22.39 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.842 0.829 . . . . 0.0 109.329 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -133.44 29.29 3.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.135 -173.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.657 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 9.6 p-10 -69.16 105.34 2.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.691 0.758 . . . . 0.0 110.012 178.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 43.5 p-90 -108.94 10.43 26.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.309 -170.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 37.2 p90 -158.05 156.93 31.94 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.651 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.421 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 21.6 mmm180 -130.08 123.77 31.23 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.99 -1.004 . . . . 0.0 108.934 171.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 52.0 mt -123.56 124.62 43.22 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.149 0.5 . . . . 0.0 110.63 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -116.6 150.17 38.48 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.3 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.4 m -106.77 147.63 29.43 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.059 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -77.78 172.33 13.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 172.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -62.06 -23.45 66.5 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -175.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -91.99 -20.68 21.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.694 -177.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.66 16.9 80.01 Favored Glycine 0 C--O 1.228 -0.223 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.588 -175.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.0 p -98.79 -16.72 18.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.969 0.414 . . . . 0.0 111.367 -176.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -136.99 125.85 24.12 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.497 179.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 34.1 m95 -109.42 137.65 46.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.1 p90 -145.08 160.26 41.68 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.463 -176.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.421 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 162.75 -159.33 31.68 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.33 -0.938 . . . . 0.0 112.51 178.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -121.23 146.83 46.4 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.898 0.38 . . . . 0.0 110.972 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 51.1 t -112.34 123.96 51.42 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 168.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.439 ' HD1' ' HG2' ' A' ' 79' ' ' GLU . 6.9 m0 -106.02 122.07 45.41 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.788 -177.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -118.74 118.66 32.22 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 176.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 30.8 mm -99.88 119.95 48.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -127.62 115.34 18.62 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.04 -176.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.479 ' C ' HD22 ' A' ' 75' ' ' LEU . 39.7 m-20 67.65 -85.8 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 124.027 0.829 . . . . 0.0 110.432 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.479 HD22 ' C ' ' A' ' 74' ' ' ASP . 3.0 mm? -137.04 0.63 2.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.882 0.372 . . . . 0.0 110.108 178.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.8 mt -108.69 149.61 28.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.335 -170.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -110.19 119.64 39.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.784 179.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -110.06 115.13 29.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.439 ' HG2' ' HD1' ' A' ' 70' ' ' TRP . 30.5 mt-10 -100.63 136.56 40.32 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.635 -175.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -128.93 116.76 19.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.814 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.73 131.83 36.74 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 176.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.449 HG22 HG22 ' A' ' 99' ' ' VAL . 23.3 pt -126.21 147.9 30.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.909 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -155.09 141.6 18.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.761 178.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.569 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 44.7 p90 -156.25 147.29 22.18 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.362 0.601 . . . . 0.0 111.652 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.519 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 5.2 p-10 -92.26 156.29 17.39 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.433 178.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.7 mm -104.88 90.87 3.83 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.403 179.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.519 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 71.5 Cg_exo -48.53 148.78 7.7 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.3 2.667 . . . . 0.0 113.189 -178.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.453 ' O ' ' HD2' ' A' ' 22' ' ' PRO . 50.3 mm -58.43 -27.54 33.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.1 -178.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.738 HG21 ' HB ' ' A' ' 92' ' ' THR . 4.1 m -93.52 17.58 11.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.964 0.411 . . . . 0.0 111.588 -178.173 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.48 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 87.4 t80 -68.56 138.24 91.07 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 174.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.683 ' HG3' ' NH2' ' A' ' 31' ' ' ARG . 35.7 Cg_endo -97.83 12.35 33.59 Favored 'Cis proline' 0 C--N 1.346 0.446 0 C-N-CA 124.377 -1.093 . . . . 0.0 113.096 -1.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.738 ' HB ' HG21 ' A' ' 89' ' ' THR . 24.3 m -56.38 -35.82 68.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.401 0.619 . . . . 0.0 109.805 177.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 52.5 m -117.86 125.31 50.27 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.368 -0.833 . . . . 0.0 108.761 171.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.76 144.75 97.67 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-O 120.779 0.323 . . . . 0.0 111.528 -174.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -71.52 124.91 10.72 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.777 2.318 . . . . 0.0 111.8 177.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.686 ' HB3' ' HD2' ' A' ' 114' ' ' LYS . 36.9 mt-10 -75.94 103.42 6.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.792 178.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.569 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 58.3 mt -70.01 136.36 26.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.626 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -112.96 130.1 56.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.686 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.449 HG22 HG22 ' A' ' 82' ' ' ILE . 36.3 t -121.56 88.18 46.3 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.944 179.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -55.6 -29.53 70.54 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.999 2.466 . . . . 0.0 113.308 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -66.73 -36.25 82.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.777 0.322 . . . . 0.0 111.315 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 85.3 mt -90.96 1.06 57.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.972 0.415 . . . . 0.0 111.059 -177.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -65.24 109.58 2.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.821 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 98.58 -27.57 18.98 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.363 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -80.67 -12.41 59.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.888 0.375 . . . . 0.0 111.71 -175.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 C--N 1.322 -0.596 0 CA-C-O 120.923 0.392 . . . . 0.0 110.427 177.9 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.685 0 N-CA-C 112.437 -0.265 . . . . 0.0 112.437 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.686 ' HD2' ' HB3' ' A' ' 96' ' ' GLU . 71.3 mmtt -85.68 137.99 32.44 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.598 0.237 . . . . 0.0 110.625 -176.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.453 ' CD1' ' HB ' ' A' ' 97' ' ' ILE . 46.7 pt -76.83 157.61 5.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.428 0.633 . . . . 0.0 111.918 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 49.5 t -125.29 113.53 17.73 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.1 173.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 88.3 mt -81.9 -82.2 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.984 -176.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.6 t -163.39 154.42 16.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.368 -177.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -62.54 -30.03 71.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.504 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.6 t60 -73.4 -20.05 60.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.215 -175.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -68.54 -40.01 80.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.892 -174.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -61.35 -55.05 47.09 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -174.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.11 -32.77 83.35 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.702 1.601 . . . . 0.0 112.164 175.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.53 -43.51 76.58 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.892 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.525 ' O ' HG21 ' A' ' 129' ' ' VAL . 70.0 t-105 -61.56 -57.48 11.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.53 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.36 -30.06 68.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.929 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -77.7 -23.04 49.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.814 0.34 . . . . 0.0 111.529 -177.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -106.0 10.29 32.29 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.525 HG21 ' O ' ' A' ' 125' ' ' TRP . 97.6 t -87.63 139.68 31.5 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.507 ' HA ' HG11 ' A' ' 129' ' ' VAL . 64.8 Cg_endo -95.6 -146.19 0.16 OUTLIER 'Cis proline' 0 C--N 1.353 0.77 0 C-N-CA 124.972 -0.845 . . . . 0.0 113.781 5.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.479 ' H ' ' HB2' ' A' ' 130' ' ' PRO . 49.3 mtmt 75.07 11.06 3.63 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.698 -176.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -91.64 144.61 25.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.985 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -146.57 167.42 28.09 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 178.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 43.6 tp -55.24 -33.13 62.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.143 0.471 . . . . 0.0 111.692 -177.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.87 -47.27 77.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.987 0.422 . . . . 0.0 111.43 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -71.29 -38.45 71.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.463 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.4 HD12 ' CZ3' ' A' ' 125' ' ' TRP . 67.2 tp -65.33 -44.57 87.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.43 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 15.8 tpt -66.56 -47.97 71.12 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.927 0.394 . . . . 0.0 110.916 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.2 -44.8 64.7 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.131 -175.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.8 mt -94.74 -0.24 54.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.796 0.331 . . . . 0.0 111.665 -174.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -113.24 -75.12 0.69 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.282 -0.961 . . . . 0.0 112.722 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.44 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 9.8 tt -67.49 -36.56 81.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.676 0.274 . . . . 0.0 110.832 -175.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.67 -61.85 6.86 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.177 -0.535 . . . . 0.0 113.274 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . 0.436 ' O ' HG21 ' A' ' 148' ' ' VAL . 32.9 Cg_exo -60.14 -33.04 95.32 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.549 2.166 . . . . 0.0 112.53 177.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 60.3 t90 -60.08 -39.55 86.48 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.903 0.383 . . . . 0.0 110.747 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 95.2 mt -58.04 -41.81 84.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.751 178.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.57 -15.06 63.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.819 -176.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . 0.436 HG21 ' O ' ' A' ' 144' ' ' PRO . 56.3 t -88.06 -42.49 14.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.469 -177.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -104.02 -44.38 5.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -173.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.54 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.3 mm -55.99 -52.74 70.17 Favored Pre-proline 0 CA--C 1.54 0.562 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -170.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.54 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 51.8 Cg_exo -56.46 -31.62 86.47 Favored 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 122.01 1.807 . . . . 0.0 112.929 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -86.96 -26.72 23.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.833 0.349 . . . . 0.0 110.731 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.492 HD22 HD12 ' A' ' 159' ' ' ILE . 24.8 tp -70.21 -40.52 74.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.998 178.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 73.6 mt -63.19 -44.51 99.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.229 176.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.452 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . 6.3 tp60 -69.44 -22.94 63.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.06 -177.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -83.19 -2.21 54.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.169 0.509 . . . . 0.0 110.303 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 72.05 24.18 76.88 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 115.817 -0.629 . . . . 0.0 113.025 175.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 40.2 t -84.53 -31.34 7.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.216 0.531 . . . . 0.0 110.722 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.492 HD12 HD22 ' A' ' 153' ' ' LEU . 53.8 mt . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.53 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.441 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 CA--C 1.529 0.166 0 CA-C-O 120.723 0.297 . . . . 0.0 111.395 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.7 m -64.0 -36.67 84.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.054 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.17 -37.17 72.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.008 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -61.46 -38.84 88.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.894 0.378 . . . . 0.0 110.416 175.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 5' ' ' ALA . 88.5 t -57.28 -52.73 52.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.414 176.061 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 65.0 t -64.52 -35.32 74.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.504 -177.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.6 m -70.45 -36.28 73.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.801 -177.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -96.52 -16.93 20.84 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -176.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.423 HD12 HG13 ' A' ' 9' ' ' VAL . 25.6 mt -108.56 90.21 7.0 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 177.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -40.12 128.24 2.15 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.959 3.106 . . . . 0.0 113.872 -174.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.5 m -76.26 146.03 9.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.654 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mp -100.94 131.64 46.72 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.109 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -110.7 -29.38 8.03 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.16 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.6 m -68.32 97.17 0.71 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.455 175.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -134.76 128.41 32.82 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.809 0.337 . . . . 0.0 110.588 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -146.97 -37.39 0.22 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.514 178.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.47 161.36 10.89 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.935 -0.65 . . . . 0.0 111.599 178.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -69.47 -7.45 20.99 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.73 2.286 . . . . 0.0 112.303 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.415 ' CG ' HG22 ' A' ' 88' ' ' ILE . 22.8 mmm180 -88.6 -3.01 58.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.718 178.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -112.76 103.55 11.56 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.596 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -61.09 -52.18 66.01 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -170.28 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.544 ' HG3' HD23 ' A' ' 27' ' ' LEU . 11.0 pt-20 -72.87 -38.92 66.85 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.576 -0.45 . . . . 0.0 112.018 -171.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.544 HD23 ' HG3' ' A' ' 26' ' ' GLU . 4.0 mm? -71.98 -31.15 65.98 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.682 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 -68.21 -33.0 73.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.131 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.596 HG23 ' O ' ' A' ' 25' ' ' ARG . 67.0 t -58.2 -49.98 79.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.641 177.007 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -61.08 -47.25 87.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.784 0.326 . . . . 0.0 110.549 178.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.535 HH22 ' HA2' ' A' ' 133' ' ' GLY . 45.9 ttt-85 -64.44 -35.24 80.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -176.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -60.59 -53.17 60.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.81 -177.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? -67.06 -41.14 86.96 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.046 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -64.71 -38.06 89.7 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.868 -179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -66.85 -36.32 82.07 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.446 ' O ' HG13 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -65.0 -46.94 79.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.25 178.731 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -63.03 -34.75 78.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.814 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.531 ' HG ' ' HB1' ' A' ' 135' ' ' ALA . 48.4 t -60.16 -46.64 88.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.866 174.502 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.511 ' O ' HG23 ' A' ' 43' ' ' VAL . 84.1 mt -61.02 -51.5 68.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.807 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.459 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 80.5 mt -56.81 -40.84 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.339 -178.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -45.6 87.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.037 0.446 . . . . 0.0 110.304 178.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -67.63 -34.97 78.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.341 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 39' ' ' LEU . 84.1 t -62.35 -40.78 89.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.319 175.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 49.3 mt-10 -58.78 -48.75 80.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.906 0.384 . . . . 0.0 110.198 175.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -57.48 -40.25 78.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.837 177.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.52 -51.99 65.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.795 176.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.45 ' HE2' HG13 ' A' ' 43' ' ' VAL . 65.3 mttm -64.29 -28.86 70.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.384 -176.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -59.17 -41.03 87.44 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.638 175.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -90.56 -1.53 57.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.143 0.496 . . . . 0.0 110.49 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.0 t70 69.38 10.54 7.78 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.853 -178.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -95.76 68.17 2.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.521 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -81.67 86.6 6.38 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -97.85 -2.76 40.13 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -165.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.49 ' HB2' ' HG ' ' A' ' 69' ' ' CYS . 6.1 p90 -159.13 153.27 23.64 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.777 -0.769 . . . . 0.0 111.666 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -134.62 128.54 33.34 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 171.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.9 tp -131.08 125.13 32.38 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.58 -173.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -136.3 169.14 18.13 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.4 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 61.5 p -152.25 177.9 10.07 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.126 -179.025 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.461 ' OD1' ' HB2' ' A' ' 61' ' ' GLU . 4.2 p30 -71.52 163.89 26.88 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 168.569 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -73.38 -9.89 59.16 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.787 0.327 . . . . 0.0 111.737 -174.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.461 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 9.1 mm-40 -74.57 -36.43 63.06 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 171.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.99 20.97 69.11 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.509 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.3 p -90.74 -15.13 30.77 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.872 0.368 . . . . 0.0 111.556 -178.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 43.4 mtm180 -146.31 126.17 13.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.219 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.4 ' CD2' ' HB3' ' A' ' 58' ' ' SER . 50.0 m95 -114.26 158.27 21.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.693 -175.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -154.95 152.72 30.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.317 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.41 -162.61 29.47 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.336 178.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.416 ' HE3' ' HB2' ' A' ' 68' ' ' LYS . 35.6 ttmt -152.63 147.0 25.63 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.946 -0.391 . . . . 0.0 109.946 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.49 ' HG ' ' HB2' ' A' ' 54' ' ' PHE . 58.8 m -118.41 135.23 54.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.357 179.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 31.3 m-90 -114.52 121.69 44.28 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 176.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.438 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 47.8 t80 -120.66 122.95 41.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.195 0.521 . . . . 0.0 110.56 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 27.8 mm -102.87 114.14 41.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.557 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 14.5 t60 -130.21 105.23 7.78 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.137 179.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.424 ' C ' ' H ' ' A' ' 76' ' ' LEU . 20.3 t70 48.08 74.07 0.18 Allowed 'General case' 0 N--CA 1.465 0.297 0 O-C-N 124.307 1.004 . . . . 0.0 111.914 177.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 72.65 -33.52 0.27 Allowed 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.276 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.424 ' H ' ' C ' ' A' ' 74' ' ' ASP . 90.5 mt -74.87 123.56 25.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.032 0.444 . . . . 0.0 111.19 -178.052 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -115.66 119.01 34.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.213 177.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.417 ' CE1' ' HD2' ' A' ' 71' ' ' TYR . 7.1 p90 -140.03 144.96 37.17 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.503 177.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.04 148.8 50.12 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.333 -174.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -120.61 126.08 49.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.672 -177.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -88.2 114.85 25.23 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.48 HG23 HG23 ' A' ' 99' ' ' VAL . 47.9 pt -124.89 150.07 29.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.282 0.563 . . . . 0.0 112.137 -172.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -156.18 159.58 39.1 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.649 175.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.487 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 43.7 p90 -165.13 163.61 20.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.92 0.39 . . . . 0.0 110.741 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -112.16 157.6 20.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.654 -178.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.429 ' HA ' ' HD2' ' A' ' 87' ' ' PRO . 49.5 mm -107.26 90.32 5.57 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.657 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 19.8 Cg_endo -56.37 157.86 17.06 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 122.996 2.464 . . . . 0.0 112.948 -177.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.415 HG22 ' CG ' ' A' ' 23' ' ' ARG . 70.1 mt -61.85 -26.41 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.289 -179.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.7 p -81.41 9.24 7.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.112 -0.494 . . . . 0.0 112.228 -176.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.461 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 67.5 t80 -72.93 141.18 81.48 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.461 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 97.0 Cg_endo -96.68 14.23 36.98 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.335 -1.111 . . . . 0.0 113.53 1.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.6 m -64.6 -35.53 81.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.372 0.606 . . . . 0.0 110.343 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.0 m -111.99 131.34 55.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 174.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.438 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -77.59 143.29 67.62 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 120.634 0.254 . . . . 0.0 111.166 -178.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 5.9 Cg_exo -79.97 123.51 5.19 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.208 2.606 . . . . 0.0 111.357 176.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 1.015 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 1.4 mp0 -84.59 126.16 33.09 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.178 -179.096 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.487 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 61.7 mt -72.86 134.6 29.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.459 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.43 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -105.89 128.93 54.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.721 0.296 . . . . 0.0 110.358 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.48 HG23 HG23 ' A' ' 82' ' ' ILE . 14.3 t -128.41 86.44 57.8 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.404 -178.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.8 -27.03 83.99 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 122.911 2.408 . . . . 0.0 112.814 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -65.11 -27.37 68.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.122 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 72.7 mt -96.87 2.94 52.31 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.689 -176.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -64.15 118.76 9.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.792 0.329 . . . . 0.0 110.746 178.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 85.78 -21.94 13.17 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.995 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -74.61 -45.87 42.19 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -179.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.7 t . . . . . 0 C--N 1.325 -0.476 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.628 176.331 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.429 0 CA-C-O 120.48 -0.067 . . . . 0.0 112.987 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 1.015 ' HD3' ' HB2' ' A' ' 96' ' ' GLU . 92.8 mttt -100.42 158.14 16.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.107 0.48 . . . . 0.0 111.211 -177.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 39.5 pt -78.96 176.57 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.846 -176.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 48.3 t -124.46 154.31 40.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.018 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 89.7 mt -124.97 -171.14 2.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.475 -176.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 7.1 t -89.91 158.48 17.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.919 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -62.93 -32.54 73.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.879 -177.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -73.95 -18.29 60.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.252 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -71.57 -38.27 70.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.344 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.422 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 73.4 mmtt -55.67 -58.76 13.97 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -176.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.422 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 38.2 Cg_endo -66.7 -34.61 31.22 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 121.744 1.629 . . . . 0.0 111.871 178.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.4 tp -60.83 -46.34 90.95 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.595 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.503 ' CZ3' HD11 ' A' ' 137' ' ' LEU . 40.8 t-105 -57.83 -57.08 14.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.698 178.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.87 -24.23 67.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.258 -174.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 -85.28 -20.52 29.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.714 0.292 . . . . 0.0 110.975 -177.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -105.81 36.53 2.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.125 0.488 . . . . 0.0 111.465 -177.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 98.2 t -116.77 130.96 24.18 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.473 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 89.6 Cg_endo -85.03 -149.64 0.49 Allowed 'Cis proline' 0 C--N 1.348 0.505 0 C-N-CA 123.973 -1.261 . . . . 0.0 113.267 1.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 99.3 mttt 75.98 9.16 3.41 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.862 0.865 . . . . 0.0 111.027 -174.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -114.94 165.6 12.69 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.535 ' HA2' HH22 ' A' ' 31' ' ' ARG . . . -163.15 175.17 39.49 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.957 -178.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 44.6 tp -67.61 -38.79 84.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.724 0.297 . . . . 0.0 110.606 -177.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.531 ' HB1' ' HG ' ' A' ' 38' ' ' SER . . . -60.7 -35.94 77.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.399 0.618 . . . . 0.0 110.415 176.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -71.55 -33.5 69.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.305 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.503 HD11 ' CZ3' ' A' ' 125' ' ' TRP . 54.8 tp -64.21 -35.62 81.39 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.844 177.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.1 mmt -69.8 -45.03 68.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.919 0.39 . . . . 0.0 110.873 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.59 -44.12 67.98 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.856 -177.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.3 mt -96.42 0.85 51.06 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -174.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.54 -68.78 0.22 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.812 -178.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 58.6 tp -65.38 -41.0 94.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.663 0.268 . . . . 0.0 111.104 -176.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.0 -61.9 6.46 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.413 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . 0.482 ' O ' HG23 ' A' ' 148' ' ' VAL . 24.0 Cg_endo -64.19 -30.37 64.71 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.492 2.128 . . . . 0.0 112.728 177.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 85.4 t90 -59.66 -45.93 90.56 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.016 0.436 . . . . 0.0 110.479 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 96.7 mt -58.53 -35.36 72.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.953 179.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.28 0.41 32.9 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -176.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 144' ' ' PRO . 89.6 t -95.0 -55.39 6.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.893 0.378 . . . . 0.0 111.098 178.208 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -96.26 -41.3 8.74 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -173.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.537 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 44.6 mm -55.96 -53.61 61.32 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -169.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.537 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 50.9 Cg_exo -54.88 -42.73 66.13 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.853 1.702 . . . . 0.0 112.302 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -74.44 -29.59 61.55 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.476 0.655 . . . . 0.0 110.441 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.518 ' HB3' HD11 ' A' ' 159' ' ' ILE . 13.9 tp -69.1 -34.15 74.63 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.642 178.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 150' ' ' ILE . 79.8 mt -63.98 -43.21 97.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.375 175.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -66.11 -28.05 68.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.187 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . 0.498 ' HE2' HD11 ' A' ' 153' ' ' LEU . 37.2 mtmm -76.72 -20.6 56.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.816 0.341 . . . . 0.0 110.73 177.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 92.86 -8.02 76.58 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.916 -0.659 . . . . 0.0 114.045 170.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.4 p -67.06 -30.61 50.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 117.012 0.406 . . . . 0.0 111.642 -175.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.518 HD11 ' HB3' ' A' ' 153' ' ' LEU . 36.3 mt . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.518 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.462 ' O ' HG22 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 120.642 0.258 . . . . 0.0 111.281 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.491 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.7 OUTLIER -66.54 -46.89 74.63 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -175.938 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -66.27 -28.0 68.37 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.044 0.45 . . . . 0.0 110.203 -179.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -67.7 -43.54 79.85 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.154 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 5' ' ' ALA . 86.2 t -63.41 -40.72 90.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.462 177.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.491 HG22 ' O ' ' A' ' 6' ' ' THR . 91.6 t -64.12 -27.29 42.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.95 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.6 m -69.12 -26.68 65.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.737 0.303 . . . . 0.0 110.832 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -94.12 -7.82 41.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.772 0.32 . . . . 0.0 111.843 176.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.448 HG12 ' HB2' ' A' ' 42' ' ' TYR . 45.6 mt -118.55 86.75 29.68 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 175.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.641 ' HD2' ' HA ' ' A' ' 38' ' ' SER . 73.2 Cg_exo -49.3 151.99 6.04 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.71 2.94 . . . . 0.0 113.878 -172.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.586 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 30.2 m -85.15 151.83 3.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.414 178.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.498 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 7.1 mp -86.81 134.57 33.54 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.316 -179.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -91.41 -44.15 9.31 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.064 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 m -66.13 -74.8 0.1 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.627 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.44 ' OD1' ' HG3' ' A' ' 91' ' ' PRO . 38.8 t30 45.83 43.66 10.19 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.333 176.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.59 -84.49 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.378 -176.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 167.12 172.54 34.45 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.86 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -71.0 -11.34 29.09 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 123.184 2.589 . . . . 0.0 112.464 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 mtp-105 -66.94 -48.6 68.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.616 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.495 ' HB3' HD21 ' A' ' 27' ' ' LEU . 15.0 m-20 -84.31 104.9 14.72 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.567 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 72.5 mtm180 -58.12 -51.8 68.19 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.517 ' HG2' HD22 ' A' ' 27' ' ' LEU . 1.4 pm0 -72.83 -26.28 61.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.642 0.258 . . . . 0.0 111.405 -177.059 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.517 HD22 ' HG2' ' A' ' 26' ' ' GLU . 3.9 mm? -80.29 -30.95 38.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.709 0.29 . . . . 0.0 110.653 178.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.417 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 60.5 t-105 -67.35 -46.83 72.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.167 177.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 90.9 t -60.74 -38.36 78.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.943 0.402 . . . . 0.0 110.445 177.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -70.55 -32.89 70.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.901 0.382 . . . . 0.0 110.161 177.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 67.0 ttt-85 -69.21 -33.16 72.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.123 177.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 90.5 mt -58.39 -42.48 87.18 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.975 174.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -59.55 -47.52 85.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.282 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -54.94 -48.37 73.23 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.945 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -61.84 -48.2 81.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.084 178.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -65.11 -32.3 73.93 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -178.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -58.96 -45.3 90.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.228 0.537 . . . . 0.0 109.994 174.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.641 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 8.3 m -70.77 -44.22 67.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.57 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.427 ' O ' HG22 ' A' ' 43' ' ' VAL . 80.1 mt -60.17 -55.35 34.86 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.25 -179.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 85.9 mt -58.05 -46.52 88.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.72 -176.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -58.81 -49.03 79.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.649 -0.25 . . . . 0.0 110.786 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.448 ' HB2' HG12 ' A' ' 13' ' ' ILE . 67.6 t80 -63.06 -49.85 72.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.711 0.291 . . . . 0.0 111.106 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.612 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 93.8 t -59.49 -45.69 93.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.904 -177.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -67.29 -35.0 78.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.667 0.27 . . . . 0.0 111.109 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -60.14 -39.9 87.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.749 0.309 . . . . 0.0 110.256 173.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.439 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 4.9 m-20 -71.65 -32.44 67.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.856 177.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.612 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 34.0 mmtp -57.79 -43.86 85.9 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.209 0.528 . . . . 0.0 110.047 174.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -72.76 -21.46 61.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.933 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -91.72 2.17 56.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.361 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.7 t70 63.43 23.76 13.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.583 0.706 . . . . 0.0 110.874 178.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.439 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 16.9 t30 -125.3 66.52 1.14 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.691 0.758 . . . . 0.0 110.48 -178.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -86.27 106.45 17.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.283 -0.871 . . . . 0.0 108.882 174.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 45.9 p-90 -120.61 6.85 10.52 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -168.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -162.83 154.23 17.65 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.826 -0.75 . . . . 0.0 112.157 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -138.54 124.4 19.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.003 167.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.7 tp -117.13 124.54 49.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.709 -177.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -131.55 155.56 47.27 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.841 -174.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.6 t -149.12 176.99 10.01 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.105 0.479 . . . . 0.0 110.827 -177.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -86.11 176.73 7.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.463 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.437 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 41.5 mmtm -66.53 -19.94 65.9 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -174.753 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -87.36 -17.58 32.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.714 0.292 . . . . 0.0 110.408 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.13 28.63 73.17 Favored Glycine 0 C--N 1.332 0.354 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.552 -179.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.5 p -85.83 -33.1 21.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.04 0.448 . . . . 0.0 111.812 -177.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -129.18 116.1 18.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.661 -179.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -102.33 128.19 49.0 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -136.5 159.46 41.72 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.978 -176.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 172.34 -165.75 38.39 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 119.867 -1.159 . . . . 0.0 112.372 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.5 pttm -142.38 139.74 31.82 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.041 0.448 . . . . 0.0 110.624 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 79' ' ' GLU . 45.7 m -112.49 153.31 27.63 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.263 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 26.0 m-90 -117.67 123.57 46.43 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.025 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -117.96 120.56 38.21 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 177.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.9 mm -88.21 114.71 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.892 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -148.35 110.63 4.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.401 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.7 t70 66.83 62.93 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.338 175.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.3 mt 68.57 -13.12 0.33 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.143 -0.935 . . . . 0.0 113.158 173.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 78.9 mt -109.06 136.67 48.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.259 0.552 . . . . 0.0 111.869 -175.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -93.44 112.22 24.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.287 174.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -97.86 130.26 44.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.715 -0.22 . . . . 0.0 111.043 -178.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.403 ' HA ' ' O ' ' A' ' 69' ' ' CYS . 1.7 mp0 -96.97 136.1 38.02 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 174.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -126.19 123.93 39.3 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -88.82 131.3 35.14 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.144 0.497 . . . . 0.0 110.054 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.495 HG21 HG22 ' A' ' 99' ' ' VAL . 46.5 pt -131.78 151.37 35.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.602 -178.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -153.22 155.33 36.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.83 174.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 35.3 p90 -159.05 152.73 23.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.4 176.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.517 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 2.2 p30 -97.94 155.24 17.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.673 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.6 mm -106.25 91.12 5.3 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.979 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.517 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 51.4 Cg_exo -54.75 153.89 22.81 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.882 2.388 . . . . 0.0 112.373 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 43.4 mt -61.25 -24.93 34.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.179 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.2 p -88.83 13.32 12.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.049 -178.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.563 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 61.4 t80 -77.59 145.65 71.78 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 176.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.563 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 50.2 Cg_endo -91.45 14.25 50.44 Favored 'Cis proline' 0 C--N 1.349 0.571 0 C-N-CA 124.305 -1.123 . . . . 0.0 114.072 0.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 86.4 m -62.02 -44.65 96.25 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.02 0.438 . . . . 0.0 110.128 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 39.2 m -102.64 119.39 38.75 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.036 174.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.71 144.48 91.05 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -78.81 172.73 14.6 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 122.9 2.4 . . . . 0.0 112.868 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.596 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 19.5 mt-10 -107.75 122.18 46.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.197 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.4 ' O ' HG12 ' A' ' 115' ' ' ILE . 34.8 mm -75.55 124.38 33.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.508 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.53 ' HB1' ' HG2' ' A' ' 114' ' ' LYS . . . -109.38 129.53 55.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.928 0.394 . . . . 0.0 111.162 179.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.495 HG22 HG21 ' A' ' 82' ' ' ILE . 21.9 t -123.52 86.58 52.39 Favored Pre-proline 0 C--O 1.237 0.401 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.832 178.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.69 -31.36 94.7 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.289 2.659 . . . . 0.0 113.753 -173.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -68.58 -28.8 67.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.842 0.353 . . . . 0.0 110.973 -177.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 82.4 mt -97.42 13.26 30.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.666 0.269 . . . . 0.0 111.175 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.75 106.39 0.4 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.715 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 88.8 -1.15 83.26 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.974 178.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -93.55 -16.0 24.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.887 0.375 . . . . 0.0 110.842 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.49 ' HB ' HD23 ' A' ' 153' ' ' LEU . 3.3 t . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.098 -178.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.471 0 N-CA-C 112.192 -0.363 . . . . 0.0 112.192 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.596 ' HD3' ' HB2' ' A' ' 96' ' ' GLU . 84.5 mttt -86.31 124.4 32.63 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.084 0.469 . . . . 0.0 110.419 177.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.4 HG12 ' O ' ' A' ' 97' ' ' ILE . 37.4 pt -76.73 158.01 5.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.227 -176.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 25.8 p -91.94 124.04 35.75 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.604 178.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 89.0 mt -86.71 161.1 18.61 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.3 173.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.1 t -69.95 153.51 43.15 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.002 0.43 . . . . 0.0 111.268 -173.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -58.13 -49.62 76.32 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.883 -177.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -68.61 -4.07 14.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.69 -176.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -66.13 -47.39 74.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.863 -0.153 . . . . 0.0 110.96 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.509 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 39.6 mmtm -59.65 -51.97 77.29 Favored Pre-proline 0 CA--C 1.537 0.449 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.52 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.509 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 50.0 Cg_exo -56.44 -41.4 76.57 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 121.941 1.761 . . . . 0.0 112.193 174.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 45.4 tp -67.14 -38.04 84.83 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.01 0.433 . . . . 0.0 110.673 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.4 ' O ' HG21 ' A' ' 129' ' ' VAL . 66.8 t-105 -59.07 -57.44 13.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.294 178.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.21 -21.7 65.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.562 -178.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 123' ' ' PRO . 48.5 ttt180 -71.54 -29.34 64.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.482 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -98.61 -39.61 8.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.503 -177.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.538 HG11 ' HA ' ' A' ' 130' ' ' PRO . 70.5 t -57.52 142.84 76.35 Favored Pre-proline 0 CA--C 1.533 0.319 0 O-C-N 123.373 0.421 . . . . 0.0 110.261 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.538 ' HA ' HG11 ' A' ' 129' ' ' VAL . 5.0 Cg_exo -79.12 -163.07 3.21 Favored 'Cis proline' 0 C--N 1.355 0.872 0 C-N-CA 125.008 -0.83 . . . . 0.0 113.838 2.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.586 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 96.7 mttt 72.81 -18.53 0.35 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.545 0.738 . . . . 0.0 111.611 -178.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.457 ' H ' ' C ' ' A' ' 130' ' ' PRO . 8.8 t80 -77.01 158.51 30.55 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.131 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -159.63 -179.59 34.54 Favored Glycine 0 C--O 1.236 0.235 0 C-N-CA 119.999 -1.096 . . . . 0.0 112.84 -174.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.413 HD12 HD22 ' A' ' 137' ' ' LEU . 58.8 tp -64.38 -37.48 87.67 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 122.999 0.52 . . . . 0.0 111.195 -175.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.63 -40.68 75.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.523 0.678 . . . . 0.0 110.66 177.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -71.32 -35.37 71.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.968 178.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.413 HD22 HD12 ' A' ' 134' ' ' LEU . 50.2 tp -66.07 -37.12 85.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.167 178.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' MET . . . . . 0.819 ' HA ' ' HE3' ' A' ' 138' ' ' MET . 17.9 mmt -62.21 -48.18 81.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.865 0.364 . . . . 0.0 110.441 177.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.89 -49.12 49.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.086 -177.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.4 10.18 37.3 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -172.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -124.23 -67.19 0.2 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.295 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.582 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 53.7 tp -65.79 -42.51 90.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.788 -0.206 . . . . 0.0 111.038 -177.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.43 -61.44 6.99 Favored Glycine 0 CA--C 1.525 0.662 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.627 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . 0.412 ' O ' HG23 ' A' ' 148' ' ' VAL . 17.0 Cg_endo -59.59 -37.38 88.75 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.555 2.17 . . . . 0.0 112.799 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 68.6 t90 -61.44 -44.38 97.21 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.963 0.411 . . . . 0.0 110.248 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 94.2 mt -59.04 -36.19 74.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.007 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.0 -15.64 61.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.85 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 144' ' ' PRO . 61.4 t -93.02 -53.96 7.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.282 -178.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -90.75 -43.53 10.04 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -171.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.471 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.3 mm -59.51 -49.91 89.82 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -169.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 146' ' ' LEU . 50.5 Cg_exo -56.06 -30.81 80.27 Favored 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 122.105 1.87 . . . . 0.0 112.879 -178.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -87.26 -37.87 16.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 109.994 177.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.574 HD22 ' HD3' ' A' ' 156' ' ' LYS . 0.2 OUTLIER -59.24 -42.76 91.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.554 -179.865 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 72.0 mt -64.47 -39.63 86.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.018 0.437 . . . . 0.0 110.353 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -66.09 -27.31 67.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.026 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . 0.574 ' HD3' HD22 ' A' ' 153' ' ' LEU . 59.6 mtpt -63.93 -22.25 66.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.788 175.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 72.74 16.45 77.95 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.409 178.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 17.0 m -92.46 -6.18 10.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.072 0.463 . . . . 0.0 111.308 -178.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.462 HD11 HD11 ' A' ' 153' ' ' LEU . 55.6 mt . . . . . 0 C--N 1.322 -0.606 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.125 175.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.454 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.249 0 CA-C-O 120.53 0.205 . . . . 0.0 110.969 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.45 ' O ' HG21 ' A' ' 10' ' ' VAL . 6.0 m -56.5 -54.52 44.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.097 -178.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -64.91 -31.89 73.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.091 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -64.3 -44.36 91.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.606 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 5' ' ' ALA . 66.0 t -62.86 -38.51 82.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.469 179.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.45 HG21 ' O ' ' A' ' 6' ' ' THR . 61.6 t -62.66 -33.1 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.178 179.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -69.92 -25.66 63.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.479 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.413 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 42.6 mt-10 -93.63 -13.07 28.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.882 0.373 . . . . 0.0 111.227 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.7 mt -113.76 87.06 11.63 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.413 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 50.9 Cg_exo -54.58 147.04 50.44 Favored 'Trans proline' 0 C--O 1.237 0.463 0 C-N-CA 123.453 2.768 . . . . 0.0 113.175 -173.234 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.486 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.7 m -72.34 161.38 4.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.192 176.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.698 HD22 ' HG3' ' A' ' 31' ' ' ARG . 10.2 mp -79.97 134.7 36.27 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.114 0.483 . . . . 0.0 111.532 -173.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.471 ' HB3' ' HG3' ' A' ' 34' ' ' GLU . 59.6 tttm -60.25 -44.08 95.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.852 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.511 HG23 HD12 ' A' ' 27' ' ' LEU . 31.7 m -129.38 130.02 45.49 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.946 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.648 ' HA ' ' HD3' ' A' ' 31' ' ' ARG . 16.8 m120 -120.43 119.63 33.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.752 0.311 . . . . 0.0 110.519 174.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -153.75 170.7 20.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.084 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.45 167.19 42.64 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.291 -178.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -72.56 3.65 4.1 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.397 2.732 . . . . 0.0 113.027 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.601 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 1.1 mmp_? -94.17 -26.24 16.77 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.308 0.575 . . . . 0.0 109.903 174.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -83.43 75.87 9.96 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 172.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -53.98 -41.95 68.45 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -169.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -58.25 -52.1 67.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.212 0.53 . . . . 0.0 110.911 179.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.511 HD12 HG23 ' A' ' 18' ' ' THR . 3.1 mm? -76.7 -23.51 53.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.743 -177.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.547 ' CH2' HG22 ' A' ' 86' ' ' ILE . 28.5 t-105 -64.29 -52.1 60.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.462 175.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.5 t -63.5 -33.71 63.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.084 0.468 . . . . 0.0 110.054 178.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -70.28 -42.81 71.6 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.495 178.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.698 ' HG3' HD22 ' A' ' 16' ' ' LEU . 51.5 ttp85 -64.54 -42.96 95.38 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 176.32 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -54.53 -50.01 68.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.722 -177.74 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.04 -33.13 71.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.532 0.206 . . . . 0.0 111.143 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.471 ' HG3' ' HB3' ' A' ' 17' ' ' LYS . 71.0 mm-40 -70.23 -45.63 66.12 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.286 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.558 ' HB3' HD21 ' A' ' 16' ' ' LEU . 15.3 pt-20 -75.01 -27.46 60.13 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.161 177.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.524 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -55.28 -44.27 75.53 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 169.445 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -63.96 -38.81 92.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.691 176.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.9 t -61.44 -40.23 93.71 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.031 -0.532 . . . . 0.0 109.711 174.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.432 ' O ' HG22 ' A' ' 43' ' ' VAL . 52.7 mt -63.31 -40.51 97.54 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.659 174.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 36' ' ' TYR . 77.4 mt -61.43 -35.56 67.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.868 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.425 ' O ' ' HB3' ' A' ' 44' ' ' GLU . 0.5 OUTLIER -66.75 -36.33 82.19 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.115 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -68.74 -47.74 65.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.928 176.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.432 HG22 ' O ' ' A' ' 39' ' ' LEU . 87.4 t -62.05 -32.6 54.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.328 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.425 ' HB3' ' O ' ' A' ' 41' ' ' ARG . 28.1 tt0 -52.89 -59.21 4.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.361 176.188 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -57.21 -36.77 71.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.289 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -64.02 -43.82 94.42 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.679 176.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.489 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 7.6 mmpt? -68.52 -37.01 79.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.78 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -57.9 -35.3 70.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.98 0.419 . . . . 0.0 110.47 177.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -96.23 -2.29 46.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.091 178.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.9 t70 60.36 20.93 10.49 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.907 0.861 . . . . 0.0 110.442 -177.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -112.87 60.15 0.64 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.59 -177.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -85.9 86.15 7.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 122.045 0.926 . . . . 0.0 109.902 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -83.22 -7.37 59.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.06 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.462 ' HZ ' HD22 ' A' ' 56' ' ' LEU . 60.6 t80 -115.49 122.39 45.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.829 -173.045 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.68 124.48 38.01 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 176.185 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.462 HD22 ' HZ ' ' A' ' 54' ' ' PHE . 19.3 tp -144.94 124.95 13.53 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.772 -175.176 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -109.09 159.6 16.74 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.031 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 m -132.88 161.74 33.41 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.636 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -93.53 171.74 8.71 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 173.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -62.0 -28.3 69.48 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 -175.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.0 -23.7 48.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.791 0.329 . . . . 0.0 110.607 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.21 7.88 84.96 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.954 -0.641 . . . . 0.0 111.584 -172.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.9 p -83.24 -14.85 52.34 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -174.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -134.11 130.54 37.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.064 0.459 . . . . 0.0 111.029 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 46.0 m95 -118.65 126.29 51.62 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.342 175.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -139.82 140.3 36.57 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.088 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -175.68 -160.35 23.16 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.216 -0.993 . . . . 0.0 112.554 -178.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.511 ' HG2' ' HA ' ' A' ' 81' ' ' ASP . 96.7 mttt -144.19 154.93 43.64 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.956 0.408 . . . . 0.0 110.769 -176.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 62.6 m -112.35 132.13 55.16 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.795 175.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.509 ' CD1' ' HG2' ' A' ' 79' ' ' GLU . 3.2 m-90 -107.58 122.59 46.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.213 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -130.45 120.03 23.57 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.058 0.456 . . . . 0.0 109.823 172.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.7 mp -98.53 117.29 43.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.639 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.433 ' HB3' ' HE2' ' A' ' 78' ' ' TYR . 39.3 t60 -139.06 117.97 12.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.99 -176.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 60.34 52.21 4.95 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.812 0.695 . . . . 0.0 111.037 176.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.0 mt 70.62 1.96 3.91 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.631 176.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.1 mt -111.08 128.71 55.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.088 0.471 . . . . 0.0 111.512 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -93.24 107.22 19.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.424 174.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.433 ' HE2' ' HB3' ' A' ' 73' ' ' HIS . 77.8 m-85 -89.93 123.37 33.8 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.509 ' HG2' ' CD1' ' A' ' 70' ' ' TRP . 33.1 mt-10 -111.08 134.92 52.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.809 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -132.93 117.72 18.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.511 ' HA ' ' HG2' ' A' ' 68' ' ' LYS . 5.7 p-10 -87.84 136.91 32.75 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.156 0.503 . . . . 0.0 111.031 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.486 HG23 ' HB ' ' A' ' 99' ' ' VAL . 37.0 pt -136.22 149.66 27.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.486 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.48 153.04 37.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.351 0.596 . . . . 0.0 110.938 173.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -161.7 158.2 25.58 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.109 177.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -107.16 173.29 6.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.143 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.547 HG22 ' CH2' ' A' ' 28' ' ' TRP . 50.4 mm -111.81 89.22 10.92 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.922 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -63.89 162.61 28.18 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.446 2.097 . . . . 0.0 111.905 177.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.418 HD11 ' N ' ' A' ' 88' ' ' ILE . 3.0 mp -61.97 -23.41 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.271 -177.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.536 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 12.1 p -68.36 -18.74 64.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.873 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.628 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 62.8 t80 -77.02 141.32 67.46 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.628 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 83.7 Cg_endo -95.44 11.39 44.44 Favored 'Cis proline' 0 N--CA 1.458 -0.595 0 C-N-CA 124.454 -1.061 . . . . 0.0 113.749 2.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 33.3 m -60.77 -42.17 96.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.428 0.632 . . . . 0.0 110.18 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.536 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 31.9 m -121.7 125.98 47.88 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.464 175.251 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.68 144.0 98.75 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.605 -0.271 . . . . 0.0 110.713 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.401 ' HD3' ' CD1' ' A' ' 90' ' ' TYR . 82.6 Cg_endo -82.0 150.18 15.9 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.65 2.234 . . . . 0.0 112.135 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.409 ' CD ' ' HZ1' ' A' ' 114' ' ' LYS . 42.2 mt-10 -79.94 100.35 8.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.911 179.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.508 ' HB ' HD13 ' A' ' 115' ' ' ILE . 56.6 mt -67.38 130.75 32.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.18 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -105.19 137.47 42.91 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.947 0.403 . . . . 0.0 110.711 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.486 ' HB ' HG23 ' A' ' 82' ' ' ILE . 3.8 p -128.8 88.09 52.91 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-O 121.478 0.656 . . . . 0.0 110.431 177.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 99' ' ' VAL . 16.1 Cg_endo -56.29 -30.47 80.69 Favored 'Trans proline' 0 CA--C 1.529 0.255 0 C-N-CA 123.258 2.638 . . . . 0.0 113.496 -174.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -67.79 -40.4 83.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.906 0.384 . . . . 0.0 111.183 -179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.475 HD22 ' HG3' ' A' ' 105' ' ' LYS . 87.7 mt -85.99 5.47 33.16 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -174.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.17 -17.12 62.55 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.081 0.467 . . . . 0.0 110.673 -176.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -128.43 11.54 6.39 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.125 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.475 ' HG3' HD22 ' A' ' 102' ' ' LEU . 75.3 mmtt -95.63 -53.16 3.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.261 0.553 . . . . 0.0 109.627 179.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.508 ' HB ' HD13 ' A' ' 153' ' ' LEU . 13.3 t . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.529 -176.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.587 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.409 ' HZ1' ' CD ' ' A' ' 96' ' ' GLU . 42.1 mttm -131.89 122.76 26.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.823 -0.189 . . . . 0.0 111.197 -172.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.508 HD13 ' HB ' ' A' ' 97' ' ' ILE . 46.2 pt -113.65 143.71 22.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 172.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 49.4 t -119.44 125.86 49.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.777 0.322 . . . . 0.0 110.206 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.523 HD12 ' HA3' ' A' ' 141' ' ' GLY . 47.5 mt -77.65 -80.4 0.11 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.198 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.536 ' OG1' ' HB2' ' A' ' 121' ' ' PHE . 24.0 p -141.85 156.75 45.53 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.67 -43.0 77.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.902 0.382 . . . . 0.0 110.613 -177.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . 0.43 ' C ' ' HD2' ' A' ' 123' ' ' PRO . 5.9 p80 -76.63 -5.54 48.23 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.56 -176.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.536 ' HB2' ' OG1' ' A' ' 118' ' ' THR . 56.4 t80 -71.22 -34.61 70.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.077 0.465 . . . . 0.0 109.868 176.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.594 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 16.6 mtpp -60.56 -52.28 73.86 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.787 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.594 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 31.6 Cg_exo -60.2 -41.25 52.73 Favored 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 121.769 1.646 . . . . 0.0 112.113 172.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 52.1 tp -61.31 -44.0 97.93 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.97 -177.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.462 ' O ' HG21 ' A' ' 129' ' ' VAL . 50.4 t-105 -61.42 -57.16 13.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.319 179.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.01 -29.43 69.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.954 -0.567 . . . . 0.0 112.037 -176.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -66.01 -43.07 88.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.507 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . 0.505 ' HB2' ' CE2' ' A' ' 132' ' ' PHE . 55.5 m-80 -97.41 -0.11 46.82 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -168.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.462 HG21 ' O ' ' A' ' 125' ' ' TRP . 97.7 t -55.67 136.19 71.37 Favored Pre-proline 0 N--CA 1.466 0.346 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 174.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.432 ' HA ' HG12 ' A' ' 129' ' ' VAL . 70.3 Cg_endo -97.11 -142.25 0.14 OUTLIER 'Cis proline' 0 C--N 1.352 0.712 0 C-N-CA 124.73 -0.946 . . . . 0.0 113.589 4.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.486 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 35.8 mtmm 75.53 1.4 3.61 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.875 0.87 . . . . 0.0 111.119 -176.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.505 ' CE2' ' HB2' ' A' ' 128' ' ' ASN . 11.3 m-85 -79.95 160.39 25.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.675 175.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -166.01 170.41 40.71 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 -178.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.633 HD13 ' HE1' ' A' ' 138' ' ' MET . 33.4 tp -59.57 -35.23 73.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.952 0.376 . . . . 0.0 111.306 -174.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.05 -41.31 83.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.06 0.457 . . . . 0.0 110.969 177.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -71.75 -37.1 70.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.506 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 63.7 tp -65.53 -46.53 79.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.245 -178.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' MET . . . . . 0.633 ' HE1' HD13 ' A' ' 134' ' ' LEU . 24.2 mmt -67.45 -39.61 85.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.295 -178.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.49 -47.53 60.08 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -176.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.8 mt -83.45 -16.44 45.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.314 -175.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . 0.523 ' HA3' HD12 ' A' ' 117' ' ' LEU . . . -112.32 -74.88 0.71 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.316 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 40.6 tp -61.02 -41.96 97.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.77 -62.87 5.77 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 121.074 -0.584 . . . . 0.0 113.423 -177.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -66.2 -27.42 48.74 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.285 1.99 . . . . 0.0 112.285 178.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 59.1 t90 -63.52 -52.56 60.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.284 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 91.2 mt -61.62 -32.8 72.96 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.623 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.13 -15.78 63.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.484 -178.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 92.5 t -106.58 -45.23 7.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.792 0.33 . . . . 0.0 110.727 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 23.1 tp10 -67.53 -52.57 37.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.74 -175.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.477 ' O ' HG13 ' A' ' 154' ' ' ILE . 46.3 mm -55.92 -54.35 53.12 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -172.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 17.4 Cg_endo -58.35 -39.56 83.15 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 121.84 1.694 . . . . 0.0 112.257 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -68.23 -38.3 81.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.272 0.558 . . . . 0.0 110.246 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.582 HD11 ' HD3' ' A' ' 156' ' ' LYS . 31.1 tp -70.14 -36.03 74.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.948 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 150' ' ' ILE . 77.2 mt -64.25 -41.93 93.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.991 0.424 . . . . 0.0 110.33 176.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -67.1 -13.93 62.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.545 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . 0.582 ' HD3' HD11 ' A' ' 153' ' ' LEU . 21.4 mtpp -69.17 -16.93 63.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.687 0.279 . . . . 0.0 110.939 174.098 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 81.0 7.49 88.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.366 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . 0.697 HG23 HG13 ' A' ' 159' ' ' ILE . 27.7 m -88.31 -15.39 9.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.155 0.502 . . . . 0.0 110.437 178.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.697 HG13 HG23 ' A' ' 158' ' ' VAL . 56.8 mt . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.562 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.436 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 120.899 0.381 . . . . 0.0 109.988 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.7 m -59.18 -49.57 77.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.331 -179.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.452 ' HD3' ' N ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -68.9 -23.63 64.21 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.533 -177.875 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.452 ' N ' ' HD3' ' A' ' 7' ' ' ARG . 10.2 ttp180 -71.92 -39.13 69.71 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.835 0.35 . . . . 0.0 110.188 177.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 5' ' ' ALA . 95.0 t -61.56 -45.2 99.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.591 177.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.9 t -67.17 -33.5 63.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.024 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -73.37 -41.76 63.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.39 -175.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -87.78 -0.76 57.37 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -175.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.43 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 57.8 mt -115.06 89.07 18.75 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 173.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.2 Cg_endo -49.99 151.22 8.92 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.951 3.101 . . . . 0.0 113.904 -172.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.7 m -83.39 157.83 3.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.744 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.441 HD12 ' N ' ' A' ' 16' ' ' LEU . 6.2 mp -100.48 147.63 25.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.509 -177.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -83.07 -39.61 20.96 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 175.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.9 m -87.59 121.4 29.97 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.738 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -145.72 120.65 9.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.784 172.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -159.07 -55.17 0.06 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.17 -178.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 121.82 -169.19 14.64 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.721 -0.752 . . . . 0.0 111.94 177.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -72.75 5.13 3.08 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.102 2.535 . . . . 0.0 112.04 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -74.23 -30.97 62.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.184 178.67 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.542 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 1.4 t0 -120.38 104.39 9.98 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 79.1 mtp180 -61.83 -40.92 96.98 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -170.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -66.09 -43.51 87.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.146 0.498 . . . . 0.0 110.244 179.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.542 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 3.8 mm? -74.05 -23.53 59.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.668 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 46.5 t-105 -63.65 -39.05 93.36 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.452 174.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.0 t -64.5 -41.99 93.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.008 175.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.2 mm100 -59.17 -44.99 92.17 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.522 175.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.509 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 25.1 tpt180 -60.3 -44.71 95.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.546 178.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.418 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 1.4 mm? -58.41 -49.29 77.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.061 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.405 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 15.2 ptpt -70.76 -38.07 73.45 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.882 -175.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -66.95 -43.3 83.5 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.363 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.566 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 11.4 tp10 -68.88 -30.54 69.07 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.229 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.431 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.2 t80 -64.31 -43.48 94.54 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -60.14 -43.44 95.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.316 0.579 . . . . 0.0 109.858 174.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.422 ' HB3' ' O ' ' A' ' 35' ' ' GLU . 16.9 t -56.38 -46.57 80.04 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.848 175.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.61 HD23 ' HB1' ' A' ' 135' ' ' ALA . 82.2 mt -61.6 -55.34 31.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.913 178.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 36' ' ' TYR . 89.7 mt -52.22 -43.78 39.91 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.098 -178.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -45.28 91.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.86 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -71.3 -42.43 68.66 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.049 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.494 HG13 ' HE3' ' A' ' 47' ' ' LYS . 88.8 t -61.17 -44.31 98.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.767 0.317 . . . . 0.0 110.385 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.3 -38.6 85.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.626 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -57.65 -40.48 79.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.45 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.524 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 96.1 m-20 -62.24 -44.65 96.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.818 0.342 . . . . 0.0 110.487 177.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.494 ' HE3' HG13 ' A' ' 43' ' ' VAL . 89.4 mttt -64.64 -37.36 87.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.107 0.479 . . . . 0.0 110.647 178.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -70.68 -19.94 62.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.018 178.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -97.23 -1.38 44.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.287 175.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 65.27 30.69 11.1 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.994 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.524 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 8.2 t30 -131.52 93.52 3.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.925 0.393 . . . . 0.0 111.016 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -99.35 110.33 22.84 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 176.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 51.8 p-90 -124.24 -0.12 8.32 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -172.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.418 ' HA ' ' HA ' ' A' ' 69' ' ' CYS . 11.0 p90 -161.14 141.49 11.05 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.382 177.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -135.12 129.81 34.48 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 174.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.4 tp -147.23 126.52 13.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.931 -168.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -111.74 163.51 14.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.798 0.332 . . . . 0.0 110.28 176.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.441 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 10.9 p -125.41 157.34 37.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.109 -178.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -68.92 167.94 14.68 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.75 171.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -70.24 -19.15 63.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.393 0.616 . . . . 0.0 109.37 173.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -72.46 -32.94 66.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.16 173.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.8 8.85 84.91 Favored Glycine 0 C--N 1.333 0.411 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.079 -174.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.0 p -89.56 -30.21 18.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.028 0.442 . . . . 0.0 111.308 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 65.9 mtt180 -114.77 133.8 55.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.58 179.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.441 ' CD2' ' HB3' ' A' ' 58' ' ' SER . 49.9 m95 -124.12 126.65 46.55 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.004 175.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -136.04 148.23 48.27 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.036 -174.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.89 -144.18 8.36 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.183 -0.767 . . . . 0.0 111.183 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.3 ptpp? -159.77 150.69 19.33 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 117.037 0.419 . . . . 0.0 110.959 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 54' ' ' PHE . 25.0 p -116.06 147.67 41.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.379 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.552 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 29.5 m-90 -115.15 129.16 56.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.351 179.202 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -118.53 124.21 46.98 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.3 mm -86.0 120.2 35.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.155 178.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -124.28 108.42 12.21 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.732 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.3 t0 64.44 -85.02 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.197 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 75' ' ' LEU . 2.3 mm? -132.64 6.61 4.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.751 0.31 . . . . 0.0 111.218 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.8 mp -112.38 147.25 36.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.17 0.51 . . . . 0.0 111.21 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -116.54 98.19 6.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.578 -177.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.521 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 74.8 m-85 -93.14 133.22 36.55 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.301 -175.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.552 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 0.8 OUTLIER -110.28 136.54 49.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.409 0.623 . . . . 0.0 110.861 175.567 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.469 ' O ' HG22 ' A' ' 82' ' ' ILE . 91.4 m-85 -122.12 117.02 25.27 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.347 175.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.85 117.65 9.25 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.469 HG22 ' O ' ' A' ' 80' ' ' PHE . 36.8 pt -118.51 161.64 17.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.475 0.655 . . . . 0.0 111.855 -171.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -165.42 161.83 19.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.007 175.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.558 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 55.6 p90 -162.64 167.16 23.62 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 123.182 0.301 . . . . 0.0 110.339 173.057 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -119.02 158.42 25.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.404 -178.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.1 mm -106.93 90.4 5.27 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.828 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -60.14 160.95 20.86 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.579 2.186 . . . . 0.0 112.087 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 27.2 mt -73.84 -5.2 6.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.475 0.655 . . . . 0.0 110.727 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.83 8.4 17.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.291 176.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -77.64 142.0 65.58 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 174.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -97.31 16.72 32.57 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.229 -1.155 . . . . 0.0 113.043 -1.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.2 m -59.56 -37.81 79.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.463 0.649 . . . . 0.0 110.453 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.9 m -122.66 142.26 50.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.606 176.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.81 144.8 96.32 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.823 178.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.0 144.7 99.44 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.87 2.38 . . . . 0.0 112.364 177.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.23 104.54 14.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.517 -176.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.558 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 58.8 mt -72.7 131.4 34.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.424 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -92.62 -74.81 0.51 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.103 -173.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.424 HG22 HG22 ' A' ' 97' ' ' ILE . 17.7 t 61.49 82.38 0.22 Allowed Pre-proline 0 N--CA 1.466 0.369 0 CA-C-O 121.249 0.547 . . . . 0.0 110.233 -174.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.71 -14.51 42.03 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 123.263 2.642 . . . . 0.0 113.74 -170.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -79.36 -31.41 42.94 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.718 0.294 . . . . 0.0 111.12 -177.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.7 mt -83.5 -7.67 59.49 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.726 -174.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -61.81 124.0 19.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.735 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 89.97 -8.3 80.08 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.552 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -101.08 -55.28 2.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.91 0.386 . . . . 0.0 110.259 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.1 t . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.84 -178.307 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . 0.477 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . . . . . . 0 N--CA 1.445 -0.749 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -147.1 116.73 7.09 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 177.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 39.7 pt -75.92 153.86 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.002 0.43 . . . . 0.0 111.202 -177.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 27.4 t -105.1 123.76 48.37 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.044 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.9 mt -71.58 161.86 30.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.261 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.3 p -67.88 159.74 29.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.025 0.441 . . . . 0.0 111.568 -176.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -61.51 -24.94 66.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.335 -0.848 . . . . 0.0 112.125 -173.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -93.39 -37.29 12.06 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.989 -0.285 . . . . 0.0 111.18 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -71.94 -35.84 69.73 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 -173.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.402 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 63.2 tttm -57.97 -52.28 75.62 Favored Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -177.064 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 56.6 Cg_endo -72.23 -25.44 18.81 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 121.826 1.684 . . . . 0.0 112.396 175.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 53.1 tp -62.44 -38.18 88.77 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.686 178.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.458 ' O ' HG22 ' A' ' 129' ' ' VAL . 57.1 t-105 -54.53 -55.44 29.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.941 0.401 . . . . 0.0 110.557 177.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -71.52 -14.19 62.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.163 -177.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.429 ' HD3' ' O ' ' A' ' 127' ' ' ARG . 3.3 tmt_? -80.54 -28.24 37.37 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -88.14 -39.14 14.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.572 -177.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.48 HG11 ' HA ' ' A' ' 130' ' ' PRO . 95.6 t -49.67 135.53 19.12 Favored Pre-proline 0 N--CA 1.472 0.653 0 O-C-N 123.512 0.508 . . . . 0.0 111.198 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.48 ' HA ' HG11 ' A' ' 129' ' ' VAL . 59.7 Cg_endo -86.51 -146.61 0.32 Allowed 'Cis proline' 0 C--N 1.353 0.77 0 C-N-CA 124.425 -1.073 . . . . 0.0 113.48 5.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.468 ' H ' ' HB2' ' A' ' 130' ' ' PRO . 42.9 mmtm 72.89 -37.61 0.39 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.32 0.648 . . . . 0.0 112.035 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.428 ' H ' ' C ' ' A' ' 130' ' ' PRO . 1.4 t80 -64.97 158.05 26.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.007 0.432 . . . . 0.0 111.215 -178.12 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.509 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -141.66 175.16 22.65 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.753 -175.18 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.403 ' H ' ' CD ' ' A' ' 35' ' ' GLU . 53.0 tp -72.29 -39.7 68.1 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.724 0.409 . . . . 0.0 111.33 -174.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.61 ' HB1' HD23 ' A' ' 39' ' ' LEU . . . -60.72 -30.82 70.21 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.481 0.657 . . . . 0.0 110.444 177.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -67.68 -32.98 74.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.055 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.418 ' HB2' ' CZ3' ' A' ' 125' ' ' TRP . 59.4 tp -68.6 -36.72 79.07 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.914 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 59.5 mtt -65.73 -42.01 91.52 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.309 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -77.82 -50.32 12.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.227 -177.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.7 mt -93.62 -6.14 47.16 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -171.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -117.02 -67.56 0.38 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.263 -0.97 . . . . 0.0 112.753 -177.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 58.8 tp -60.33 -48.93 79.63 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 122.154 0.182 . . . . 0.0 111.482 -175.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.74 -61.64 6.87 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 121.256 -0.497 . . . . 0.0 113.143 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . 0.401 ' O ' HG23 ' A' ' 148' ' ' VAL . 50.8 Cg_exo -56.08 -37.71 95.92 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.629 2.219 . . . . 0.0 112.797 177.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 64.8 t90 -61.99 -46.69 88.11 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.914 0.388 . . . . 0.0 110.569 -179.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 97.2 mt -61.7 -37.69 85.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.187 0.518 . . . . 0.0 110.647 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.13 -9.72 56.5 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.798 -178.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 144' ' ' PRO . 85.0 t -70.53 -55.98 12.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.648 -179.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -141.81 11.16 2.03 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -175.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.493 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 29.7 mm -69.3 -50.75 19.12 Favored Pre-proline 0 CA--C 1.535 0.404 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.502 174.018 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 15.0 Cg_endo -59.12 -31.23 95.09 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.763 1.642 . . . . 0.0 111.189 171.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.456 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 30.0 t70 -66.39 -45.0 81.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.402 178.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.581 ' HA ' ' HD3' ' A' ' 156' ' ' LYS . 41.0 tp -56.01 -38.81 71.0 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.518 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 62.7 mt -68.19 -44.41 84.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.669 177.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -69.98 -23.07 63.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.356 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . 0.581 ' HD3' ' HA ' ' A' ' 153' ' ' LEU . 28.8 mtpp -65.67 -18.19 65.14 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.849 176.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 85.8 26.1 36.08 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.67 -177.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 54.6 t -86.52 -43.85 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.976 0.417 . . . . 0.0 110.14 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 60.6 mt . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.48 -179.841 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.402 ' O ' HG22 ' A' ' 9' ' ' VAL . . . . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.85 0.357 . . . . 0.0 110.814 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.492 ' O ' HG22 ' A' ' 10' ' ' VAL . 28.1 m -60.54 -53.84 52.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.433 -179.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.412 ' HD3' ' N ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -64.65 -28.9 69.92 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.807 0.337 . . . . 0.0 111.325 -176.063 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.412 ' N ' ' HD3' ' A' ' 7' ' ' ARG . 54.3 mtp180 -70.5 -36.56 73.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.679 0.276 . . . . 0.0 110.912 178.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 5' ' ' ALA . 99.5 t -72.88 -44.08 58.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.389 176.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 6' ' ' THR . 44.4 t -68.0 -14.36 18.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.196 0.522 . . . . 0.0 110.711 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.2 t -69.09 -34.33 74.94 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.127 174.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -96.65 -21.29 17.71 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.985 0.421 . . . . 0.0 110.369 178.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.3 mt -117.42 81.81 14.4 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 174.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -76.81 174.25 13.16 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 123.142 2.561 . . . . 0.0 113.852 -168.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.1 m -79.66 152.3 4.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.308 176.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 9.4 mp -86.9 134.66 33.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.771 -177.189 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.519 ' HD2' ' N ' ' A' ' 17' ' ' LYS . 12.2 mptt -87.2 -31.61 20.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.049 0.452 . . . . 0.0 110.238 -178.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.452 ' O ' ' HG3' ' A' ' 31' ' ' ARG . 11.6 m -93.64 105.76 17.78 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.603 176.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -125.24 133.36 52.73 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.803 0.335 . . . . 0.0 111.27 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -165.63 167.62 17.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.088 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.76 170.67 23.18 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.685 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -61.85 -10.62 17.86 Favored 'Trans proline' 0 N--CA 1.476 0.465 0 C-N-CA 123.232 2.621 . . . . 0.0 112.999 -177.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.822 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 0.4 OUTLIER -69.24 -27.02 65.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.953 177.936 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -112.91 97.52 6.59 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.465 ' O ' HG23 ' A' ' 29' ' ' VAL . 37.3 mtt180 -66.8 -29.68 69.69 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -176.098 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -62.68 -53.36 55.58 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.086 0.47 . . . . 0.0 110.195 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -75.62 -26.74 58.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.829 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.445 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 74.7 t-105 -64.42 -46.5 82.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.768 177.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 25' ' ' ARG . 68.1 t -60.03 -40.9 84.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 120.743 0.306 . . . . 0.0 110.455 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -67.42 -42.69 82.81 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.67 177.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.452 ' HG3' ' O ' ' A' ' 18' ' ' THR . 38.6 ttt-85 -65.18 -34.45 78.4 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.532 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.409 HD21 ' HA ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -63.56 -43.92 95.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.567 -178.237 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.613 ' HZ1' ' HB3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -74.32 -26.92 60.46 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.933 179.778 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -71.57 -35.91 70.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.141 0.496 . . . . 0.0 109.858 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.401 ' CD ' ' H ' ' A' ' 134' ' ' LEU . 10.1 tp10 -64.42 -40.73 96.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.395 174.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.4 ' HD2' ' HA ' ' A' ' 33' ' ' LYS . 5.3 m-85 -55.03 -40.39 70.16 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.913 175.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 71.8 mm-40 -58.71 -49.26 78.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.208 0.528 . . . . 0.0 110.261 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.6 t -62.16 -39.56 93.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.656 179.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.514 HD21 ' HB2' ' A' ' 135' ' ' ALA . 94.4 mt -65.09 -54.94 22.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.155 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 83.6 mt -54.13 -45.32 65.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.061 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -43.99 97.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.035 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -65.12 -43.69 91.16 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.745 0.307 . . . . 0.0 110.906 -179.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 39' ' ' LEU . 55.3 t -73.39 -43.0 56.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.475 -176.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.63 -29.01 64.18 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -178.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -65.63 -31.38 72.38 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 174.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.587 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 13.1 m-80 -71.49 -39.34 70.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.319 175.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -62.6 -33.28 74.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.049 176.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -66.82 -14.8 63.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 111.07 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -106.04 5.03 29.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.326 175.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.8 t70 63.33 27.7 15.44 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.99 0.9 . . . . 0.0 109.985 -176.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.587 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 11.9 t30 -122.07 72.06 1.02 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.692 -175.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -92.56 88.99 6.54 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 9.6 p-90 -99.89 -8.15 24.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.498 -0.773 . . . . 0.0 112.363 -170.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -161.43 144.88 12.68 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.707 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 55' ' ' ARG . 37.2 mtm180 -143.16 124.31 14.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.066 171.511 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.462 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 5.1 tt -131.05 127.81 39.0 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.439 -169.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -121.41 177.06 5.35 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.121 -175.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.441 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 78.6 p -146.26 174.72 11.09 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.516 ' OD1' ' HB2' ' A' ' 61' ' ' GLU . 4.8 p30 -73.12 166.57 22.86 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 167.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.646 ' HA ' ' HE3' ' A' ' 60' ' ' LYS . 0.3 OUTLIER -76.12 -5.57 47.25 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.026 0.441 . . . . 0.0 111.264 -175.31 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.516 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 6.7 mm-40 -78.89 -32.68 45.93 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 171.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.34 13.39 83.63 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.662 177.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -92.26 -5.53 52.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.861 0.363 . . . . 0.0 111.791 -177.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.41 ' HB3' HD22 ' A' ' 59' ' ' ASN . 15.3 ttm180 -151.2 128.01 10.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.016 177.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.461 ' HB3' HD22 ' A' ' 56' ' ' LEU . 46.6 m95 -115.37 149.57 37.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.368 -176.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -156.11 140.65 16.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.473 -178.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.462 ' HA3' ' HA ' ' A' ' 56' ' ' LEU . . . -175.41 -174.91 42.4 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 119.897 -1.144 . . . . 0.0 112.637 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.7 mttp -117.8 145.25 44.66 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.9 0.381 . . . . 0.0 110.735 -178.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 48.5 t -130.75 127.5 38.89 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.528 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . 0.547 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 7.8 p90 -130.28 132.77 46.07 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.66 -178.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -118.29 143.71 46.38 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 42.8 mm -105.24 116.15 48.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 120.842 0.353 . . . . 0.0 110.829 -175.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -127.47 106.6 9.3 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.415 ' C ' ' H ' ' A' ' 76' ' ' LEU . 5.1 m-20 52.22 58.49 5.37 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.918 0.761 . . . . 0.0 111.247 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.2 mm? 73.34 -22.46 0.23 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.44 176.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.415 ' H ' ' C ' ' A' ' 74' ' ' ASP . 88.5 mt -72.22 118.07 14.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.713 0.292 . . . . 0.0 110.404 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -105.96 135.7 46.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.204 178.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.405 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 7.4 p90 -143.74 114.73 7.81 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.688 179.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.547 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 0.6 OUTLIER -106.09 136.43 45.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.559 177.914 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -117.04 139.19 51.0 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.469 178.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -93.15 115.62 28.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.175 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 pt -127.13 152.34 35.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.483 -178.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.11 161.71 42.22 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.992 0.425 . . . . 0.0 110.303 176.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.551 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 48.0 p90 -160.09 152.06 20.34 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.44 -179.47 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.51 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 7.2 p-10 -100.8 167.91 9.99 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.978 0.418 . . . . 0.0 110.14 178.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.1 mm -109.2 89.5 6.99 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.399 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 37.1 Cg_exo -56.55 164.11 6.05 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 123.095 2.53 . . . . 0.0 112.529 -178.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 35.0 mt -74.36 -10.96 14.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.365 0.603 . . . . 0.0 110.226 -178.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.1 p -80.91 -6.82 59.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.948 176.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.555 ' CG ' ' HA ' ' A' ' 91' ' ' PRO . 51.2 t80 -75.86 144.15 75.78 Favored Pre-proline 0 C--N 1.328 -0.352 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.555 ' HA ' ' CG ' ' A' ' 90' ' ' TYR . 24.2 Cg_endo -94.04 11.82 49.31 Favored 'Cis proline' 0 N--CA 1.458 -0.614 0 C-N-CA 124.244 -1.148 . . . . 0.0 113.937 2.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 19.1 m -65.04 -36.11 83.32 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.175 0.512 . . . . 0.0 110.355 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 49.9 m -113.43 140.56 47.97 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.739 175.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.52 146.24 95.99 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.752 179.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.53 153.91 76.27 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.646 2.231 . . . . 0.0 112.5 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -81.66 90.74 6.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.956 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.551 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 65.3 mt -74.9 119.84 23.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.263 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -107.06 130.75 54.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.787 0.327 . . . . 0.0 111.505 -176.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 19.7 t -130.55 77.27 76.16 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 173.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -66.25 -21.79 54.34 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 123.073 2.515 . . . . 0.0 112.538 -176.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -57.88 -33.33 68.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.894 0.378 . . . . 0.0 111.272 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 87.5 mt -86.72 1.97 50.23 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -173.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.18 -16.14 63.87 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.39 0.614 . . . . 0.0 110.772 -176.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -131.21 26.3 3.96 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.631 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -117.88 -59.33 1.92 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.123 0.487 . . . . 0.0 109.876 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.438 179.69 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.396 0 CA-C-O 120.77 0.095 . . . . 0.0 113.126 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -86.99 149.49 24.73 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 42.9 pt -73.05 146.23 10.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.489 . . . . 0.0 111.362 -175.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 33.8 m -100.02 128.4 46.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.53 -179.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 91.9 mt -120.61 159.8 24.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.535 -178.095 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.0 t -65.0 150.13 48.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.632 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.16 -21.39 59.31 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.25 176.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -66.54 -30.26 70.53 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.945 0.402 . . . . 0.0 110.802 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -68.96 -34.7 75.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.331 -175.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.479 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 50.1 mtpt -58.66 -58.65 17.64 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.752 -174.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.479 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 43.2 Cg_endo -69.06 -31.09 24.39 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.796 1.664 . . . . 0.0 112.075 176.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 55.6 tp -60.42 -49.38 77.79 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.479 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.535 ' O ' HG21 ' A' ' 129' ' ' VAL . 51.2 t-105 -60.03 -56.38 22.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.687 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.05 -24.73 68.05 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -174.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -78.77 -26.11 44.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.961 0.41 . . . . 0.0 110.759 -179.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -96.07 5.4 51.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.042 -177.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.535 HG21 ' O ' ' A' ' 125' ' ' TRP . 86.3 t -96.15 138.11 21.64 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 174.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.498 ' HA ' HG13 ' A' ' 129' ' ' VAL . 63.0 Cg_endo -90.8 -160.92 1.28 Allowed 'Cis proline' 0 C--N 1.347 0.463 0 C-N-CA 124.302 -1.124 . . . . 0.0 113.49 4.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 53.8 mttp 75.09 5.14 4.27 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.999 0.812 . . . . 0.0 111.861 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -90.82 134.66 34.27 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -108.21 155.42 16.2 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.402 -177.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.401 ' H ' ' CD ' ' A' ' 35' ' ' GLU . 52.7 tp -64.34 -37.85 88.97 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 122.824 0.45 . . . . 0.0 111.39 -174.497 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.514 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -54.66 -30.32 55.04 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.393 0.616 . . . . 0.0 111.337 179.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -67.66 -31.26 71.12 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.385 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 58.7 tp -65.15 -35.38 80.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.715 178.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -65.61 -44.8 85.46 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.97 0.414 . . . . 0.0 110.522 176.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -73.61 -41.12 63.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.254 -176.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.0 mt -98.1 -6.94 30.6 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -173.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -129.29 -63.69 0.11 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.174 -1.012 . . . . 0.0 113.203 -177.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.6 tp -57.82 -50.97 71.51 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -175.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.55 -62.0 6.79 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.16 -0.543 . . . . 0.0 113.598 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -58.47 -31.69 94.77 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.498 2.132 . . . . 0.0 113.107 -179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 51.1 t90 -65.9 -50.08 65.75 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.044 0.45 . . . . 0.0 110.033 179.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.11 -37.92 89.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.668 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.25 -14.25 60.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.185 -176.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 96.1 t -105.45 -50.54 8.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.8 0.333 . . . . 0.0 111.689 -179.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -81.68 -32.76 31.62 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -171.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.492 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 38.7 mm -67.2 -54.32 20.23 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -175.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.4 Cg_endo -52.45 -41.02 70.04 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 122.446 2.097 . . . . 0.0 112.8 -178.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . 0.473 ' O ' ' HB2' ' A' ' 156' ' ' LYS . 32.2 t70 -67.89 -37.16 81.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.577 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.458 ' HG ' HG13 ' A' ' 159' ' ' ILE . 30.9 tp -69.62 -31.41 69.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.696 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 150' ' ' ILE . 72.2 mt -67.19 -53.82 29.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.41 176.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -70.42 -15.98 62.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.4 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 152' ' ' ASP . 20.3 ttmm -68.64 -18.18 64.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.921 175.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 87.83 21.32 47.25 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.281 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 51.7 t -99.96 -44.95 11.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.731 0.301 . . . . 0.0 111.115 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . 0.458 HG13 ' HG ' ' A' ' 153' ' ' LEU . 52.2 mt . . . . . 0 C--N 1.326 -0.43 0 CA-C-O 121.378 0.608 . . . . 0.0 110.458 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.455 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.261 0 CA-C-O 120.875 0.369 . . . . 0.0 110.495 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.462 ' O ' HG23 ' A' ' 10' ' ' VAL . 88.8 m -58.77 -48.39 81.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.384 179.318 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.0 ppt_? -70.08 -20.22 63.22 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.104 -178.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -71.23 -46.09 61.84 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 171.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.463 ' O ' HG13 ' A' ' 13' ' ' ILE . 83.7 t -57.21 -45.05 84.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.419 176.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 6' ' ' THR . 85.6 t -57.73 -43.18 83.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.643 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.4 p -70.29 -20.64 63.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.795 0.331 . . . . 0.0 111.542 -178.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -97.55 0.72 47.94 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.118 0.485 . . . . 0.0 110.584 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 9' ' ' VAL . 60.3 mt -113.74 88.57 14.12 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 115.409 -0.814 . . . . 0.0 108.82 173.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.426 ' HD2' ' HA ' ' A' ' 38' ' ' SER . 78.0 Cg_exo -47.16 141.96 12.37 Favored 'Trans proline' 0 C--O 1.237 0.431 0 C-N-CA 123.605 2.87 . . . . 0.0 113.798 -171.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.7 m -82.61 165.71 2.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.735 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.829 HD21 ' HB3' ' A' ' 35' ' ' GLU . 7.6 mp -101.76 134.89 44.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.97 -176.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -87.81 -34.01 18.42 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.584 0.707 . . . . 0.0 109.64 174.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.523 HG22 ' HB3' ' A' ' 30' ' ' GLN . 19.7 m -110.82 118.78 37.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.233 -177.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.426 ' HA ' ' CG ' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -152.89 136.81 16.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.27 0.557 . . . . 0.0 111.674 176.382 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -157.13 173.15 17.43 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.154 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.0 161.31 52.06 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.211 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.15 3.32 1.68 Allowed 'Trans proline' 0 N--CA 1.473 0.273 0 C-N-CA 123.074 2.516 . . . . 0.0 112.554 -178.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -72.61 -23.83 60.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.864 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -112.24 108.91 18.3 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.503 ' O ' HG22 ' A' ' 29' ' ' VAL . 64.0 mtt180 -69.66 -36.24 75.87 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -173.412 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -71.96 -46.09 58.68 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.091 -175.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.42 -25.88 64.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 64.0 t-105 -69.3 -45.3 69.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.385 176.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.503 HG22 ' O ' ' A' ' 25' ' ' ARG . 73.1 t -60.75 -42.47 92.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 110.718 177.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.523 ' HB3' HG22 ' A' ' 18' ' ' THR . 9.8 tt0 -70.12 -31.82 69.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.135 0.493 . . . . 0.0 110.032 178.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.597 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 2.9 tmt_? -61.44 -40.07 93.13 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 174.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.44 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 6.5 mp -62.43 -41.74 98.93 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.894 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.404 ' HE2' ' HB2' ' A' ' 33' ' ' LYS . 7.7 ptmm? -66.31 -33.3 75.41 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.597 -178.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 21.6 mm-40 -64.6 -51.83 60.65 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.166 0.508 . . . . 0.0 110.385 177.748 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.829 ' HB3' HD21 ' A' ' 16' ' ' LEU . 17.2 pt-20 -75.34 -29.19 59.89 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.503 -176.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -60.36 -43.58 96.39 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 176.481 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -62.04 -38.13 87.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.403 175.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.426 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 8.8 t -62.71 -46.76 86.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.202 176.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.478 HD23 ' HZ ' ' A' ' 54' ' ' PHE . 66.2 mt -60.12 -55.61 31.71 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.083 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 77.9 mt -59.19 -39.21 78.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.15 -176.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.0 tpp180 -63.12 -45.53 91.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.479 -178.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -67.22 -44.55 79.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.956 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 39' ' ' LEU . 93.5 t -61.89 -42.45 94.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.254 178.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -57.67 -49.31 76.92 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.57 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -54.11 -45.36 71.85 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.322 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -77.33 -28.47 53.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.879 0.371 . . . . 0.0 110.67 -177.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.618 ' HB3' ' HZ2' ' A' ' 47' ' ' LYS . 9.9 mtpm? -61.66 -26.58 68.1 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.657 174.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -65.8 -17.62 64.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.932 177.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -99.95 11.0 40.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.211 176.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.4 t70 68.83 15.54 8.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.115 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -120.24 99.75 6.77 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.408 179.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -76.49 124.6 27.82 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 175.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.539 ' HE3' ' HB3' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -63.56 -58.66 6.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.269 -171.433 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.539 ' HB3' ' HE3' ' A' ' 53' ' ' TRP . 35.7 p90 -154.57 161.21 41.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.019 0.438 . . . . 0.0 110.914 -174.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.0 mtt180 -134.0 121.78 22.09 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.527 HD21 ' HB3' ' A' ' 65' ' ' TRP . 5.7 tt -157.3 137.73 12.92 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -167.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.425 ' N ' HD22 ' A' ' 56' ' ' LEU . 17.6 mm-40 -126.16 168.99 13.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.853 0.359 . . . . 0.0 110.391 -175.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.0 t -143.67 172.46 12.79 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.197 -178.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -68.04 173.71 4.38 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.468 174.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -72.91 -27.01 61.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.114 0.483 . . . . 0.0 109.732 177.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -79.64 -14.02 59.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.396 172.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.74 32.59 84.69 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.739 -179.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.4 p -89.28 -29.15 19.4 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -176.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 -130.46 123.49 29.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.527 ' HB3' HD21 ' A' ' 56' ' ' LEU . 47.3 m95 -109.61 132.91 53.7 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.129 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -143.39 139.12 29.84 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.445 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.414 ' HA3' ' HA ' ' A' ' 56' ' ' LEU . . . 172.17 -166.98 39.89 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.118 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.432 ' NZ ' ' HB2' ' A' ' 81' ' ' ASP . 23.0 mtpp -133.65 156.28 48.17 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -178.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.646 ' SG ' ' HB2' ' A' ' 80' ' ' PHE . 5.1 p -118.65 149.64 41.06 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.214 175.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 11.8 m-90 -120.97 138.59 54.07 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -176.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -146.23 120.09 9.31 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.008 0.432 . . . . 0.0 110.332 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 3.6 mp -95.62 127.84 47.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 175.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -130.07 108.35 10.01 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -179.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 64.53 -85.95 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.639 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -123.57 -11.63 7.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.192 -176.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.8 mt -103.27 145.84 29.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.17 0.51 . . . . 0.0 111.64 -174.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.426 ' HE3' ' HB3' ' A' ' 77' ' ' LYS . 1.1 tmmt? -128.52 120.99 27.82 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -132.42 153.12 51.14 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.958 0.409 . . . . 0.0 111.152 -176.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -116.79 139.21 50.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.698 -176.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.646 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . 46.7 m-85 -121.51 117.37 26.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.855 0.36 . . . . 0.0 110.477 175.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.432 ' HB2' ' NZ ' ' A' ' 68' ' ' LYS . 9.6 t70 -83.18 130.86 35.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.082 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.474 HG23 HG23 ' A' ' 99' ' ' VAL . 23.2 pt -133.92 147.47 30.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.946 -177.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -154.75 151.84 29.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.61 176.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.414 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 50.3 p90 -167.93 170.31 10.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.186 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -114.15 166.4 11.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.415 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 46.2 mm -107.12 90.23 5.31 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.696 178.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.33 164.47 17.54 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.86 2.374 . . . . 0.0 112.697 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.1 mm -63.74 -27.35 42.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.892 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' THR . . . . . 0.467 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 3.7 p -75.69 -14.02 60.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.998 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.531 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 73.3 t80 -78.11 143.58 65.78 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.531 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.4 Cg_endo -95.63 9.73 45.03 Favored 'Cis proline' 0 C--N 1.35 0.641 0 C-N-CA 124.488 -1.047 . . . . 0.0 113.509 1.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 21.5 m -61.03 -31.02 70.66 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.392 0.615 . . . . 0.0 110.201 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.467 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 22.9 m -126.33 144.3 50.86 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.195 173.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.83 143.95 82.09 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 120.54 0.21 . . . . 0.0 111.2 -178.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -86.73 171.88 6.91 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.993 2.462 . . . . 0.0 112.421 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.776 ' HB3' ' HD3' ' A' ' 114' ' ' LYS . 40.6 mt-10 -101.5 113.53 26.73 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.625 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.414 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 57.7 mt -92.79 141.42 14.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.726 -177.451 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -118.27 140.31 50.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.733 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.474 HG23 HG23 ' A' ' 82' ' ' ILE . 27.6 t -119.57 86.43 34.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.851 0.357 . . . . 0.0 110.288 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.65 -18.51 48.26 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 123.184 2.589 . . . . 0.0 113.138 -175.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.432 ' CB ' ' H ' ' A' ' 81' ' ' ASP . 4.7 tp10 -74.83 -19.0 60.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.036 0.446 . . . . 0.0 110.9 -177.064 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.8 mt -97.66 14.47 26.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.239 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -58.89 131.52 51.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.178 -176.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 61.5 23.73 63.03 Favored Glycine 0 C--N 1.334 0.435 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.51 176.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -133.85 -38.0 0.9 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.984 0.421 . . . . 0.0 110.436 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.7 t . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.837 176.871 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.239 0 N-CA-C 112.366 -0.294 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.776 ' HD3' ' HB3' ' A' ' 96' ' ' GLU . 53.8 mttp -93.56 156.5 16.7 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.502 HD13 HD22 ' A' ' 117' ' ' LEU . 30.3 pt -74.25 139.11 19.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.041 0.448 . . . . 0.0 111.401 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 18.6 t -94.11 109.06 20.86 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.502 HD22 HD13 ' A' ' 115' ' ' ILE . 96.0 mt -91.19 175.62 6.87 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.23 -177.252 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.514 HG22 ' HB2' ' A' ' 121' ' ' PHE . 4.7 t -71.98 146.2 47.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.904 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . 0.421 ' HA ' ' HE3' ' A' ' 122' ' ' LYS . 13.4 t70 -65.49 -30.26 71.01 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.621 -176.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -80.03 -15.57 56.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.753 -172.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.514 ' HB2' HG22 ' A' ' 118' ' ' THR . 49.1 t80 -70.93 -34.15 71.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.006 -176.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.508 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 42.3 mttt -57.81 -58.67 16.87 Favored Pre-proline 0 CA--C 1.539 0.522 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.085 -176.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.508 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 29.0 Cg_endo -64.37 -34.87 53.04 Favored 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 121.83 1.687 . . . . 0.0 111.976 178.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 42.3 tp -61.62 -45.24 94.92 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.837 0.351 . . . . 0.0 110.349 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.464 ' O ' HG22 ' A' ' 129' ' ' VAL . 57.2 t-105 -59.23 -57.26 13.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.587 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.03 -32.17 71.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.884 -175.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -70.36 -36.56 74.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.903 0.382 . . . . 0.0 111.169 -178.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -89.36 -31.16 17.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.061 -173.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.504 HG11 ' HA ' ' A' ' 130' ' ' PRO . 51.2 t -53.64 138.95 51.05 Favored Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 176.128 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.504 ' HA ' HG11 ' A' ' 129' ' ' VAL . 6.9 Cg_endo -88.59 -151.64 0.52 Allowed 'Cis proline' 0 C--N 1.349 0.591 0 C-N-CA 124.727 -0.947 . . . . 0.0 114.453 6.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.639 ' HB2' ' HZ3' ' A' ' 131' ' ' LYS . 9.4 mtmp? 75.24 36.66 0.5 Allowed 'General case' 0 C--N 1.343 0.309 0 C-N-CA 123.759 0.823 . . . . 0.0 110.427 -172.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -128.01 152.9 47.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.828 -179.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.597 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -146.1 175.17 25.72 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 47.6 tp -58.45 -38.25 77.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 117.355 0.578 . . . . 0.0 111.497 -176.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.12 -43.85 70.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.732 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 29.5 m80 -70.33 -36.61 74.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.682 0.277 . . . . 0.0 110.73 -178.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.75 -50.57 62.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.283 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 21.8 ptm -71.69 -31.67 67.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.55 -175.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -73.22 -45.35 56.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.682 0.277 . . . . 0.0 111.418 -179.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.2 mt -85.72 -15.98 40.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.569 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -98.79 -69.44 0.93 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.433 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' LEU . . . . . 0.58 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 94.9 mt -65.97 -38.69 89.19 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -176.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.32 -62.28 6.15 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 121.086 -0.578 . . . . 0.0 113.352 -177.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -64.4 -31.17 62.38 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.55 2.167 . . . . 0.0 112.414 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 38.3 t90 -62.57 -39.51 93.9 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.009 0.433 . . . . 0.0 110.621 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.612 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 98.7 mt -60.1 -34.52 73.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.876 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.02 -4.89 41.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.759 -176.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 61.4 t -85.47 -56.12 5.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.702 -0.226 . . . . 0.0 111.511 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -107.07 -29.49 9.36 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -172.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . 0.612 ' HB ' ' O ' ' A' ' 146' ' ' LEU . 1.7 mp -57.91 -48.7 96.67 Favored Pre-proline 0 CA--C 1.541 0.622 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -175.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' PRO . . . . . 0.441 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 54.3 Cg_exo -54.59 -37.87 90.65 Favored 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 121.79 1.66 . . . . 0.0 112.346 175.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.31 -44.4 87.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.401 179.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.84 -36.9 80.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.887 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 150' ' ' ILE . 64.9 mt -66.48 -41.18 88.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.816 178.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 151' ' ' PRO . 52.8 mt-30 -62.89 -39.06 93.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.023 0.439 . . . . 0.0 111.326 178.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -85.98 -5.58 59.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.633 -178.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 71.8 38.31 60.78 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.06 -0.591 . . . . 0.0 112.781 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 5.4 t -91.07 4.17 6.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.546 0.689 . . . . 0.0 110.105 -178.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.8 mm . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.174 179.245 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.681 0.277 . . . . 0.0 110.984 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.73 -161.02 0.81 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.0 t70 65.52 23.98 11.83 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.883 0.849 . . . . 0.0 110.432 175.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.555 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -66.9 -37.96 85.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.089 -175.745 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.58 -41.55 86.01 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.884 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.458 ' O ' HG21 ' A' ' 10' ' ' VAL . 11.0 m -59.57 -47.41 85.68 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.597 178.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 -67.08 -29.59 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.013 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.555 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 96.0 mtt180 -60.63 -50.79 72.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.95 0.405 . . . . 0.0 110.067 175.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.37 -42.5 95.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.88 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.499 HG23 HD22 ' A' ' 140' ' ' LEU . 64.7 t -62.52 -32.35 55.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.911 0.386 . . . . 0.0 110.589 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.4 t -69.54 -21.89 63.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.695 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.07 -3.31 54.4 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.06 0.457 . . . . 0.0 110.129 177.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.424 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 42.6 mt -108.35 88.46 4.97 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.57 175.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 10.3 Cg_endo -49.1 147.89 10.43 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 123.588 2.859 . . . . 0.0 113.318 -173.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.511 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 29.5 m -79.17 142.36 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.503 178.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.591 HD21 ' HG2' ' A' ' 31' ' ' ARG . 7.3 mp -81.33 134.16 35.53 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.23 -4.43 20.19 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.748 -173.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.1 m -87.55 -53.98 4.51 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 173.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.8 t30 46.25 81.13 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.52 0 O-C-N 124.037 0.836 . . . . 0.0 112.276 175.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.71 165.43 23.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.946 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -100.67 177.97 28.41 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.938 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.45 5.76 2.21 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 123.399 2.733 . . . . 0.0 113.238 -176.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.522 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 3.4 mmp_? -84.14 -48.0 10.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.828 0.347 . . . . 0.0 110.86 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -91.66 92.59 8.52 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 176.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.546 ' O ' HG21 ' A' ' 29' ' ' VAL . 61.4 mtt85 -59.9 -31.26 69.65 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -175.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.26 -52.16 60.03 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.603 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 12.3 mt -72.82 -28.57 62.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.716 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.508 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 67.9 t-105 -60.87 -49.54 77.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.463 175.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.546 HG21 ' O ' ' A' ' 25' ' ' ARG . 86.4 t -61.55 -30.5 48.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.927 178.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.435 ' O ' ' HG3' ' A' ' 34' ' ' GLU . 11.2 mt-30 -68.85 -49.94 54.11 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.84 0.352 . . . . 0.0 110.568 175.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.591 ' HG2' HD21 ' A' ' 16' ' ' LEU . 16.3 ttp180 -63.36 -32.16 73.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.063 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.415 HD21 ' HA ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -59.47 -48.47 81.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.683 -179.405 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.5 ptpp? -72.16 -34.89 68.83 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.248 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 30' ' ' GLN . 49.3 mt-10 -60.02 -46.92 87.92 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.718 0.77 . . . . 0.0 109.485 174.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -67.02 -42.45 84.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.614 -1.176 . . . . 0.0 111.028 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.24 -45.1 95.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.946 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -60.77 -39.2 87.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.955 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.4 m -62.89 -39.29 94.04 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.348 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.408 ' O ' HG23 ' A' ' 43' ' ' VAL . 96.1 mt -65.34 -47.78 75.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.584 177.546 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.63 -43.32 98.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.681 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.4 tpp180 -56.2 -47.19 78.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.737 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.457 ' CD2' ' HE3' ' A' ' 138' ' ' MET . 43.1 t80 -65.06 -45.58 84.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.724 -178.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.696 HG22 HH21 ' A' ' 55' ' ' ARG . 98.2 t -63.01 -45.16 99.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.107 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -59.94 -50.4 73.92 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.555 0.693 . . . . 0.0 110.137 177.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -53.64 -40.94 66.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.54 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.65 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 91.8 m-20 -68.49 -44.53 74.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.175 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -62.99 -31.9 73.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.284 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -64.24 -36.1 82.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 0.0 110.199 176.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.17 0.43 40.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.859 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.9 t70 74.02 12.12 4.29 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.291 177.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.65 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 5.3 t30 -119.82 92.78 3.87 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.12 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.89 146.86 35.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.692 0.282 . . . . 0.0 110.703 -176.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.776 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -104.94 -68.69 0.84 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -171.556 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.776 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 26.5 p90 -160.65 165.91 29.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.733 0.777 . . . . 0.0 112.923 -165.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.696 HH21 HG22 ' A' ' 43' ' ' VAL . 2.4 mmp_? -131.44 121.84 25.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.641 -1.163 . . . . 0.0 108.898 166.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.478 HD21 HD13 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -134.11 125.32 27.73 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 -177.004 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -131.93 168.77 17.31 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.844 0.354 . . . . 0.0 110.321 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.469 ' OG ' ' HA2' ' A' ' 62' ' ' GLY . 6.3 t -130.48 178.2 6.79 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.31 -0.404 . . . . 0.0 109.948 -175.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -84.43 -177.98 6.78 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.4 ptpp? -60.66 -28.43 68.58 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -93.59 -10.9 33.12 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.592 0.234 . . . . 0.0 111.092 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.469 ' HA2' ' OG ' ' A' ' 58' ' ' SER . . . 71.48 13.31 74.1 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.913 -0.66 . . . . 0.0 113.047 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.8 p -80.64 -15.92 55.36 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -174.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.489 ' HA ' ' HA ' ' A' ' 85' ' ' ASP . 32.1 ttm180 -143.65 122.1 12.41 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 55.3 m95 -103.12 139.03 39.16 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.361 -178.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 p90 -146.0 146.43 30.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.93 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.54 -153.51 21.94 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.836 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.613 ' HG3' ' HZ3' ' A' ' 70' ' ' TRP . 5.5 ptpp? -151.23 143.81 24.31 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.098 0.475 . . . . 0.0 110.987 -178.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 15.9 p -122.79 141.23 52.05 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.561 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.637 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 2.9 p90 -122.7 137.06 55.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.462 0.649 . . . . 0.0 110.877 -178.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -117.89 123.27 45.44 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.708 -176.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 34.7 mm -87.59 126.71 41.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.117 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -140.59 124.76 17.51 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 176.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.443 ' C ' HD22 ' A' ' 75' ' ' LEU . 39.1 t70 68.3 -85.95 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.93 0.769 . . . . 0.0 110.422 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.699 ' HB2' ' HB2' ' A' ' 172' ' ' HIS . 2.2 mm? -142.03 5.62 1.72 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 175.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 82.0 mt -111.47 153.67 25.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.898 0.38 . . . . 0.0 111.116 -172.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -116.68 129.01 55.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.958 176.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -115.74 101.21 8.62 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.837 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.637 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 1.1 pm0 -96.2 135.76 37.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.092 0.473 . . . . 0.0 110.926 177.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -124.75 138.76 54.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.919 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -93.93 124.58 38.03 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.478 HD13 HD21 ' A' ' 56' ' ' LEU . 39.5 pt -130.8 160.32 42.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.927 0.394 . . . . 0.0 111.608 -173.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -154.14 153.39 31.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.398 177.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -172.55 162.31 5.16 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.489 ' HA ' ' HA ' ' A' ' 64' ' ' ARG . 5.6 p-10 -115.64 176.1 5.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.625 0.25 . . . . 0.0 110.504 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.6 mm -114.34 89.05 16.62 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.227 -175.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.05 165.4 12.41 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.596 2.197 . . . . 0.0 112.122 177.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 55.6 mt -64.32 -21.84 29.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.256 0.551 . . . . 0.0 110.974 -178.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.16 -20.11 64.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.293 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.683 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 49.6 t80 -88.31 144.51 34.18 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.683 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.2 Cg_endo -95.5 17.67 36.31 Favored 'Cis proline' 0 N--CA 1.459 -0.531 0 C-N-CA 124.495 -1.044 . . . . 0.0 113.822 3.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 10.3 m -65.24 -38.45 90.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.51 0.671 . . . . 0.0 110.186 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -129.18 141.73 51.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.612 175.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.44 144.48 91.78 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.636 -0.257 . . . . 0.0 111.256 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.415 ' HD3' ' CD1' ' A' ' 90' ' ' TYR . 95.2 Cg_endo -92.98 -171.9 0.33 Allowed 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.159 2.572 . . . . 0.0 112.39 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -106.71 123.21 47.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.392 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.86 126.22 41.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.572 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -92.24 117.64 30.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.116 -178.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 25.6 t -119.96 87.24 38.19 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.439 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -68.74 -6.5 18.1 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.867 2.378 . . . . 0.0 113.008 -176.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -78.87 -43.25 25.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.046 0.45 . . . . 0.0 110.53 178.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.788 HD21 ' HG ' ' A' ' 153' ' ' LEU . 86.7 mt -86.76 -35.11 19.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.977 -175.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.547 ' HB2' ' HE3' ' A' ' 109' ' ' MET . 21.7 t70 -60.0 128.67 38.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.364 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 95.86 -29.36 10.0 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.147 -177.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -92.34 4.59 53.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.914 0.388 . . . . 0.0 111.392 -177.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.9 t -150.09 151.84 33.82 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 175.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -82.94 -21.66 34.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.174 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -89.31 81.3 6.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.217 0.532 . . . . 0.0 110.381 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.547 ' HE3' ' HB2' ' A' ' 103' ' ' ASP . 7.6 tpt -135.06 136.44 42.05 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.487 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -61.53 -53.93 49.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.213 0.53 . . . . 0.0 110.657 -178.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -163.3 157.88 20.73 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -48.95 96.56 0.01 OUTLIER Glycine 0 CA--C 1.521 0.417 0 O-C-N 123.696 0.623 . . . . 0.0 114.013 -176.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . 0.572 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . 113.89 -23.92 12.5 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.079 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -96.51 131.19 43.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.941 0.401 . . . . 0.0 111.652 -173.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 33.3 pt -75.86 170.75 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.688 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 35.1 m -111.14 93.7 4.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.13 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 93.5 mt -74.28 157.32 36.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.722 0.296 . . . . 0.0 110.859 179.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.419 HG23 ' HB2' ' A' ' 121' ' ' PHE . 2.6 t -72.37 151.97 42.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.029 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -67.06 -25.38 66.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.601 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -78.56 -20.03 51.51 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.428 -176.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.419 ' HB2' HG23 ' A' ' 118' ' ' THR . 56.3 t80 -71.44 -34.43 70.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.953 -177.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.58 -53.53 63.63 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.009 -176.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.441 ' O ' ' HG3' ' A' ' 127' ' ' ARG . 37.0 Cg_endo -67.47 -34.17 27.07 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.529 1.486 . . . . 0.0 112.227 175.753 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.3 tp -60.35 -45.56 93.06 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.859 0.362 . . . . 0.0 110.462 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.529 ' O ' HG23 ' A' ' 129' ' ' VAL . 41.6 t-105 -59.91 -54.88 40.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.143 177.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.95 -34.68 68.26 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.413 -175.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 123' ' ' PRO . 97.0 mtt180 -69.15 -30.12 68.29 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -178.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -95.62 -21.8 18.0 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -172.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 125' ' ' TRP . 89.3 t -46.22 129.96 7.58 Favored Pre-proline 0 N--CA 1.473 0.678 0 O-C-N 123.446 0.466 . . . . 0.0 111.542 -178.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.473 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 72.0 Cg_endo -96.72 -120.08 0.0 OUTLIER 'Cis proline' 0 CA--C 1.536 0.59 0 C-N-CA 124.016 -1.243 . . . . 0.0 113.156 2.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.511 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 64.8 mttm 67.42 22.37 9.41 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.331 175.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -91.84 -178.95 5.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.587 0.708 . . . . 0.0 112.151 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -178.31 157.71 21.87 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.393 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.6 tp -54.19 -40.24 67.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.792 0.296 . . . . 0.0 111.618 -177.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.43 -38.26 74.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.061 0.458 . . . . 0.0 111.015 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -71.87 -45.85 59.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.161 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.3 tp -59.19 -46.81 87.43 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.343 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.519 ' HE1' ' HB3' ' A' ' 138' ' ' MET . 7.8 tmm? -62.38 -47.69 83.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.215 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.75 -38.79 73.51 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -176.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.499 HD22 HG23 ' A' ' 10' ' ' VAL . 95.9 mt -86.87 -17.95 32.09 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -175.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -112.55 -66.63 0.5 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.296 -0.954 . . . . 0.0 113.041 -177.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.589 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 54.9 tp -66.45 -42.85 87.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.664 0.269 . . . . 0.0 111.031 -175.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -51.75 -61.94 6.0 Favored Glycine 0 CA--C 1.523 0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.63 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . 0.476 ' O ' HG21 ' A' ' 148' ' ' VAL . 33.9 Cg_endo -65.63 -31.86 49.05 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.314 2.009 . . . . 0.0 112.702 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 33.5 t90 -64.5 -33.74 76.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.694 0.283 . . . . 0.0 111.0 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 90.4 mt -58.55 -40.65 83.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.953 0.406 . . . . 0.0 110.167 177.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.0 -2.12 29.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.306 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.476 HG21 ' O ' ' A' ' 144' ' ' PRO . 90.8 t -104.85 -55.19 5.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.529 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -95.74 -32.48 12.71 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -173.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.604 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 40.2 mm -56.45 -41.19 89.88 Favored Pre-proline 0 CA--C 1.54 0.565 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -176.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.604 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 1.2 Cg_endo -46.18 -40.56 21.59 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 122.395 2.063 . . . . 0.0 112.792 171.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -61.93 -49.31 76.65 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.041 0.448 . . . . 0.0 110.097 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.788 ' HG ' HD21 ' A' ' 102' ' ' LEU . 3.7 mm? -60.52 -42.81 97.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.086 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.94 -53.3 31.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.038 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -65.31 -36.34 83.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.389 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . 0.541 ' HZ1' ' HB3' ' A' ' 156' ' ' LYS . 5.8 ttpm? -70.99 -16.53 62.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.986 0.422 . . . . 0.0 110.42 -178.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.71 17.69 63.19 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.333 172.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 29.1 m -87.54 -19.99 7.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.861 0.331 . . . . 0.0 110.969 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.508 HG13 ' HB3' ' A' ' 153' ' ' LEU . 44.5 mt -83.82 121.88 37.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 175.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -80.65 66.16 6.06 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.46 0.648 . . . . 0.0 110.051 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . 0.507 ' HB2' HG23 ' A' ' 159' ' ' ILE . 42.3 m80 -152.24 41.41 0.64 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.535 -178.118 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -69.45 -22.68 63.64 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.029 0.443 . . . . 0.0 110.937 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -143.06 174.95 10.23 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -121.52 -24.66 5.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.018 0.437 . . . . 0.0 110.589 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . 0.613 ' SG ' ' HB2' ' A' ' 168' ' ' LEU . 12.7 t -137.82 -43.23 0.53 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.556 -176.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 8.5 t30 59.68 95.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.274 178.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.477 ' HA ' ' OE1' ' A' ' 167' ' ' GLN . 14.3 mm-40 72.49 -29.98 0.2 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 171.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . 0.613 ' HB2' ' SG ' ' A' ' 165' ' ' CYS . 11.2 mp -60.61 -71.0 0.15 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.714 0.293 . . . . 0.0 110.572 179.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -84.76 -75.31 0.36 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.961 0.41 . . . . 0.0 110.26 175.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -165.45 152.55 10.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 -175.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -69.27 155.15 40.89 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 174.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . 0.699 ' HB2' ' HB2' ' A' ' 75' ' ' LEU . 10.4 p80 -64.68 93.61 0.11 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 122.426 1.108 . . . . 0.0 108.512 170.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 21.5 t-160 -172.65 99.07 0.14 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.276 -1.329 . . . . 0.0 107.598 -168.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . 0.443 ' HB2' HD23 ' A' ' 75' ' ' LEU . 1.6 t-80 -85.7 -15.03 43.58 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -166.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 58.5 m170 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.202 175.782 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.3 mtp . . . . . 0 N--CA 1.481 1.112 0 CA-C-O 120.602 0.239 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.78 -11.48 20.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.482 0.658 . . . . 0.0 109.83 173.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -85.57 20.31 2.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.528 -177.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.413 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 44.9 mt-10 -55.33 -41.42 72.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.989 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.483 ' O ' HG22 ' A' ' 9' ' ' VAL . . . -60.54 -44.1 96.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.981 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.2 m -61.12 -42.63 98.88 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.517 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -64.41 -38.35 90.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.442 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.413 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 21.9 mtp180 -62.97 -40.37 97.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.06 178.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 5' ' ' ALA . 96.3 t -58.53 -47.36 88.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 120.93 0.395 . . . . 0.0 110.448 178.012 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.2 t -67.17 -25.72 34.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.868 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.6 m -81.71 -40.71 22.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.375 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.479 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 34.9 mt-10 -79.1 -12.21 60.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.655 0.264 . . . . 0.0 111.372 -179.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.7 mt -105.35 89.76 3.44 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 172.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.479 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 87.8 Cg_exo -45.52 151.2 1.15 Allowed 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 124.058 3.172 . . . . 0.0 114.25 -172.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.581 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 20.0 m -86.05 145.21 8.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.716 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.733 HD22 ' HG2' ' A' ' 35' ' ' GLU . 8.2 mp -85.11 134.58 34.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.893 -178.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -82.07 -32.87 30.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.721 0.772 . . . . 0.0 109.545 174.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.473 HG21 HD12 ' A' ' 27' ' ' LEU . 25.4 m -85.03 135.21 34.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.427 -175.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -135.24 93.23 2.96 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.388 178.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -162.42 161.38 27.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.516 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -103.77 -176.61 25.85 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.397 -179.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.51 -6.54 13.86 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 123.454 2.769 . . . . 0.0 113.051 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.414 ' HG3' HG22 ' A' ' 88' ' ' ILE . 45.7 mtp180 -71.31 -24.63 62.16 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.566 0.222 . . . . 0.0 111.239 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -113.83 96.42 5.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.514 ' O ' HG22 ' A' ' 29' ' ' VAL . 87.6 mtm180 -64.44 -32.95 74.78 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -173.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -68.41 -45.53 72.39 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.418 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.473 HD12 HG21 ' A' ' 18' ' ' THR . 4.5 mm? -71.7 -26.95 62.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.208 0.528 . . . . 0.0 110.203 174.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.411 ' HH2' HG23 ' A' ' 86' ' ' ILE . 63.7 t-105 -64.1 -41.84 97.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.297 178.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 25' ' ' ARG . 96.5 t -60.08 -37.84 74.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.158 0.504 . . . . 0.0 110.174 175.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.45 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 38.7 mt-30 -67.07 -43.49 82.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.14 178.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.459 HH11 ' HG3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -62.41 -30.51 71.27 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.35 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 2.1 mm? -65.29 -49.45 69.48 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.225 177.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.431 ' HG2' ' HA ' ' A' ' 30' ' ' GLN . 19.7 ptpt -66.37 -38.59 87.92 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 120.826 -0.349 . . . . 0.0 110.961 -178.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.5 ' HB3' ' HG ' ' A' ' 16' ' ' LEU . 26.4 mm-40 -61.88 -51.1 69.57 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.973 0.416 . . . . 0.0 110.392 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.733 ' HG2' HD22 ' A' ' 16' ' ' LEU . 6.0 mm-40 -63.36 -42.06 98.85 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.578 177.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.49 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -58.85 -45.02 91.06 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.281 -178.241 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.42 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 84.3 mm-40 -58.99 -43.09 91.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.027 0.442 . . . . 0.0 110.438 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.436 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 18.0 m -66.54 -40.58 89.16 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.763 177.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 35' ' ' GLU . 95.9 mt -62.95 -49.01 76.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.014 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.444 HG13 ' O ' ' A' ' 36' ' ' TYR . 85.8 mt -55.59 -47.44 78.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 O-C-N 123.163 0.289 . . . . 0.0 110.582 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -61.52 -41.07 96.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.375 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.486 ' HE2' ' HZ ' ' A' ' 54' ' ' PHE . 80.0 t80 -72.1 -46.21 57.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.22 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.435 ' O ' ' HG3' ' A' ' 47' ' ' LYS . 85.3 t -62.91 -37.34 78.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.068 0.461 . . . . 0.0 110.295 179.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.7 -50.56 70.65 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 175.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -53.72 -48.66 69.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.52 177.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -62.49 -39.36 93.21 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -178.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 32.2 mtmm -68.88 -37.28 78.93 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.312 177.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -66.5 -34.91 78.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.713 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -85.86 -1.61 57.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.256 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.9 t70 61.62 29.68 18.3 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.667 0.746 . . . . 0.0 110.48 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -122.9 55.1 1.2 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.575 -175.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -93.7 106.59 18.55 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 65.0 p-90 -125.5 5.16 7.6 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -174.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.486 ' HZ ' ' HE2' ' A' ' 42' ' ' TYR . 19.7 p90 -154.64 147.0 23.91 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.077 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.524 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 23.0 tpt180 -126.57 123.32 37.42 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.575 178.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.1 mt -121.52 124.6 44.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.002 0.43 . . . . 0.0 110.112 175.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -134.78 152.37 51.7 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.178 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.6 m -126.23 159.35 33.27 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 120.771 0.32 . . . . 0.0 111.553 -171.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -75.74 173.2 11.41 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -69.14 -12.73 61.94 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -170.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -85.35 -25.53 27.04 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.831 0.348 . . . . 0.0 110.373 175.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.39 17.74 77.85 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.984 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.9 p -83.73 -30.28 26.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.953 0.406 . . . . 0.0 111.757 -177.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 50.3 mtp180 -128.72 128.32 43.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.239 179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -110.91 126.43 54.71 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.436 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.427 ' HA ' ' HA ' ' A' ' 83' ' ' GLU . 39.7 p90 -136.46 167.05 22.08 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.524 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 168.33 -138.77 5.31 Favored Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.011 -1.09 . . . . 0.0 112.544 178.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.498 ' HA ' ' HA ' ' A' ' 81' ' ' ASP . 20.7 ttmm -153.03 134.73 14.53 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -172.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 64.5 m -119.67 122.66 42.0 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 174.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.572 ' HB3' ' HG2' ' A' ' 79' ' ' GLU . 41.5 p90 -124.43 129.98 51.65 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.284 0.564 . . . . 0.0 110.399 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -121.01 133.96 55.28 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 -179.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 43.3 mm -96.9 121.47 47.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.411 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -147.15 116.87 7.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.035 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 57.24 58.4 3.93 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.918 0.761 . . . . 0.0 111.224 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.1 mt 72.65 -38.64 0.42 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.385 0.674 . . . . 0.0 112.641 175.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.35 137.14 55.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.318 0.58 . . . . 0.0 112.068 -175.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -108.55 102.37 11.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.667 175.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 17.8 p90 -104.6 119.71 39.62 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.185 0.517 . . . . 0.0 110.6 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.572 ' HG2' ' HB3' ' A' ' 70' ' ' TRP . 57.4 mt-10 -105.77 136.44 45.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.328 -178.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -121.25 112.57 18.79 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.498 ' HA ' ' HA ' ' A' ' 68' ' ' LYS . 2.3 m-20 -83.34 112.97 20.39 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 38.2 pt -114.62 173.76 3.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.266 -173.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 66' ' ' PHE . 10.0 pt-20 -162.44 157.71 22.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.785 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.554 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 36.0 p90 -160.91 148.15 15.43 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.084 0.469 . . . . 0.0 111.077 176.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -93.34 164.0 13.38 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.831 177.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.412 ' HA ' ' HD2' ' A' ' 87' ' ' PRO . 39.7 mm -107.45 91.98 7.75 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.631 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 1.3 Cg_endo -40.79 148.22 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 124.181 3.254 . . . . 0.0 113.807 -178.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.414 HG22 ' HG3' ' A' ' 23' ' ' ARG . 50.2 mm -58.52 -39.42 75.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.957 -174.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.3 p -83.19 40.5 0.71 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.213 0.53 . . . . 0.0 112.064 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.558 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 25.0 t80 -77.76 147.65 74.75 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.483 177.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.558 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 19.9 Cg_endo -94.76 13.35 44.72 Favored 'Cis proline' 0 N--CA 1.453 -0.856 0 C-N-CA 124.513 -1.036 . . . . 0.0 112.883 -2.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 22.5 m -62.28 -35.84 80.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.33 0.586 . . . . 0.0 110.191 178.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.6 m -105.77 119.66 39.71 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.641 173.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -81.41 152.05 69.79 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.528 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.54 ' HG2' HD13 ' A' ' 134' ' ' LEU . 50.9 Cg_exo -55.31 136.47 73.66 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.891 2.394 . . . . 0.0 112.163 174.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.478 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 19.9 mt-10 -79.74 -22.68 42.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.201 -173.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.554 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 62.8 mt 65.95 116.24 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-O 121.363 0.601 . . . . 0.0 111.665 -178.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.693 ' HB1' ' HG2' ' A' ' 114' ' ' LYS . . . -119.62 138.38 53.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.357 0.599 . . . . 0.0 111.84 -177.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.644 ' HB ' ' HE2' ' A' ' 109' ' ' MET . 16.7 t -124.43 86.18 55.26 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.713 176.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.91 -21.71 65.6 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.333 2.689 . . . . 0.0 114.138 -172.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.65 -29.81 56.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.208 0.528 . . . . 0.0 110.375 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.704 ' HB2' ' HE2' ' A' ' 109' ' ' MET . 75.2 mt -89.92 4.05 51.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.309 -176.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -62.26 110.57 1.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 87.02 -2.55 87.08 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.26 -178.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.551 ' HZ2' ' HB2' ' A' ' 105' ' ' LYS . 4.2 ttmp? -101.9 -5.87 24.2 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 121.433 0.635 . . . . 0.0 110.045 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 t -153.02 163.47 39.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.648 177.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -113.41 14.22 19.1 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.099 0.476 . . . . 0.0 110.447 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -96.19 35.81 1.4 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.781 -177.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.704 ' HE2' ' HB2' ' A' ' 102' ' ' LEU . 59.8 mtt -139.24 164.68 29.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.055 0.455 . . . . 0.0 111.759 -176.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -90.76 179.4 5.8 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.584 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -64.37 112.34 3.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.917 177.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 126.5 -16.05 6.67 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.536 177.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.81 12.93 42.01 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.229 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.693 ' HG2' ' HB1' ' A' ' 98' ' ' ALA . 95.0 mttt -91.8 137.54 32.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 176.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.5 pt -82.13 167.55 2.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.376 0.607 . . . . 0.0 112.32 -168.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 17.6 p -114.27 116.71 29.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.054 176.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.8 mt -85.7 -175.14 5.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.183 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 31.5 m -59.86 131.93 52.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.092 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -63.57 -32.33 73.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.82 -177.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -75.18 -22.11 58.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.09 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -71.5 -33.57 69.36 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.35 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.414 ' HB3' ' CD ' ' A' ' 123' ' ' PRO . 28.1 ttpp -55.69 -56.75 26.46 Favored Pre-proline 0 CA--C 1.542 0.647 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.975 -178.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.414 ' CD ' ' HB3' ' A' ' 122' ' ' LYS . 36.3 Cg_endo -67.28 -31.28 35.75 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.589 1.526 . . . . 0.0 112.104 175.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 54.5 tp -61.33 -44.8 96.59 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.414 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.54 ' O ' HG23 ' A' ' 129' ' ' VAL . 49.9 t-105 -59.84 -54.61 44.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.309 178.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.12 -16.13 63.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.968 -176.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -86.35 -21.6 27.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.958 0.408 . . . . 0.0 110.591 178.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -110.11 25.61 11.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.972 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 125' ' ' TRP . 87.2 t -102.13 135.23 19.69 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.641 174.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.488 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 88.3 Cg_endo -89.05 -153.33 0.64 Allowed 'Cis proline' 0 N--CA 1.462 -0.344 0 C-N-CA 124.085 -1.215 . . . . 0.0 112.851 1.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.581 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 53.5 mtmt 76.28 7.1 3.54 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.836 0.855 . . . . 0.0 111.759 -176.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.2 171.25 7.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 173.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -169.94 176.02 43.85 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.43 -0.89 . . . . 0.0 112.244 -174.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.54 HD13 ' HG2' ' A' ' 95' ' ' PRO . 60.9 tp -61.97 -37.09 83.46 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 122.784 0.433 . . . . 0.0 111.49 -174.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.683 ' HA ' ' HE3' ' A' ' 138' ' ' MET . . . -57.54 -39.58 76.93 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.403 0.62 . . . . 0.0 110.591 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -69.93 -36.1 75.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.065 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.493 HD23 ' HD2' ' A' ' 95' ' ' PRO . 57.3 tp -66.42 -53.49 35.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.414 -179.087 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.683 ' HE3' ' HA ' ' A' ' 135' ' ' ALA . 26.2 ptt? -62.18 -35.64 79.44 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.522 -175.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.34 -41.76 69.4 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.7 mt -95.61 -12.12 26.15 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -172.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -112.91 -53.9 0.47 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.155 -1.022 . . . . 0.0 113.739 -175.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.491 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 52.0 tp -64.36 -42.54 96.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.715 0.258 . . . . 0.0 111.479 -173.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.05 -61.69 7.22 Favored Glycine 0 CA--C 1.522 0.471 0 C-N-CA 121.244 -0.503 . . . . 0.0 113.068 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -58.38 -29.01 86.92 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.733 2.288 . . . . 0.0 113.081 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -66.87 -37.46 84.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.744 0.307 . . . . 0.0 110.818 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 91.8 mt -55.21 -38.13 68.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.316 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.57 -6.11 46.66 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 57.5 t -82.14 -40.1 17.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.734 0.302 . . . . 0.0 111.584 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -125.01 -39.78 2.22 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -173.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.468 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 48.2 mm -55.02 -52.56 70.0 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -169.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.468 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.6 Cg_endo -54.27 -33.86 77.38 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.102 1.868 . . . . 0.0 112.921 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.485 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 20.7 t70 -87.14 -29.67 21.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.9 0.381 . . . . 0.0 110.371 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.622 ' HA ' ' HE2' ' A' ' 156' ' ' LYS . 24.2 tp -56.96 -39.65 74.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.589 179.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 60.4 mt -64.18 -40.32 88.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.361 176.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -66.93 -34.62 78.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.223 -178.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 153' ' ' LEU . 54.4 mttm -55.6 -30.76 61.45 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.087 0.47 . . . . 0.0 110.962 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.88 13.64 71.69 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.688 -0.768 . . . . 0.0 111.756 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 28.7 m -79.7 -17.12 12.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.136 0.494 . . . . 0.0 110.78 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 61.8 mt -91.95 125.84 44.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.007 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 19.6 tm0? -71.15 130.56 41.79 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . 0.461 ' HD2' ' HD2' ' A' ' 164' ' ' LYS . 13.5 p-80 -67.44 95.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.177 0.513 . . . . 0.0 111.301 -178.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.556 ' HZ1' ' HB3' ' A' ' 162' ' ' LYS . 9.3 mtpm? -94.95 -167.52 1.65 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.595 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 67.39 6.66 5.03 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.679 174.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.461 ' HD2' ' HD2' ' A' ' 161' ' ' HIS . 27.2 mtpp -75.27 -42.46 54.88 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 40.6 t -71.82 129.14 37.91 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 174.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -78.06 93.89 4.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.961 0.41 . . . . 0.0 110.745 -176.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -105.73 136.67 44.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.867 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 49.0 tp -120.91 137.01 54.8 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 177.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.04 149.3 25.92 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 58.2 t60 -129.21 88.67 2.74 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -86.77 110.1 19.69 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.025 -177.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 70.4 t60 -58.17 117.86 4.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.102 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 37.6 m80 -87.1 175.2 8.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.094 177.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 11.6 p80 -71.62 -16.16 62.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.185 0.517 . . . . 0.0 109.915 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 117.983 -1.008 . . . . 0.0 109.253 -178.23 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ptm . . . . . 0 N--CA 1.481 1.103 0 CA-C-O 120.53 0.205 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.39 82.45 7.21 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.743 0.306 . . . . 0.0 110.871 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 58.4 73.16 0.49 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.757 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -67.52 -30.19 69.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.171 -176.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.407 ' O ' HG22 ' A' ' 9' ' ' VAL . . . -60.63 -43.11 97.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.106 0.479 . . . . 0.0 109.856 176.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 25.0 m -66.94 -43.5 83.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.42 177.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.08 -49.19 78.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.696 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.441 ' HG3' ' N ' ' A' ' 9' ' ' VAL . 12.4 ptm180 -65.44 -45.3 84.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.437 -175.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.441 ' N ' ' HG3' ' A' ' 8' ' ' ARG . 88.4 t -61.73 -43.65 97.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 C-N-CA 121.124 -0.231 . . . . 0.0 111.047 -177.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.7 t -63.96 -31.35 52.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.915 0.388 . . . . 0.0 110.696 178.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.1 m -83.18 -17.33 43.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.257 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -93.08 -4.3 52.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.328 0.585 . . . . 0.0 110.095 175.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.1 mt -116.63 89.07 26.82 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.619 176.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -40.67 139.52 1.24 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.058 3.172 . . . . 0.0 113.687 -176.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.58 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.5 m -81.23 151.46 4.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.325 -177.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.6 mp -83.98 169.53 14.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.436 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.401 ' N ' ' HD2' ' A' ' 17' ' ' LYS . 2.6 mptp? -122.64 -48.39 2.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.959 0.409 . . . . 0.0 110.235 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.8 m -84.32 95.54 8.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.407 0.623 . . . . 0.0 110.957 -177.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -89.22 79.46 7.11 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.444 0.64 . . . . 0.0 110.089 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -122.68 168.23 12.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.075 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.512 ' HA3' ' O ' ' A' ' 90' ' ' TYR . . . -125.38 177.89 16.79 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.247 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.503 ' HB2' HG22 ' A' ' 88' ' ' ILE . 18.0 Cg_exo -66.45 -4.46 10.81 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 123.317 2.678 . . . . 0.0 112.959 -175.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.403 ' HD2' HG23 ' A' ' 88' ' ' ILE . 15.0 mmm180 -64.65 -35.44 81.02 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.946 0.403 . . . . 0.0 109.948 174.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -110.25 106.41 15.8 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.582 ' O ' HG22 ' A' ' 29' ' ' VAL . 74.6 mtm180 -61.6 -39.46 91.32 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.807 -173.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -70.02 -47.47 61.97 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.899 0.38 . . . . 0.0 110.958 -175.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.96 -28.43 67.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.373 177.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 59.6 t-105 -64.59 -39.46 93.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.891 174.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.582 HG22 ' O ' ' A' ' 25' ' ' ARG . 72.4 t -55.8 -44.27 76.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.489 175.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -64.46 -50.74 66.31 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.369 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.405 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 22.8 ttt180 -62.47 -36.59 82.95 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.07 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.81 -40.86 69.95 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 178.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.545 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 66.9 mttm -65.86 -44.65 84.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.3 177.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -64.71 -41.46 95.97 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.531 -178.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -58.87 -43.33 90.82 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.2 0.524 . . . . 0.0 109.661 175.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -65.74 -31.35 72.3 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.451 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.545 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 28.9 mm-40 -61.01 -47.44 86.45 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.806 0.336 . . . . 0.0 110.419 178.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.0 m -63.04 -40.62 98.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.491 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.468 ' O ' HG22 ' A' ' 43' ' ' VAL . 95.7 mt -63.78 -55.43 23.13 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.229 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 97.9 mt -56.63 -43.08 78.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 O-C-N 123.29 0.368 . . . . 0.0 111.267 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.1 tpp85 -57.99 -47.19 83.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.605 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -69.82 -37.69 76.31 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.782 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.468 HG22 ' O ' ' A' ' 39' ' ' LEU . 75.3 t -60.56 -40.24 83.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.878 0.37 . . . . 0.0 110.675 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.58 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 40.7 mt-10 -70.32 -37.86 74.81 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.979 177.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -57.69 -42.61 83.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.426 0.631 . . . . 0.0 109.698 172.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.591 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 15.3 m-20 -62.55 -57.56 10.68 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.708 -1.133 . . . . 0.0 112.008 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.58 ' HG2' ' HA ' ' A' ' 44' ' ' GLU . 21.7 ptmt -66.6 -25.64 66.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.483 -175.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -76.42 -21.02 56.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.951 0.405 . . . . 0.0 110.692 176.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -97.95 4.04 49.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.059 175.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.4 t70 60.06 26.38 15.71 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.956 0.884 . . . . 0.0 110.908 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -134.67 87.55 2.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.005 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.591 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 41.9 t0 -83.06 156.71 23.21 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.053 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.554 ' HB3' ' CD2' ' A' ' 54' ' ' PHE . 1.2 m95 -100.25 -56.9 2.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.863 -170.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.554 ' CD2' ' HB3' ' A' ' 53' ' ' TRP . 44.5 p90 -161.51 157.52 25.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.327 0.584 . . . . 0.0 111.87 -172.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -108.46 123.72 49.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 168.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.0 tp -130.92 124.12 30.41 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.061 0.458 . . . . 0.0 110.683 -173.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -101.9 158.51 16.08 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.465 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.2 m -141.84 149.92 40.93 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.753 0.311 . . . . 0.0 110.687 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.0 p-10 -79.27 169.97 17.33 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 172.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.615 ' HD3' ' H ' ' A' ' 60' ' ' LYS . 1.9 mppt? -63.31 -24.04 67.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.764 0.316 . . . . 0.0 111.534 -175.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -82.0 -22.41 36.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.911 -177.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.25 21.93 79.26 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.783 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.507 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . 15.4 p -99.42 -28.09 13.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.176 0.512 . . . . 0.0 111.182 -177.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.699 HH22 ' HB3' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -119.27 109.11 15.44 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.462 -178.399 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 1.008 ' HB2' ' HB2' ' A' ' 84' ' ' PHE . 27.1 m95 -107.51 140.18 40.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.138 177.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -152.35 142.42 22.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.789 0.328 . . . . 0.0 110.687 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 173.71 -149.82 11.33 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -142.02 138.61 31.95 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.894 0.347 . . . . 0.0 110.596 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.41 ' HA ' ' HB3' ' A' ' 54' ' ' PHE . 49.0 t -122.34 150.93 41.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.008 -178.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.689 ' HB3' ' HA ' ' A' ' 79' ' ' GLU . 47.5 p90 -159.9 159.98 33.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.817 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -149.2 139.64 22.44 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 172.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 26.1 mm -84.03 114.4 24.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.011 0.434 . . . . 0.0 110.938 -173.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -127.11 122.19 33.55 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.476 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.405 ' C ' ' H ' ' A' ' 76' ' ' LEU . 0.8 OUTLIER 62.3 34.07 16.09 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 123.667 0.604 . . . . 0.0 110.075 178.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.633 HD13 ' HA ' ' A' ' 164' ' ' LYS . 1.8 tm? 75.36 -20.03 0.37 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.927 -178.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.405 ' H ' ' C ' ' A' ' 74' ' ' ASP . 62.4 mt -66.2 115.79 6.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.737 0.303 . . . . 0.0 110.86 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -94.34 106.97 18.95 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.472 ' HD1' ' HE1' ' A' ' 80' ' ' PHE . 6.7 p90 -121.8 117.69 27.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.129 0.49 . . . . 0.0 110.432 177.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.689 ' HA ' ' HB3' ' A' ' 70' ' ' TRP . 0.9 OUTLIER -110.72 138.98 46.42 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.867 -177.424 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.472 ' HE1' ' HD1' ' A' ' 78' ' ' TYR . 65.5 m-85 -127.83 129.79 47.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.63 -177.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -73.65 125.0 27.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.226 0.536 . . . . 0.0 110.206 174.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.445 HG22 HG12 ' A' ' 99' ' ' VAL . 38.3 pt -127.92 155.34 39.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.659 -175.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.699 ' HB3' HH22 ' A' ' 64' ' ' ARG . 44.7 mt-10 -127.37 163.0 24.98 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.771 175.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 1.008 ' HB2' ' HB2' ' A' ' 65' ' ' TRP . 93.2 m-85 -134.94 143.32 46.82 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.435 176.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -121.56 137.96 54.51 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.507 ' HB ' ' HA ' ' A' ' 63' ' ' THR . 51.0 mm -108.3 89.38 5.79 Favored Pre-proline 0 C--N 1.312 -1.057 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.463 -178.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -56.98 150.31 56.55 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.101 1.867 . . . . 0.0 110.531 175.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.503 HG22 ' HB2' ' A' ' 22' ' ' PRO . 2.1 mt -79.16 1.48 2.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.544 0.688 . . . . 0.0 109.996 -174.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.1 p -88.02 -4.94 58.74 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.737 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.747 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 33.5 t80 -65.39 145.51 99.06 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.528 175.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.747 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 98.1 Cg_endo -95.75 5.53 45.67 Favored 'Cis proline' 0 N--CA 1.455 -0.753 0 C-N-CA 124.453 -1.061 . . . . 0.0 113.029 0.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 10.2 m -62.13 -33.7 74.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.537 0.684 . . . . 0.0 109.653 178.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.0 m -111.59 135.47 52.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.065 171.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.56 146.16 98.99 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.051 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.534 ' HD3' ' CE1' ' A' ' 90' ' ' TYR . 57.3 Cg_endo -73.74 159.07 46.16 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.54 2.16 . . . . 0.0 111.697 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.414 ' CD ' ' HZ2' ' A' ' 114' ' ' LYS . 21.0 mt-10 -104.5 129.8 52.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.187 0.518 . . . . 0.0 111.178 -175.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.473 HD13 HD13 ' A' ' 142' ' ' LEU . 54.4 mt -101.64 123.64 54.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.215 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -113.08 135.0 54.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.115 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.445 HG12 HG22 ' A' ' 82' ' ' ILE . 18.7 t -121.09 87.74 44.21 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-O 120.588 0.233 . . . . 0.0 111.407 -176.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.45 -20.63 71.08 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.993 2.462 . . . . 0.0 112.347 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.408 ' O ' ' HE2' ' A' ' 105' ' ' LYS . 9.8 tp10 -71.75 -29.03 64.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.204 0.526 . . . . 0.0 110.602 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.0 mt -98.28 -31.43 12.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -50.86 109.64 0.34 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 123.724 0.64 . . . . 0.0 111.554 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 92.23 -36.75 3.57 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.747 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.408 ' HE2' ' O ' ' A' ' 101' ' ' GLU . 37.2 ttpt -81.45 -26.55 35.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.081 0.467 . . . . 0.0 111.031 -175.191 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 5.8 t -113.83 161.79 17.13 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.838 0.352 . . . . 0.0 110.596 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' A' ' 108' ' ' LYS . . . -111.61 -173.44 2.24 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.962 ' HB3' ' HZ1' ' A' ' 108' ' ' LYS . 3.8 ttpm? 75.31 -29.56 0.19 Allowed 'General case' 0 N--CA 1.471 0.576 0 O-C-N 123.3 0.375 . . . . 0.0 111.686 176.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.427 ' H ' ' C ' ' A' ' 107' ' ' ALA . 41.6 ttm -73.45 124.39 25.72 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 172.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.488 ' HE1' ' HB3' ' A' ' 116' ' ' CYS . 20.5 p90 -66.78 152.71 45.0 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 177.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -61.55 113.58 2.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.101 0.477 . . . . 0.0 110.628 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 177.28 -35.32 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.75 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 87.94 -13.22 61.74 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.419 176.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 97' ' ' ILE . 17.1 ptpt -101.87 158.68 15.95 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.457 HD11 HD11 ' A' ' 97' ' ' ILE . 38.6 pt -72.28 147.98 9.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.958 0.409 . . . . 0.0 111.323 -176.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.488 ' HB3' ' HE1' ' A' ' 110' ' ' TYR . 2.0 p -97.97 116.98 31.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.523 178.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 96.7 mt -92.77 158.69 15.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.988 0.423 . . . . 0.0 111.28 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.2 t -87.62 157.39 19.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.207 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.28 -53.35 59.16 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 -172.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -71.59 -10.01 59.11 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -173.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -71.06 -33.96 70.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.928 0.394 . . . . 0.0 110.238 178.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -62.14 -55.39 41.04 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.632 -177.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -62.42 -34.84 75.27 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.584 1.523 . . . . 0.0 111.917 175.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 49.2 tp -59.35 -46.41 88.7 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.368 177.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 57.3 t-105 -59.33 -56.03 27.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.707 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.33 -36.51 82.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.159 -175.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -67.72 -31.89 72.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.301 -177.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -95.96 20.97 9.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.455 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.46 HG13 ' HA ' ' A' ' 130' ' ' PRO . 90.4 t -91.28 137.6 26.11 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 172.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.46 ' HA ' HG13 ' A' ' 129' ' ' VAL . 97.5 Cg_endo -93.36 -152.88 0.37 Allowed 'Cis proline' 0 N--CA 1.46 -0.493 0 C-N-CA 124.265 -1.139 . . . . 0.0 113.58 2.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.58 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 9.6 mtmp? 77.21 -5.96 2.08 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.955 0.902 . . . . 0.0 111.614 -176.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -80.74 152.22 28.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.291 174.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.405 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -156.72 179.17 32.74 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.797 -0.716 . . . . 0.0 111.977 -174.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.601 ' HG ' ' HE2' ' A' ' 138' ' ' MET . 53.9 tp -64.73 -40.76 95.87 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 122.57 0.348 . . . . 0.0 111.197 -174.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.42 -35.91 76.92 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.499 0.666 . . . . 0.0 110.751 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . 0.4 ' HE1' ' HA ' ' A' ' 15' ' ' VAL . 47.7 m80 -71.23 -33.02 69.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.166 178.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 62.0 tp -66.49 -33.81 76.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.321 176.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.601 ' HE2' ' HG ' ' A' ' 134' ' ' LEU . 23.7 mmt -56.87 -55.65 31.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.098 0.475 . . . . 0.0 110.173 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.17 -40.77 82.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.674 -0.693 . . . . 0.0 112.657 -177.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.1 mt -86.36 -28.97 23.31 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -171.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -115.61 -57.13 0.34 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.285 -0.959 . . . . 0.0 113.165 -175.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.473 HD13 HD13 ' A' ' 97' ' ' ILE . 10.2 tt -62.48 -49.51 75.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.64 0.257 . . . . 0.0 111.208 -174.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.25 -61.45 7.38 Favored Glycine 0 CA--C 1.524 0.65 0 CA-C-N 116.178 -0.465 . . . . 0.0 113.49 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.83 -35.77 89.39 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.891 2.394 . . . . 0.0 113.059 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -65.22 -40.93 94.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.613 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 80.1 mt -59.95 -33.58 72.11 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.805 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.73 -13.87 62.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.663 -177.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 44.8 t -103.17 -35.85 3.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.091 0.472 . . . . 0.0 110.641 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -85.71 -51.89 6.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.027 -174.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.546 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 40.8 mm -60.67 -52.11 74.9 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -170.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.546 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 56.2 Cg_exo -53.74 -34.71 75.74 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 122.18 1.92 . . . . 0.0 112.707 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -67.14 -41.03 86.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.595 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 57.8 tp -68.81 -35.72 77.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.082 0.468 . . . . 0.0 110.371 176.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 150' ' ' ILE . 77.2 mt -62.4 -48.3 88.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.363 177.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -66.01 -26.06 67.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.842 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . 0.535 ' HE3' HG22 ' A' ' 158' ' ' VAL . 34.8 ttpt -74.0 -16.03 61.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.987 0.422 . . . . 0.0 110.268 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 83.62 18.32 64.16 Favored Glycine 0 C--O 1.229 -0.164 0 C-N-CA 121.078 -0.582 . . . . 0.0 113.607 172.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . 0.535 HG22 ' HE3' ' A' ' 156' ' ' LYS . 41.1 t -88.4 -18.59 8.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.526 0.679 . . . . 0.0 110.751 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.469 HD12 HG12 ' A' ' 154' ' ' ILE . 66.0 mt -93.19 129.28 43.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.29 119.88 7.18 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 177.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -70.05 108.32 4.02 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -176.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.503 ' HE3' ' HA ' ' A' ' 162' ' ' LYS . 0.8 OUTLIER -63.19 134.78 56.52 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.251 -177.205 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.18 121.2 17.92 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.265 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.633 ' HA ' HD13 ' A' ' 75' ' ' LEU . 3.7 ttmp? -89.98 -26.14 20.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.039 -174.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . 0.614 ' HA ' HD13 ' A' ' 168' ' ' LEU . 84.1 m -83.35 4.29 27.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.033 0.444 . . . . 0.0 111.184 -177.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -103.87 126.03 50.71 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 66.46 28.03 9.65 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.787 0.803 . . . . 0.0 109.596 -177.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . 0.614 HD13 ' HA ' ' A' ' 165' ' ' CYS . 1.2 tt -77.12 110.86 12.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.428 -178.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -55.04 -36.6 65.69 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.542 -0.753 . . . . 0.0 111.85 -174.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . 0.488 ' HB2' HD21 ' A' ' 168' ' ' LEU . 26.8 m-70 -64.0 -22.09 66.78 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -112.27 -20.29 11.91 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.072 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -64.13 -41.4 97.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.456 174.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -109.12 121.99 46.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.719 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -72.35 119.48 16.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.411 -178.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 . . . . . 0 C--O 1.245 0.844 0 CA-C-O 118.495 -0.764 . . . . 0.0 109.542 178.575 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.904 0 CA-C-O 120.85 0.357 . . . . 0.0 110.204 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -114.61 14.17 17.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.231 0.539 . . . . 0.0 110.403 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -120.92 127.32 51.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.643 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.34 -35.15 47.92 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.092 -177.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.463 ' HA ' ' NE ' ' A' ' 8' ' ' ARG . . . -62.98 -46.37 88.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.907 0.384 . . . . 0.0 110.745 -178.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.433 ' O ' HG21 ' A' ' 10' ' ' VAL . 24.8 m -56.62 -49.53 74.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.186 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.6 ptt180 -67.79 -38.24 83.07 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -173.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.463 ' NE ' ' HA ' ' A' ' 5' ' ' ALA . 17.3 ptt180 -71.17 -32.23 68.65 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.535 -177.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.409 HG21 ' O ' ' A' ' 5' ' ' ALA . 79.1 t -68.64 -45.59 81.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.433 HG21 ' O ' ' A' ' 6' ' ' THR . 57.4 t -67.89 -26.5 34.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.891 0.377 . . . . 0.0 110.899 178.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.3 t -70.03 -50.79 37.83 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.741 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.432 ' O ' ' HD2' ' A' ' 41' ' ' ARG . 50.2 mt-10 -83.94 -8.96 59.04 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -176.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.425 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 54.0 mt -104.74 88.2 2.16 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 170.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.6 Cg_endo -49.42 146.09 14.83 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.919 3.079 . . . . 0.0 113.657 -170.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.0 m -77.55 160.8 4.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.255 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.482 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 6.1 mp -110.05 148.99 30.65 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.161 -176.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -110.24 -20.96 12.47 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 -174.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 32.7 m -88.44 115.86 26.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.771 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -112.49 104.34 12.45 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -151.07 157.94 43.44 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.266 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.17 -177.05 29.04 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.152 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.95 5.68 5.15 Favored 'Trans proline' 0 CA--C 1.531 0.348 0 C-N-CA 122.913 2.409 . . . . 0.0 113.103 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.765 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 0.4 OUTLIER -92.52 -46.61 7.55 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 177.598 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -80.16 75.9 6.93 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 174.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.53 ' HA ' ' HB3' ' A' ' 28' ' ' TRP . 93.8 mtt180 -71.22 -25.06 62.34 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -168.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.529 ' HG3' HD23 ' A' ' 27' ' ' LEU . 7.5 pt-20 -63.53 -35.78 81.61 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.371 171.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.529 HD23 ' HG3' ' A' ' 26' ' ' GLU . 3.8 mm? -81.29 -29.52 34.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.046 0.451 . . . . 0.0 109.954 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.53 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 64.5 t-105 -61.16 -39.18 89.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.445 177.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.505 HG21 ' O ' ' A' ' 25' ' ' ARG . 87.2 t -59.55 -40.96 83.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 121.107 0.479 . . . . 0.0 110.414 175.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -66.86 -41.76 86.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.226 0.536 . . . . 0.0 109.678 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.538 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 11.8 tpt180 -62.23 -36.54 82.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.805 176.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 61.9 mt -57.8 -54.9 41.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.215 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.462 ' HB2' ' HE3' ' A' ' 33' ' ' LYS . 19.1 ptmt -61.23 -37.02 81.57 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.572 -176.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -59.31 -50.87 72.32 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.133 0.492 . . . . 0.0 110.68 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.454 ' HA ' HD22 ' A' ' 16' ' ' LEU . 8.5 tp10 -65.44 -42.05 92.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.138 -178.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.477 ' O ' HG13 ' A' ' 40' ' ' ILE . 23.5 m-85 -60.53 -45.36 94.11 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.165 178.284 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -60.66 -40.63 92.77 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.655 0.264 . . . . 0.0 110.848 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.3 t -64.73 -46.89 80.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.97 177.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.484 ' O ' HG23 ' A' ' 43' ' ' VAL . 64.0 mt -56.07 -53.92 51.26 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.293 177.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.516 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 82.5 mt -55.98 -40.67 64.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.883 -175.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.465 ' O ' ' HD3' ' A' ' 41' ' ' ARG . 0.0 OUTLIER -61.33 -44.34 97.35 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.704 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -65.91 -36.99 84.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.11 178.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 39' ' ' LEU . 94.9 t -64.89 -42.46 94.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.62 177.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.516 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 42.1 mt-10 -53.51 -56.21 18.9 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 123.315 0.384 . . . . 0.0 111.289 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -52.22 -41.85 63.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.146 0.498 . . . . 0.0 111.075 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.603 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 83.3 m-20 -72.47 -51.07 21.73 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.602 -176.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 31.9 mmmt -59.08 -38.93 80.61 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.557 0.218 . . . . 0.0 111.14 176.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -63.57 -41.46 98.38 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.499 178.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.18 3.69 22.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.865 0.364 . . . . 0.0 110.495 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.1 t70 67.9 9.38 7.1 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.681 0.792 . . . . 0.0 111.23 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.603 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 5.9 t30 -98.78 77.3 2.24 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.77 102.5 0.59 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.386 0.613 . . . . 0.0 109.848 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.571 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -67.04 -57.16 7.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.66 -1.155 . . . . 0.0 112.437 -168.808 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.571 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 37.1 p90 -156.72 161.44 39.82 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.27 0.557 . . . . 0.0 111.152 -171.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.489 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 18.4 tpp85 -121.46 123.42 42.02 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 171.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 19.4 tp -124.03 122.68 38.54 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.031 0.443 . . . . 0.0 110.401 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -105.59 156.06 18.61 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.442 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.8 p -135.54 159.72 40.73 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.767 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -73.1 176.32 5.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.104 173.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -57.56 -43.08 84.21 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.915 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -81.22 -20.47 40.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.718 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.82 25.97 65.93 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.646 -0.787 . . . . 0.0 111.314 -173.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.7 p -85.71 -4.89 59.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.972 0.415 . . . . 0.0 112.014 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 56.0 ttt180 -155.95 129.86 8.58 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -121.22 142.09 50.24 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 -177.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -155.0 160.99 41.48 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 -177.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.489 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 163.68 -160.09 32.83 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.537 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -115.21 147.07 40.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.811 0.339 . . . . 0.0 110.91 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.573 ' SG ' ' HB2' ' A' ' 80' ' ' PHE . 5.3 p -117.49 134.26 55.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.134 172.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.459 ' CD1' ' HG2' ' A' ' 79' ' ' GLU . 13.6 m-90 -114.24 128.65 56.46 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.221 0.534 . . . . 0.0 111.559 -175.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -136.21 120.6 18.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.088 175.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.418 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.7 mp -105.61 123.73 60.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.981 0.419 . . . . 0.0 110.486 -176.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -128.46 108.31 10.44 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.717 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.27 57.69 4.33 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.674 0.609 . . . . 0.0 111.31 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.571 ' HB3' ' HB3' ' A' ' 164' ' ' LYS . 88.8 mt 70.11 -0.6 2.72 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.355 -0.839 . . . . 0.0 113.141 175.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 66.5 mt -91.91 113.69 26.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.999 0.428 . . . . 0.0 110.571 177.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.3 tttt -99.95 96.3 7.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.181 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.543 ' HH ' HG23 ' A' ' 150' ' ' ILE . 2.8 p90 -104.54 125.96 51.18 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.053 0.454 . . . . 0.0 110.182 176.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.459 ' HG2' ' CD1' ' A' ' 70' ' ' TRP . 28.4 mt-10 -106.88 135.41 48.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.186 -174.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.573 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . 84.7 m-85 -120.9 129.97 53.71 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.679 0.276 . . . . 0.0 110.871 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -88.09 121.09 30.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.859 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 40.1 pt -125.34 157.19 34.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.541 -178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -158.57 158.99 35.0 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.723 174.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 30.5 p90 -159.14 153.79 24.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.349 177.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.416 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 8.7 p-10 -99.41 166.6 11.1 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.89 -177.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.3 mm -111.95 89.68 12.0 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.201 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.416 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 11.0 Cg_exo -66.02 164.66 26.62 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.551 2.167 . . . . 0.0 112.12 -177.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 58.0 mt -66.49 -22.14 29.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.36 0.6 . . . . 0.0 110.052 177.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -82.23 3.38 27.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.041 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.642 ' HH ' ' HB2' ' A' ' 134' ' ' LEU . 70.6 t80 -77.94 142.72 65.17 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -96.23 10.51 41.76 Favored 'Cis proline' 0 N--CA 1.457 -0.645 0 C-N-CA 124.178 -1.176 . . . . 0.0 113.126 -1.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.506 ' HA ' HG11 ' A' ' 129' ' ' VAL . 15.9 m -56.51 -35.3 67.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.32 0.581 . . . . 0.0 110.99 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.4 m -130.66 127.62 39.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.886 175.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.38 143.44 82.81 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.824 -179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -83.63 134.0 6.31 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.69 2.26 . . . . 0.0 112.226 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.59 ' HB2' ' HD2' ' A' ' 114' ' ' LYS . 2.9 mp0 -62.24 132.64 53.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.149 176.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.488 ' O ' HG12 ' A' ' 115' ' ' ILE . 57.7 mt -75.64 143.47 13.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.391 -178.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.503 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -107.45 124.1 49.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.792 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 25.6 t -119.98 87.22 38.25 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.016 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -70.73 6.2 1.74 Allowed 'Trans proline' 0 N--CA 1.474 0.379 0 C-N-CA 123.5 2.8 . . . . 0.0 114.046 -173.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -103.95 -44.03 5.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.836 0.351 . . . . 0.0 110.84 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.795 ' HA ' ' HD3' ' A' ' 105' ' ' LYS . 91.4 mt -83.47 0.33 46.78 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -172.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.486 ' HA ' ' SD ' ' A' ' 109' ' ' MET . 8.1 p-10 -64.6 -15.1 60.6 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -171.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -114.8 2.71 23.03 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.56 -0.828 . . . . 0.0 113.633 -177.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.795 ' HD3' ' HA ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -127.96 -20.34 3.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.688 0.744 . . . . 0.0 112.37 -178.466 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.55 HG23 ' O ' ' A' ' 102' ' ' LEU . 7.7 t -110.85 -32.88 6.69 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.382 173.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 59.58 25.92 14.86 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.87 177.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.9 tppt? -83.11 7.05 17.09 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.266 0.555 . . . . 0.0 110.368 -178.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.499 ' HE2' HG22 ' A' ' 115' ' ' ILE . 1.9 mpt? -91.45 134.74 34.37 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.152 -178.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -114.92 6.3 15.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.174 0.511 . . . . 0.0 110.735 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.649 ' HB3' ' HB2' ' A' ' 114' ' ' LYS . 24.0 ttm180 -156.49 82.18 0.97 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.531 175.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 63.45 -103.47 0.68 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.196 -177.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . 0.503 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . -100.42 -5.54 54.13 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.292 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.649 ' HB2' ' HB3' ' A' ' 111' ' ' ARG . 64.1 mmtt -70.03 111.77 5.94 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 122.422 0.289 . . . . 0.0 110.978 -179.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.499 HG22 ' HE2' ' A' ' 109' ' ' MET . 34.9 pt -81.65 164.17 3.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.312 -178.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 53.0 t -99.85 119.89 38.9 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.058 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 96.1 mt -79.17 177.07 9.1 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.859 175.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.65 140.18 58.84 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.561 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.09 -46.56 61.83 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -171.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.6 m170 -92.91 -5.93 49.73 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.414 -174.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -71.38 -41.18 69.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.357 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.552 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 79.2 tttt -65.79 -49.89 57.11 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.68 -177.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.552 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 34.6 Cg_exo -60.99 -32.15 92.08 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.839 1.693 . . . . 0.0 111.83 175.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 52.3 tp -60.82 -46.98 88.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.984 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.479 ' O ' HG23 ' A' ' 129' ' ' VAL . 17.7 t-105 -54.23 -56.66 16.18 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.565 177.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -58.23 -35.21 71.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.648 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 6.1 ttp180 -68.31 -36.31 79.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.066 0.46 . . . . 0.0 110.801 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -79.76 -31.4 40.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.513 -173.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.506 HG11 ' HA ' ' A' ' 92' ' ' THR . 94.8 t -53.5 137.24 51.75 Favored Pre-proline 0 N--CA 1.468 0.433 0 O-C-N 123.394 0.434 . . . . 0.0 110.545 176.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.483 ' HA ' HG12 ' A' ' 129' ' ' VAL . 86.5 Cg_endo -90.43 -147.55 0.28 Allowed 'Cis proline' 0 C--N 1.349 0.572 0 C-N-CA 124.28 -1.133 . . . . 0.0 113.204 5.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.482 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 33.1 ttpt 67.5 4.69 3.93 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.409 0.684 . . . . 0.0 111.439 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -101.56 159.96 14.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.789 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.538 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -136.78 158.25 24.07 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.947 -174.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.642 ' HB2' ' HH ' ' A' ' 90' ' ' TYR . 53.6 tp -63.84 -38.76 92.29 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.23 0.612 . . . . 0.0 111.198 -177.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.59 -31.03 56.24 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.407 0.622 . . . . 0.0 111.165 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -71.2 -31.46 67.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.514 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 63.1 tp -61.73 -48.34 81.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.943 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.471 ' HE3' ' HG ' ' A' ' 134' ' ' LEU . 5.4 mpp? -66.25 -41.03 90.52 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.738 0.304 . . . . 0.0 111.206 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.18 -49.99 44.83 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 87.8 mt -88.86 -21.71 23.54 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -172.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -106.77 -62.58 0.59 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.01 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.491 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 53.9 tp -64.75 -42.15 95.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 -175.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.03 -61.87 6.49 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 121.248 -0.501 . . . . 0.0 112.991 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . 0.468 ' O ' HG22 ' A' ' 148' ' ' VAL . 48.9 Cg_exo -58.66 -33.84 98.52 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.635 2.223 . . . . 0.0 112.699 176.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 39.9 t90 -59.72 -44.31 93.78 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.994 0.426 . . . . 0.0 110.258 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 76.8 mt -62.75 -37.75 87.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.719 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.9 -11.84 61.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.907 -176.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.468 HG22 ' O ' ' A' ' 144' ' ' PRO . 59.5 t -89.13 -46.66 15.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.787 0.327 . . . . 0.0 110.828 178.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.417 ' O ' HD22 ' A' ' 153' ' ' LEU . 59.2 mm-40 -83.8 -43.14 15.72 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -173.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.543 HG23 ' HH ' ' A' ' 78' ' ' TYR . 1.6 mp -54.21 -50.97 81.63 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -170.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 11.6 Cg_endo -54.91 -34.0 84.31 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 122.108 1.872 . . . . 0.0 113.055 -178.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 15.9 t70 -87.5 -43.2 12.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.98 0.419 . . . . 0.0 110.75 -177.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.417 HD22 ' O ' ' A' ' 149' ' ' GLU . 4.2 mm? -60.44 -35.58 76.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.639 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . 0.51 ' HA ' ' HB ' ' A' ' 159' ' ' ILE . 67.9 mt -65.25 -40.32 88.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.066 0.46 . . . . 0.0 110.187 175.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -66.14 -34.75 78.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.564 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 58.8 mtpt -65.29 -17.93 64.9 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.28 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 81.19 22.03 61.61 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.7 178.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 28.5 m -103.2 -21.16 5.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.855 0.359 . . . . 0.0 110.797 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.51 ' HB ' ' HA ' ' A' ' 154' ' ' ILE . 45.0 mm -84.25 138.62 18.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . 0.432 ' NE2' ' HD3' ' A' ' 162' ' ' LYS . 25.1 tp60 -65.32 102.82 0.71 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.188 0.518 . . . . 0.0 111.754 -176.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -102.86 110.46 22.39 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 172.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.453 ' HG3' ' H ' ' A' ' 163' ' ' GLU . 9.4 tptm -135.96 -158.05 0.84 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.523 -172.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.453 ' H ' ' HG3' ' A' ' 162' ' ' LYS . 34.4 mt-10 -60.32 131.65 51.44 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.059 -178.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.571 ' HB3' ' HB3' ' A' ' 75' ' ' LEU . 54.1 mttp -77.39 -18.12 57.57 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.194 -173.061 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 51.3 t -103.57 118.02 35.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.0 0.429 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -81.05 82.63 6.95 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -81.14 -2.61 49.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.94 -178.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -77.79 106.21 9.47 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.75 -179.5 3.96 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.199 177.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -117.59 126.71 53.03 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.954 -172.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -95.85 98.99 10.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.165 175.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 23.2 p80 -142.25 142.48 32.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.588 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 7.0 p80 -141.44 128.71 21.06 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.984 178.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -74.13 -31.69 62.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 177.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 78.9 t60 . . . . . 0 C--O 1.248 1.025 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.415 175.782 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.11 -21.15 29.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.868 0.366 . . . . 0.0 111.32 -177.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -89.78 20.57 4.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.101 0.477 . . . . 0.0 110.245 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 2.7 tm-20 -58.3 -54.64 44.75 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.097 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.47 ' O ' HG22 ' A' ' 9' ' ' VAL . . . -59.58 -42.14 91.83 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.856 177.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.1 m -58.88 -51.14 71.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.609 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.47 ' HG2' ' O ' ' A' ' 4' ' ' GLU . 14.3 ptm180 -65.26 -38.07 89.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.702 -174.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.1 ppt_? -75.16 -23.5 57.78 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.247 -177.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.47 HG22 ' O ' ' A' ' 5' ' ' ALA . 76.1 t -75.56 -50.68 22.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.826 0.346 . . . . 0.0 110.217 175.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.8 t -62.29 -30.4 48.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.876 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.8 t -64.31 -21.89 66.76 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.386 -178.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -95.98 2.37 53.41 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.975 0.416 . . . . 0.0 110.812 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.471 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 32.1 mt -118.93 88.0 35.1 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.471 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 6.4 Cg_endo -46.76 148.64 3.63 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 124.398 3.399 . . . . 0.0 114.382 -170.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.4 m -83.36 152.88 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.237 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.751 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 6.1 mp -103.21 136.15 43.53 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.382 -175.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.47 ' HD2' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -94.76 -45.62 7.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.188 0.518 . . . . 0.0 110.779 -173.434 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.448 HG23 ' HB3' ' A' ' 30' ' ' GLN . 0.6 OUTLIER -88.86 83.35 6.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.224 -174.681 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.461 ' OD1' ' HD2' ' A' ' 31' ' ' ARG . 84.9 m-20 -124.62 127.37 47.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.413 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.411 ' HB1' ' HB3' ' A' ' 27' ' ' LEU . . . -140.45 -65.5 0.45 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.866 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 158.85 166.71 18.43 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.873 -0.679 . . . . 0.0 111.694 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.9 -10.87 29.47 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.061 2.508 . . . . 0.0 111.89 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.509 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 4.8 mmp_? -63.63 -44.47 93.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.417 176.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.531 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 10.3 t0 -91.74 111.28 22.73 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 -178.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.447 ' O ' HG21 ' A' ' 29' ' ' VAL . 18.1 mtp180 -55.14 -51.28 66.95 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.026 -178.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.77 -44.02 94.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.901 0.381 . . . . 0.0 111.345 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.531 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 4.4 mm? -70.55 -29.39 65.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.204 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.533 ' CH2' HG22 ' A' ' 86' ' ' ILE . 75.6 t-105 -73.99 -42.0 61.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 177.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' ' 25' ' ' ARG . 72.1 t -60.97 -42.51 93.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.982 0.42 . . . . 0.0 110.082 176.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.448 ' HB3' HG23 ' A' ' 18' ' ' THR . 2.4 mm100 -62.15 -52.43 63.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.604 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.505 HH12 HD22 ' A' ' 16' ' ' LEU . 1.8 ttt85 -56.62 -39.37 73.49 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.144 0.278 . . . . 0.0 111.338 178.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.511 ' HG ' ' CE2' ' A' ' 36' ' ' TYR . 18.1 tp -57.34 -47.57 81.26 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.773 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -67.5 -38.97 85.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.863 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 6.7 mm-40 -55.76 -50.67 69.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.232 0.539 . . . . 0.0 110.312 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.535 ' HA ' HD23 ' A' ' 16' ' ' LEU . 12.6 tp10 -65.53 -37.85 87.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.424 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.511 ' CE2' ' HG ' ' A' ' 32' ' ' LEU . 10.7 m-85 -59.78 -38.28 81.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.145 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -60.59 -45.12 95.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.993 0.425 . . . . 0.0 110.252 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.7 t -63.77 -47.04 82.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.552 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 35' ' ' GLU . 94.7 mt -58.78 -48.08 82.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.093 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 36' ' ' TYR . 80.0 mt -57.86 -47.14 86.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.778 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -63.43 -40.25 96.67 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.704 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -59.76 -48.87 79.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.505 HG12 ' HE2' ' A' ' 47' ' ' LYS . 94.3 t -59.19 -38.41 74.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.781 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.63 -50.31 74.31 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 173.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.2 -40.47 81.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.918 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.419 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 16.2 m120 -55.72 -55.28 34.14 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.916 176.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.505 ' HE2' HG12 ' A' ' 43' ' ' VAL . 53.8 mttm -66.21 -34.81 78.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.973 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -68.41 -28.32 66.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.704 0.287 . . . . 0.0 111.384 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -93.81 2.16 56.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.754 0.312 . . . . 0.0 110.788 177.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.1 t0 64.24 20.14 12.06 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.827 0.822 . . . . 0.0 110.677 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -118.39 72.96 0.89 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.627 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.419 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 14.8 t70 -91.85 88.81 6.78 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.172 -179.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.42 ' HB2' ' O ' ' A' ' 70' ' ' TRP . 24.1 p-90 -117.28 2.95 12.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.986 -173.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -119.23 129.88 55.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.498 0.666 . . . . 0.0 112.195 -167.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -140.45 124.23 17.24 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.906 -1.043 . . . . 0.0 108.376 174.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.7 tp -134.49 127.99 32.52 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.764 0.316 . . . . 0.0 110.259 -178.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -128.39 160.42 32.28 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.5 p -142.23 172.72 12.31 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.997 0.427 . . . . 0.0 111.019 -176.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 33.1 p30 -89.66 163.55 15.09 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 168.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.404 ' HB2' ' HE2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -66.27 -21.39 66.28 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -172.825 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -74.38 -25.94 59.8 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.572 175.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.03 22.36 78.0 Favored Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.162 -177.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 26.8 p -89.97 -26.94 20.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.864 0.364 . . . . 0.0 111.336 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.3 mtt180 -127.58 132.99 49.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.034 0.445 . . . . 0.0 110.553 175.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -115.82 128.21 55.65 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.244 175.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.7 p90 -130.4 129.32 42.91 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -131.24 166.84 22.67 Favored Glycine 0 N--CA 1.435 -1.401 0 C-N-CA 119.838 -1.173 . . . . 0.0 113.28 -172.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -124.24 131.23 53.51 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.0 p -128.64 131.6 48.07 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.418 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.42 ' O ' ' HB2' ' A' ' 53' ' ' TRP . 6.7 p90 -133.26 121.47 22.5 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.261 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.416 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 14.5 t80 -117.82 129.44 55.66 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.896 -172.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.456 ' N ' HD12 ' A' ' 72' ' ' ILE . 4.0 mp -93.83 113.79 29.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -138.21 118.68 13.83 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.653 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 56.79 45.21 22.09 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.58 0.55 . . . . 0.0 110.84 -176.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.576 ' HB2' ' HB2' ' A' ' 166' ' ' ASN . 4.4 mm? 67.26 4.74 3.83 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.479 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 99.2 mt -96.96 113.14 24.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.106 0.479 . . . . 0.0 110.126 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -96.44 93.47 6.84 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.32 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.416 ' CE1' ' HB3' ' A' ' 71' ' ' TYR . 14.2 p90 -99.66 150.13 22.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.597 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -124.37 136.27 53.95 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.499 -174.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -133.5 137.96 45.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.948 176.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -102.75 137.1 41.41 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.011 0.434 . . . . 0.0 110.051 176.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.448 HG22 HG22 ' A' ' 99' ' ' VAL . 40.8 pt -136.41 158.16 37.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.396 -176.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -155.79 156.4 34.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.245 0.545 . . . . 0.0 110.829 175.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.556 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 42.4 p90 -155.46 149.81 25.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.23 177.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -102.36 163.52 12.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.503 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.533 HG22 ' CH2' ' A' ' 28' ' ' TRP . 50.8 mm -105.66 91.49 5.12 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.189 -178.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.04 164.01 10.86 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.677 2.251 . . . . 0.0 112.798 -179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 73.4 mt -66.33 -33.39 63.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.196 -177.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.9 p -85.19 17.57 2.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.25 0.548 . . . . 0.0 111.64 -176.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.537 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 69.0 t80 -79.15 143.4 60.86 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 176.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.537 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.4 Cg_endo -96.7 14.74 36.42 Favored 'Cis proline' 0 N--CA 1.459 -0.509 0 C-N-CA 124.497 -1.043 . . . . 0.0 113.689 2.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.5 m -65.57 -26.93 68.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.543 0.687 . . . . 0.0 109.972 178.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.3 m -114.01 131.57 56.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.543 172.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.451 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -70.73 144.92 91.6 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.804 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 5.7 Cg_exo -72.8 143.41 37.14 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.8 2.334 . . . . 0.0 112.307 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' A' ' 114' ' ' LYS . 48.0 mt-10 -86.63 101.17 13.0 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.993 0.425 . . . . 0.0 110.046 179.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.556 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 61.6 mt -74.35 125.42 33.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.781 -178.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -105.58 134.14 49.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.54 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.448 HG22 HG22 ' A' ' 82' ' ' ILE . 42.5 t -127.78 86.84 57.33 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.54 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.04 -24.53 73.93 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.861 2.374 . . . . 0.0 112.664 -175.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -63.58 -38.9 92.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.574 176.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 98.7 mt -108.99 34.16 3.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.312 -177.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -63.01 -16.98 61.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.03 -175.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -171.74 30.17 0.12 Allowed Glycine 0 C--N 1.314 -0.65 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.145 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -100.08 8.2 44.11 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -175.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.55 HG23 ' HB2' ' A' ' 109' ' ' MET . 4.2 t -121.07 154.96 35.42 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 174.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -76.09 -27.95 57.36 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.7 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 21.9 pttm -115.49 101.03 8.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.391 0.615 . . . . 0.0 110.111 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.55 ' HB2' HG23 ' A' ' 106' ' ' THR . 12.6 tpt -139.26 156.62 46.94 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.711 -173.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -75.98 162.79 27.78 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -66.6 84.14 0.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.935 0.397 . . . . 0.0 111.053 176.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 135.71 -163.46 24.98 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 121.097 -0.573 . . . . 0.0 111.752 178.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -97.66 29.34 11.18 Favored Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.302 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.494 ' HD3' ' HB3' ' A' ' 96' ' ' GLU . 59.4 mttp -109.36 139.18 44.64 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 35.4 pt -68.02 146.69 12.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.149 0.499 . . . . 0.0 112.314 -173.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.2 t -104.53 100.07 9.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.885 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 97.3 mt -88.16 171.84 9.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.334 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 10.2 t -64.83 142.07 58.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.795 0.331 . . . . 0.0 110.161 178.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -65.42 -25.09 67.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.521 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -79.93 -6.67 57.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.734 0.302 . . . . 0.0 111.61 -177.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -71.71 -36.44 70.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.707 0.289 . . . . 0.0 110.529 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.448 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 99.8 mttt -68.21 -50.51 29.46 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.987 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.448 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 10.3 Cg_endo -55.29 -37.81 94.2 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 121.932 1.755 . . . . 0.0 111.88 172.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.77 -46.05 87.01 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.721 0.296 . . . . 0.0 110.27 176.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.57 ' O ' HG21 ' A' ' 129' ' ' VAL . 17.9 t-105 -53.16 -57.6 9.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.624 176.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.43 -27.35 68.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.647 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 -74.44 -25.29 59.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.958 0.409 . . . . 0.0 110.945 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -104.01 15.12 29.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.858 -175.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.57 HG21 ' O ' ' A' ' 125' ' ' TRP . 95.9 t -98.57 137.26 20.63 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.467 ' HA ' HG13 ' A' ' 129' ' ' VAL . 82.0 Cg_endo -89.98 -158.25 1.02 Allowed 'Cis proline' 0 N--CA 1.46 -0.473 0 C-N-CA 123.871 -1.304 . . . . 0.0 113.243 -0.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.751 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 57.8 mttp 75.51 0.79 3.5 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.898 0.879 . . . . 0.0 111.73 -174.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -79.08 169.77 17.68 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -149.32 160.48 28.45 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.652 -176.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.492 HD13 ' HH ' ' A' ' 90' ' ' TYR . 49.3 tp -69.85 -38.45 76.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 122.678 0.391 . . . . 0.0 110.368 -177.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.9 -30.82 64.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.246 0.546 . . . . 0.0 110.809 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -70.38 -31.9 69.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.45 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.4 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 49.5 tp -60.52 -51.96 67.22 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.137 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.404 ' HE1' ' HG ' ' A' ' 134' ' ' LEU . 5.4 mpp? -67.19 -33.61 75.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.732 0.301 . . . . 0.0 111.141 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.7 -48.39 47.68 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.976 -178.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 84.5 mt -97.97 -2.94 39.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -173.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -119.13 -64.82 0.29 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.316 -0.945 . . . . 0.0 112.586 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.457 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 52.6 tp -62.3 -51.86 66.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.47 0.176 . . . . 0.0 111.37 -176.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -50.7 -61.07 6.32 Favored Glycine 0 CA--C 1.523 0.581 0 CA-C-N 116.181 -0.463 . . . . 0.0 113.298 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . 0.556 ' O ' HG21 ' A' ' 148' ' ' VAL . 72.6 Cg_exo -53.49 -40.42 78.79 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.724 2.283 . . . . 0.0 112.73 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -63.47 -41.82 98.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.709 0.29 . . . . 0.0 110.616 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.49 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 89.7 mt -59.99 -39.28 85.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.091 0.472 . . . . 0.0 110.092 176.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.63 -18.66 64.34 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.736 -179.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.556 HG21 ' O ' ' A' ' 144' ' ' PRO . 86.4 t -71.61 -56.68 9.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -175.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -134.5 0.53 3.04 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -172.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.569 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 33.4 mm -68.2 -52.18 23.22 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.157 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.569 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 38.2 Cg_exo -61.42 -29.36 85.24 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.734 1.623 . . . . 0.0 111.516 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -69.84 -40.98 75.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.008 178.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.51 HD23 HD13 ' A' ' 159' ' ' ILE . 24.7 tp -68.11 -30.93 70.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.499 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . 0.522 HG13 ' O ' ' A' ' 150' ' ' ILE . 74.3 mt -62.14 -44.86 99.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.073 0.463 . . . . 0.0 110.077 175.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 54.3 tp60 -69.16 -14.66 63.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.081 -178.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . 0.545 ' HE2' ' HA ' ' A' ' 156' ' ' LYS . 11.2 mmpt? -68.3 -20.94 64.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.95 0.405 . . . . 0.0 110.228 174.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 88.96 13.15 62.75 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.722 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 27.5 m -100.11 -16.31 7.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.844 0.354 . . . . 0.0 111.645 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.51 HD13 HD23 ' A' ' 153' ' ' LEU . 55.6 mt -104.86 107.45 22.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.12 0.486 . . . . 0.0 110.391 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -146.15 93.21 2.29 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.594 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -95.08 -15.55 23.33 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.409 -174.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.534 ' HG3' ' OE1' ' A' ' 163' ' ' GLU . 14.8 tptp -142.45 162.26 35.93 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.219 -175.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.534 ' OE1' ' HG3' ' A' ' 162' ' ' LYS . 0.1 OUTLIER -94.92 8.61 42.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.523 -177.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -56.32 -63.63 1.13 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.035 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 41.2 m 55.13 87.03 0.05 Allowed 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.715 0.635 . . . . 0.0 111.606 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . 0.576 ' HB2' ' HB2' ' A' ' 75' ' ' LEU . 8.5 t30 -85.93 -37.89 18.58 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.164 0.507 . . . . 0.0 109.759 179.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -71.28 132.31 44.73 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.929 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 88.6 mt -74.33 103.6 4.78 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 176.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -54.91 121.34 8.45 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.014 -175.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -82.69 142.48 31.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.514 177.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 -56.07 115.8 2.64 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.068 0.461 . . . . 0.0 110.449 -175.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -130.76 146.94 52.35 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.081 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 1.2 p80 -123.39 139.65 53.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.195 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -147.38 140.06 24.83 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -177.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.494 -0.765 . . . . 0.0 108.977 177.807 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 121.021 0.438 . . . . 0.0 110.592 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.56 4.85 52.78 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.611 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.555 ' HB3' ' HB ' ' A' ' 6' ' ' THR . 55.1 m-20 64.38 47.24 3.13 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.945 177.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -56.91 -54.81 42.37 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.723 -178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.474 ' O ' HG22 ' A' ' 9' ' ' VAL . . . -57.9 -43.91 86.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.625 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.555 ' HB ' ' HB3' ' A' ' 3' ' ' ASP . 17.4 m -57.43 -48.63 78.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.59 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.42 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 24.0 mmt180 -64.11 -38.98 93.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.79 0.328 . . . . 0.0 110.658 -178.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 8' ' ' ARG . 44.5 ttp180 -65.2 -40.02 93.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.286 177.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.474 HG22 ' O ' ' A' ' 5' ' ' ALA . 52.3 t -63.96 -44.14 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.04 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.513 HG21 ' O ' ' A' ' 6' ' ' THR . 46.7 t -68.38 -20.15 25.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 121.103 0.478 . . . . 0.0 110.613 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.1 m -81.54 -47.61 12.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.786 176.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -69.85 -27.88 65.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.896 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.545 HG23 ' HB2' ' A' ' 38' ' ' SER . 39.6 mt -106.56 88.67 3.54 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.827 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -65.69 179.32 1.77 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.981 2.454 . . . . 0.0 113.109 -174.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.576 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.8 m -88.85 162.98 2.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.102 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.801 HD21 ' HB3' ' A' ' 35' ' ' GLU . 9.1 mp -92.07 156.09 17.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.448 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -71.45 -33.06 69.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.151 0.5 . . . . 0.0 110.267 178.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.542 HG22 ' HB3' ' A' ' 31' ' ' ARG . 3.0 t -146.74 152.36 38.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.629 -176.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -132.1 36.32 3.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.084 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.63 149.48 48.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.439 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.38 176.78 54.58 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.327 -179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.8 -3.44 6.88 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.364 2.709 . . . . 0.0 112.587 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HD2' HG22 ' A' ' 88' ' ' ILE . 0.3 OUTLIER -64.11 -29.5 70.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.7 176.944 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -109.33 110.55 21.74 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 57.9 mtp85 -56.61 -51.59 68.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.647 -174.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -65.6 -52.82 49.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.68 0.276 . . . . 0.0 111.197 -174.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.497 HD12 HG21 ' A' ' 18' ' ' THR . 4.4 mm? -63.67 -33.42 75.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.002 -177.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.454 ' CZ2' HG22 ' A' ' 86' ' ' ILE . 63.7 t-105 -63.19 -52.05 63.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.633 176.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.6 t -64.7 -34.34 69.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.975 0.417 . . . . 0.0 110.662 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -71.58 -44.48 64.42 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.053 -178.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.542 ' HB3' HG22 ' A' ' 18' ' ' THR . 6.8 ptm180 -68.37 -28.54 67.2 Favored 'General case' 0 CA--C 1.523 -0.095 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -43.72 76.08 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.046 174.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -67.51 -40.48 85.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.536 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -61.12 -45.05 96.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.233 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.801 ' HB3' HD21 ' A' ' 16' ' ' LEU . 22.0 pt-20 -77.41 -29.29 52.99 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.953 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.0 OUTLIER -57.35 -47.1 82.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.92 0.39 . . . . 0.0 110.404 171.747 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -63.98 -37.92 89.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.732 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.561 ' OG ' ' HA ' ' A' ' 35' ' ' GLU . 0.6 OUTLIER -72.18 -31.38 65.86 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.732 177.068 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 56.9 mt -62.28 -49.28 76.3 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 170.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.3 mt -58.32 -40.66 78.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.837 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.427 ' NE ' ' HA ' ' A' ' 41' ' ' ARG . 4.5 mmp_? -53.42 -52.54 59.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.75 0.31 . . . . 0.0 111.192 176.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -63.16 -47.2 83.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.697 -177.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.8 t -62.67 -41.38 92.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.545 ' OE2' ' HD3' ' A' ' 47' ' ' LYS . 6.7 tp10 -61.72 -51.34 68.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.354 0.597 . . . . 0.0 110.318 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -59.31 -39.45 83.1 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.89 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -66.9 -47.42 71.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.573 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.545 ' HD3' ' OE2' ' A' ' 44' ' ' GLU . 22.8 ptmt -66.59 -28.75 68.75 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.207 -0.197 . . . . 0.0 110.887 -178.053 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.98 -24.72 61.63 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.245 0.545 . . . . 0.0 110.302 176.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -88.17 7.06 33.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.266 176.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.7 t70 72.81 3.87 4.81 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.469 176.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.504 ' C ' HD21 ' A' ' 51' ' ' ASN . 0.2 OUTLIER -117.81 86.11 2.46 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.129 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.27 136.07 51.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.088 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -88.79 -78.78 0.33 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.906 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -150.95 171.25 17.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.124 0.488 . . . . 0.0 111.453 -170.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 -132.48 124.05 27.81 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.043 172.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.534 HD12 ' HE3' ' A' ' 138' ' ' MET . 9.0 mt -126.69 127.12 44.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.94 0.4 . . . . 0.0 111.378 -178.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -133.22 163.32 29.55 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.354 173.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -129.54 166.72 19.11 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.737 0.303 . . . . 0.0 110.738 -173.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.481 ' HB3' ' OE1' ' A' ' 61' ' ' GLU . 4.3 m-20 -58.71 159.71 6.42 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 167.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -67.19 -17.94 65.04 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 -177.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.481 ' OE1' ' HB3' ' A' ' 59' ' ' ASN . 1.4 mp0 -85.78 -17.66 35.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.021 0.438 . . . . 0.0 110.519 174.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.03 11.55 83.89 Favored Glycine 0 C--O 1.227 -0.311 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.542 -177.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.4 p -77.37 -36.7 53.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.884 0.373 . . . . 0.0 111.808 -177.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.7 mtt180 -123.07 144.22 49.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.095 0.474 . . . . 0.0 110.857 175.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.958 ' HB2' ' HB2' ' A' ' 84' ' ' PHE . 22.8 m95 -118.89 150.33 40.05 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.196 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -154.12 150.61 28.34 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 174.27 -165.1 36.5 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.297 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -138.29 142.3 39.8 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.446 ' SG ' HD12 ' A' ' 82' ' ' ILE . 78.1 m -115.9 129.63 56.49 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.065 177.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.624 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 28.9 m-90 -100.5 125.85 46.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.949 0.404 . . . . 0.0 109.963 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 38.5 t80 -117.37 120.32 37.81 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.131 0.491 . . . . 0.0 110.367 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 50.8 mm -94.9 118.44 41.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.7 178.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.418 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 10.2 t60 -141.56 121.43 13.57 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.69 41.49 15.01 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.465 0.65 . . . . 0.0 110.156 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.8 mt 71.92 -4.89 1.83 Allowed 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.214 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.543 HD23 ' HE1' ' A' ' 161' ' ' HIS . 63.7 mt -91.95 144.6 25.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.666 0.27 . . . . 0.0 110.762 -177.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.589 ' HB2' ' HZ1' ' A' ' 77' ' ' LYS . 3.8 ttmp? -109.34 117.42 34.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.508 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -130.28 128.68 42.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.782 0.325 . . . . 0.0 110.14 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.624 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 9.6 pt-20 -102.29 145.24 29.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.158 -177.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -123.48 135.78 54.24 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.874 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -92.14 129.82 38.0 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.803 -178.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.505 HG22 HG21 ' A' ' 99' ' ' VAL . 42.5 pt -126.78 149.58 31.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.734 -174.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -131.15 163.44 27.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.981 174.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.958 ' HB2' ' HB2' ' A' ' 65' ' ' TRP . 44.9 m-85 -150.11 148.66 29.25 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.854 -179.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -129.85 148.13 51.69 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 169.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.454 HG22 ' CZ2' ' A' ' 28' ' ' TRP . 47.9 mm -109.68 91.7 10.94 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -172.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 15.0 Cg_endo -56.19 159.02 13.48 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.533 2.155 . . . . 0.0 111.715 174.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.51 HG22 ' HD2' ' A' ' 23' ' ' ARG . 23.3 mm -71.99 -14.58 17.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.373 0.606 . . . . 0.0 110.702 -175.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.2 p -89.69 1.98 55.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.634 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.626 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 65.6 t80 -80.62 146.87 61.73 Favored Pre-proline 0 C--N 1.328 -0.336 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 176.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.626 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 85.1 Cg_endo -95.18 16.41 39.24 Favored 'Cis proline' 0 C--N 1.351 0.671 0 C-N-CA 124.519 -1.034 . . . . 0.0 113.608 1.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -64.04 -37.06 86.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.591 0.71 . . . . 0.0 109.586 176.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.4 m -111.16 124.73 52.78 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.799 176.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -71.58 144.43 88.73 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.811 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -89.48 -164.44 0.16 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.907 2.405 . . . . 0.0 112.04 177.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -123.89 127.15 47.59 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.595 HG12 ' CZ ' ' A' ' 84' ' ' PHE . 47.6 mt -66.05 115.76 4.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -89.54 112.38 23.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.026 -176.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.505 HG21 HG22 ' A' ' 82' ' ' ILE . 34.0 t -125.28 85.34 58.45 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.804 176.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -73.58 -9.62 22.91 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.795 2.33 . . . . 0.0 112.59 -175.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -73.68 -43.13 60.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.398 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.4 ' O ' HG23 ' A' ' 106' ' ' THR . 90.3 mt -82.36 -30.19 30.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.836 -178.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.488 ' HB2' ' HA2' ' A' ' 113' ' ' GLY . 16.6 t70 -53.66 124.91 16.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.949 178.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 106.37 -27.25 17.55 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.214 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.773 ' HG2' HG13 ' A' ' 158' ' ' VAL . 10.5 mptt -101.25 -42.4 6.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.016 0.436 . . . . 0.0 110.424 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.543 ' HB ' HD21 ' A' ' 153' ' ' LEU . 5.7 t -93.6 155.59 17.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.386 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -126.65 11.95 7.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.073 -179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -86.66 -8.31 57.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.827 0.346 . . . . 0.0 110.638 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.454 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 2.5 ppp? -121.27 -171.86 2.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.265 -176.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -86.37 120.65 27.95 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.006 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -59.87 111.86 1.63 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.83 176.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 148.31 -13.31 1.24 Allowed Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.567 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . 0.488 ' HA2' ' HB2' ' A' ' 103' ' ' ASP . . . 109.61 2.9 30.74 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.856 -0.688 . . . . 0.0 113.014 176.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.16 136.91 43.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.901 0.381 . . . . 0.0 111.056 -178.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 43.4 pt -69.19 162.18 3.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.878 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.454 ' HB2' ' HA ' ' A' ' 109' ' ' MET . 53.1 t -113.63 105.32 13.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.847 0.356 . . . . 0.0 110.345 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.1 mt -93.74 -178.33 4.65 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.842 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.8 t -85.14 158.81 20.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.002 -176.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -75.32 -12.88 60.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.069 0.462 . . . . 0.0 110.741 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 61.1 m-70 -80.79 -12.26 59.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.264 0.554 . . . . 0.0 110.201 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -70.75 -45.18 65.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.346 -172.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.442 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 14.7 mmmm -60.53 -52.23 74.26 Favored Pre-proline 0 C--O 1.236 0.392 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -175.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.442 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 26.5 Cg_endo -63.85 -31.87 67.31 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 121.769 1.646 . . . . 0.0 112.205 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 47.4 tp -66.1 -45.09 82.42 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.9 0.381 . . . . 0.0 110.171 177.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 41.8 t-105 -56.88 -49.3 75.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.482 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.14 -21.85 65.81 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.727 -176.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -84.64 -35.16 22.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.125 0.488 . . . . 0.0 110.3 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -73.85 -42.43 60.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.076 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.482 HG11 ' HA ' ' A' ' 130' ' ' PRO . 98.7 t -60.28 141.07 91.25 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.482 ' HA ' HG11 ' A' ' 129' ' ' VAL . 65.6 Cg_endo -84.29 -159.47 1.82 Allowed 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 124.909 -0.871 . . . . 0.0 114.061 6.49 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.576 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 73.7 mmtt 71.36 11.25 6.7 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.631 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -94.65 163.27 13.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.208 0.528 . . . . 0.0 111.742 -171.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -159.43 162.63 32.98 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.064 -0.814 . . . . 0.0 111.064 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.7 tp -60.39 -29.14 68.75 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -173.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.13 -39.12 66.19 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.187 0.518 . . . . 0.0 111.781 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.0 m80 -71.47 -32.48 68.34 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.95 -178.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 49.3 tp -63.28 -44.05 96.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 110.746 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.534 ' HE3' HD12 ' A' ' 56' ' ' LEU . 14.4 mmt -64.11 -52.69 57.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.512 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.08 -34.16 77.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.548 -175.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.1 mt -98.39 -17.9 18.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -174.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -111.72 -64.04 0.49 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.981 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.457 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 38.5 tp -63.16 -41.31 99.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 -171.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.95 -61.79 6.98 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.084 -179.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -58.74 -28.69 87.46 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.766 2.311 . . . . 0.0 112.908 177.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 64.7 t90 -72.05 -45.64 60.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.052 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.462 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 96.7 mt -60.16 -34.99 74.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.079 0.466 . . . . 0.0 111.16 -178.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.23 -2.81 20.29 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.989 -176.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 60.5 t -92.82 -55.28 6.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -109.82 -12.49 14.59 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -170.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.582 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 1.4 mp -55.58 -45.52 99.86 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.689 178.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.582 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 11.0 Cg_endo -55.77 -32.36 84.07 Favored 'Trans proline' 0 C--N 1.357 1.02 0 C-N-CA 122.026 1.817 . . . . 0.0 112.73 174.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.597 ' HA ' ' HG2' ' A' ' 155' ' ' GLN . 31.6 t70 -71.29 -36.48 71.68 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 120.589 0.233 . . . . 0.0 110.645 -179.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.543 HD21 ' HB ' ' A' ' 106' ' ' THR . 4.3 mm? -65.7 -31.63 72.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.9 0.381 . . . . 0.0 110.362 176.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 66.0 mt -72.51 -47.11 53.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.616 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.597 ' HG2' ' HA ' ' A' ' 152' ' ' ASP . 13.3 pt20 -71.16 -20.84 62.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.805 0.336 . . . . 0.0 110.723 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -72.68 -32.39 65.77 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.105 0.479 . . . . 0.0 109.762 175.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 99.58 10.08 48.29 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.176 177.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . 0.773 HG13 ' HG2' ' A' ' 105' ' ' LYS . 42.1 t -91.62 -14.06 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.356 0.598 . . . . 0.0 110.485 -178.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 37.4 mm -84.07 111.89 20.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.139 176.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -84.98 118.13 24.37 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.257 -178.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . 0.543 ' HE1' HD23 ' A' ' 76' ' ' LEU . 82.2 t60 -75.52 120.38 20.86 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.93 0.395 . . . . 0.0 111.315 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -102.25 -71.56 0.71 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.562 176.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -155.95 162.49 40.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.582 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.97 -79.01 0.5 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.977 0.418 . . . . 0.0 111.064 -178.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 64.5 m -100.79 139.67 36.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.696 -176.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -100.73 6.57 43.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.092 0.472 . . . . 0.0 109.963 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.412 ' HG3' ' H ' ' A' ' 168' ' ' LEU . 12.7 tp60 -143.53 170.41 15.88 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -177.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . 0.412 ' H ' ' HG3' ' A' ' 167' ' ' GLN . 5.4 mp -70.94 152.64 43.42 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 178.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.41 146.8 50.13 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -158.13 -178.39 7.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.713 0.292 . . . . 0.0 110.99 -173.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -74.03 142.75 45.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.408 -177.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 16.0 m170 -95.42 141.29 29.14 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -177.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -109.6 85.42 2.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.943 0.401 . . . . 0.0 110.901 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -175.62 165.29 3.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.165 177.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 18.1 p80 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.147 -0.93 . . . . 0.0 109.975 -179.789 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.481 1.104 0 CA-C-O 120.806 0.336 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.3 -156.0 0.62 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.135 -179.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -76.12 159.02 31.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.865 0.364 . . . . 0.0 110.094 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -66.82 -37.98 85.56 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.487 ' O ' HG21 ' A' ' 9' ' ' VAL . . . -59.14 -34.29 71.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.339 176.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.436 ' O ' HG21 ' A' ' 10' ' ' VAL . 7.4 m -58.53 -50.38 73.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.979 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -72.92 -25.28 60.99 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.042 -0.263 . . . . 0.0 111.136 -177.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -69.98 -43.74 70.83 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.487 HG21 ' O ' ' A' ' 5' ' ' ALA . 73.8 t -58.37 -44.99 89.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.613 177.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.436 HG21 ' O ' ' A' ' 6' ' ' THR . 50.5 t -67.04 -24.21 31.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.183 0.516 . . . . 0.0 110.815 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t -80.01 -43.1 22.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.657 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.582 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 42.5 mt-10 -75.45 -27.27 58.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.844 0.354 . . . . 0.0 110.94 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 47.9 mt -104.92 89.19 2.73 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.235 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.582 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 33.1 Cg_exo -59.23 165.06 9.55 Favored 'Trans proline' 0 N--CA 1.475 0.385 0 C-N-CA 123.538 2.826 . . . . 0.0 113.811 -173.102 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.454 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 30.3 m -83.59 162.42 3.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.166 178.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.563 HD22 ' HB2' ' A' ' 35' ' ' GLU . 7.0 mp -93.44 134.55 35.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.407 177.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -36.61 74.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.702 0.287 . . . . 0.0 111.293 -176.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.445 ' O ' ' HG3' ' A' ' 31' ' ' ARG . 6.2 p -107.61 139.67 41.8 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.725 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -132.56 77.11 1.73 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.409 0.623 . . . . 0.0 109.547 176.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -115.86 174.68 5.9 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.276 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.29 -179.69 23.15 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.331 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -69.29 2.39 3.31 Favored 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 123.015 2.477 . . . . 0.0 112.847 -178.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.405 ' HD2' HG23 ' A' ' 88' ' ' ILE . 26.3 mtp-105 -74.76 -44.68 48.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.617 0.722 . . . . 0.0 109.775 176.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.514 ' HB3' HD23 ' A' ' 27' ' ' LEU . 11.8 m-20 -94.62 101.54 13.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.653 -1.158 . . . . 0.0 109.925 -174.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.555 ' O ' HG23 ' A' ' 29' ' ' VAL . 60.2 mtm180 -57.63 -52.84 63.76 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -170.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.6 -41.6 92.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.049 0.452 . . . . 0.0 110.902 -175.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.514 HD23 ' HB3' ' A' ' 24' ' ' ASP . 3.3 mm? -67.63 -34.46 77.02 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.976 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.575 ' CH2' HG22 ' A' ' 86' ' ' ILE . 76.4 t-105 -67.66 -43.35 80.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.406 177.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.555 HG23 ' O ' ' A' ' 25' ' ' ARG . 84.1 t -61.09 -47.21 94.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 O-C-N 123.186 0.304 . . . . 0.0 111.501 -178.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.496 ' HA ' ' HG2' ' A' ' 33' ' ' LYS . 3.8 pt20 -72.03 -32.49 67.17 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.72 -178.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.445 ' HG3' ' O ' ' A' ' 18' ' ' THR . 18.8 ttp85 -66.22 -39.8 89.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.55 0.691 . . . . 0.0 109.301 174.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -63.69 -47.69 80.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.192 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.496 ' HG2' ' HA ' ' A' ' 30' ' ' GLN . 19.4 ptpt -64.38 -38.42 90.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.672 0.272 . . . . 0.0 111.204 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 12.7 mm-40 -69.54 -32.52 71.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.018 0.437 . . . . 0.0 110.366 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.563 ' HB2' HD22 ' A' ' 16' ' ' LEU . 37.6 tt0 -70.59 -35.98 73.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.435 176.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.422 ' O ' HG13 ' A' ' 40' ' ' ILE . 4.5 m-30 -59.71 -49.14 78.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.74 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -59.4 -41.46 89.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.943 0.401 . . . . 0.0 110.602 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.5 t -58.33 -44.8 88.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.346 177.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.449 ' O ' HG21 ' A' ' 43' ' ' VAL . 88.1 mt -64.16 -52.64 58.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.274 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 36' ' ' TYR . 86.3 mt -54.58 -41.45 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.473 -176.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -56.8 -45.98 81.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.938 0.399 . . . . 0.0 110.85 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -73.56 -35.71 65.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.672 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.449 HG21 ' O ' ' A' ' 39' ' ' LEU . 80.9 t -62.68 -45.95 97.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.993 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -34.27 75.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.193 -179.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -60.88 -44.43 97.09 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 174.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.52 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 62.0 m-20 -63.55 -36.97 85.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.837 177.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -60.97 -49.68 76.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.727 0.299 . . . . 0.0 110.712 177.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.97 -41.06 95.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.264 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -86.09 5.9 31.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.757 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 56.03 33.2 21.38 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 122.127 0.965 . . . . 0.0 109.816 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -117.66 24.85 10.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.068 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.52 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 29.9 t70 -67.5 100.14 0.83 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.973 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 58.5 p-90 -114.33 2.93 14.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.282 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -162.29 169.6 20.37 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.554 -178.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -160.99 124.33 3.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.3 168.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.486 HD12 ' HA3' ' A' ' 67' ' ' GLY . 3.4 mm? -90.24 123.99 34.5 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.304 -178.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -110.22 147.17 34.3 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 176.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.7 p -128.94 157.1 42.58 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 120.981 0.419 . . . . 0.0 111.31 -171.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -79.31 168.56 19.36 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 172.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -57.1 -49.33 76.23 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -174.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -68.76 -19.54 64.33 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.849 0.357 . . . . 0.0 111.551 178.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.43 16.49 80.32 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.774 -174.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.5 p -88.46 -39.55 14.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.171 0.51 . . . . 0.0 111.078 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -101.57 128.46 47.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.075 174.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 54.9 m95 -116.04 145.15 43.23 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.011 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -152.36 86.06 1.28 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.688 0.756 . . . . 0.0 109.674 -177.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.486 ' HA3' HD12 ' A' ' 56' ' ' LEU . . . -104.8 146.55 16.14 Favored Glycine 0 N--CA 1.439 -1.104 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.074 -176.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 81' ' ' ASP . 1.5 ptpp? -100.18 130.93 46.37 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 54.8 m -131.48 127.99 38.47 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.089 -177.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.717 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 8.2 p90 -119.32 138.51 52.99 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.07 0.462 . . . . 0.0 110.948 -177.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -117.54 120.45 38.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.786 -178.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.438 HD11 ' N ' ' A' ' 72' ' ' ILE . 4.1 mp -91.39 121.03 41.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.996 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -147.97 124.6 11.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.011 175.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.1 t70 59.95 50.13 7.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.034 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.4 mt 74.46 -33.43 0.25 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 114.767 -1.106 . . . . 0.0 112.642 178.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 51.1 mt -76.0 139.61 41.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.038 0.447 . . . . 0.0 111.548 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -121.38 106.86 11.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.966 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.404 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 79.9 m-85 -96.26 121.53 38.15 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.255 178.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.717 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 0.0 OUTLIER -108.38 135.83 49.03 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.418 0.628 . . . . 0.0 111.208 -179.903 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -128.41 120.25 26.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.158 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.403 ' HA ' ' HA ' ' A' ' 68' ' ' LYS . 2.4 m-20 -78.24 119.12 21.17 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 171.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.4 pt -114.46 130.31 69.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.337 0.589 . . . . 0.0 110.416 -179.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -120.06 149.4 42.24 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.538 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.576 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 45.7 p90 -158.14 162.8 37.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.338 0.589 . . . . 0.0 110.934 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -106.64 154.78 20.43 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.176 -177.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.575 HG22 ' CH2' ' A' ' 28' ' ' TRP . 43.7 mm -104.19 90.46 3.13 Favored Pre-proline 0 C--N 1.324 -0.517 0 C-N-CA 122.734 0.413 . . . . 0.0 110.676 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -70.99 175.9 8.46 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.797 2.332 . . . . 0.0 112.182 -177.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.405 HG23 ' HD2' ' A' ' 23' ' ' ARG . 51.6 mm -68.47 -22.66 27.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.147 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.63 -13.74 61.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.219 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.542 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 63.5 t80 -87.47 143.75 34.61 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.542 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 23.0 Cg_endo -96.34 26.17 20.36 Favored 'Cis proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.825 -0.906 . . . . 0.0 112.883 0.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.1 m -69.57 -34.99 74.95 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.528 0.68 . . . . 0.0 110.129 178.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -131.32 145.64 51.95 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.16 175.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.12 144.3 99.02 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.437 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -80.61 161.08 22.03 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.79 2.327 . . . . 0.0 112.342 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -93.17 101.56 13.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.24 0.543 . . . . 0.0 110.537 -177.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.576 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 63.2 mt -72.38 136.72 25.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.783 -177.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -102.28 116.66 33.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.788 0.328 . . . . 0.0 110.864 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.428 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 5.8 p -124.04 87.74 53.05 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-O 121.889 0.852 . . . . 0.0 110.659 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' A' ' 99' ' ' VAL . 18.8 Cg_endo -59.97 -36.35 90.3 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 123.287 2.658 . . . . 0.0 114.056 -172.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -82.65 17.87 1.7 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -171.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.453 ' O ' HG21 ' A' ' 106' ' ' THR . 42.3 mt -106.09 -15.69 14.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.274 0.559 . . . . 0.0 109.751 169.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.68 144.01 54.57 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.101 -176.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 77.74 -8.64 34.5 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.601 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.9 mtmm -117.22 -48.92 2.61 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.71 -0.288 . . . . 0.0 111.473 -176.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.453 HG21 ' O ' ' A' ' 102' ' ' LEU . 14.1 t -94.98 166.05 12.14 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -148.0 168.8 21.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.827 -177.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 108' ' ' LYS . 39.3 tttm 65.71 8.9 5.54 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.788 0.68 . . . . 0.0 110.89 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.51 ' SD ' ' HA ' ' A' ' 115' ' ' ILE . 9.2 tmm? -113.77 3.55 15.58 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.865 -174.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 66.2 t80 64.17 95.55 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.557 0.694 . . . . 0.0 110.109 -174.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.1 24.26 1.36 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.873 -172.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -83.89 41.51 2.97 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.901 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 68.77 26.87 74.28 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 121.174 -0.536 . . . . 0.0 112.767 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -141.44 -171.9 3.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.51 ' HA ' ' SD ' ' A' ' 109' ' ' MET . 46.3 pt -123.7 152.36 28.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.891 0.377 . . . . 0.0 111.115 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.8 t -112.09 111.06 21.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.473 173.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.35 165.32 20.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.604 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 2.7 m -55.1 133.67 48.96 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.856 179.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -56.91 -49.42 75.62 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -172.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -79.03 -15.43 58.25 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.991 -0.284 . . . . 0.0 111.703 -177.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -71.37 -33.69 69.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.134 0.493 . . . . 0.0 110.145 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.576 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 54.0 mtpt -59.88 -51.22 82.28 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.427 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.576 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 25.9 Cg_exo -64.63 -35.62 46.33 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.761 1.641 . . . . 0.0 111.862 171.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.5 tp -59.6 -37.34 78.3 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.881 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.498 ' O ' HG22 ' A' ' 129' ' ' VAL . 48.0 t-105 -54.83 -50.44 68.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.417 176.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.21 -18.31 65.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.708 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -83.78 -20.4 33.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.005 0.431 . . . . 0.0 110.894 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -104.07 10.1 36.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.797 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.498 HG22 ' O ' ' A' ' 125' ' ' TRP . 94.9 t -93.79 139.69 22.79 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 174.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.463 ' HA ' HG13 ' A' ' 129' ' ' VAL . 69.5 Cg_endo -95.98 -154.7 0.35 Allowed 'Cis proline' 0 N--CA 1.456 -0.677 0 C-N-CA 124.165 -1.181 . . . . 0.0 113.49 1.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.454 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 54.8 mtmt 71.99 12.06 6.07 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.834 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -90.51 177.44 6.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.073 176.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -169.35 172.56 43.52 Favored Glycine 0 C--O 1.236 0.236 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.243 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.651 HD11 ' HE1' ' A' ' 138' ' ' MET . 45.1 tp -60.41 -36.15 77.46 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.815 0.446 . . . . 0.0 111.66 -175.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.52 -41.78 73.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.29 0.567 . . . . 0.0 111.124 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -71.84 -34.86 69.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.536 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 69.3 tp -67.3 -41.14 85.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.19 -178.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.651 ' HE1' HD11 ' A' ' 134' ' ' LEU . 24.7 mmt -69.05 -40.68 78.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.82 0.343 . . . . 0.0 111.017 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.07 -47.37 62.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.766 -177.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 86.9 mt -84.34 -29.1 26.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.005 0.431 . . . . 0.0 111.419 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' A' ' 145' ' ' TRP . . . -96.41 -77.93 1.38 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.852 -0.689 . . . . 0.0 113.092 -176.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.8 tp -55.07 -47.92 74.22 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -170.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.6 -63.15 5.48 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.995 -0.621 . . . . 0.0 113.522 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.6 -27.31 53.4 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.42 2.08 . . . . 0.0 112.085 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . 0.473 ' HZ2' ' SD ' ' A' ' 109' ' ' MET . 56.6 t90 -62.2 -45.05 95.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.74 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 96.4 mt -67.37 -34.18 76.75 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.132 0.492 . . . . 0.0 110.549 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.97 -5.05 36.08 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.954 -176.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 84.7 t -70.26 -55.13 15.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.501 ' O ' HD21 ' A' ' 153' ' ' LEU . 0.0 OUTLIER -135.08 -12.82 2.16 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.709 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.546 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 32.1 mm -55.76 -50.66 85.83 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-N 118.059 0.39 . . . . 0.0 111.836 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.546 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.3 Cg_endo -53.58 -34.75 74.36 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 122.203 1.935 . . . . 0.0 112.533 177.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -78.22 -39.31 40.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.771 -177.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.501 HD21 ' O ' ' A' ' 149' ' ' GLU . 4.0 mm? -58.35 -37.78 75.87 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.705 177.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 71.7 mt -63.02 -47.19 93.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.685 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 151' ' ' PRO . 22.3 mt-30 -68.46 -27.92 66.58 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.774 -178.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -63.85 -27.43 69.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.432 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 87.13 6.24 79.06 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.846 176.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.9 p -78.45 -26.61 14.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.294 0.569 . . . . 0.0 110.386 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 54.7 mt -83.49 138.52 19.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.0 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -59.72 113.31 2.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.173 0.511 . . . . 0.0 110.34 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -125.0 131.03 53.48 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.028 -172.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -165.72 171.52 12.85 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.694 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 65.18 41.96 4.25 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.851 0.719 . . . . 0.0 112.913 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 36.9 mtmt -96.53 -53.45 3.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.513 0.673 . . . . 0.0 109.473 172.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 62.2 m -95.39 50.74 1.26 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.385 -173.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -72.28 -51.04 22.67 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 173.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -178.9 135.91 0.14 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.057 -1.429 . . . . 0.0 108.018 178.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.87 91.84 3.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.623 0.725 . . . . 0.0 110.234 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.47 160.02 29.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.966 -175.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -139.45 122.84 17.15 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.904 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -82.05 130.35 35.06 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.239 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 69.6 t60 -64.75 125.01 23.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.504 -175.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 43.0 t-80 -84.26 116.86 23.19 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.954 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 33.6 p80 -83.21 165.32 19.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.071 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 24.5 p80 . . . . . 0 C--O 1.247 0.927 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.006 177.388 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tmt? . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 120.669 0.271 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.09 -29.38 61.82 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -173.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.435 ' O ' ' HG3' ' A' ' 7' ' ' ARG . 33.6 t70 -88.84 7.46 34.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.005 0.431 . . . . 0.0 110.775 -174.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.444 ' OE2' ' HD2' ' A' ' 8' ' ' ARG . 7.4 tm-20 -53.9 -48.7 69.87 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.816 -178.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.433 ' O ' HG22 ' A' ' 9' ' ' VAL . . . -59.55 -45.93 90.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.768 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.2 m -59.78 -55.44 34.21 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.095 0.474 . . . . 0.0 111.297 -175.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -68.99 -22.04 64.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.292 -177.354 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.444 ' HD2' ' OE2' ' A' ' 4' ' ' GLU . 21.6 ttt180 -71.16 -39.23 72.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.377 178.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.433 HG22 ' O ' ' A' ' 5' ' ' ALA . 99.4 t -63.73 -43.37 97.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.196 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.9 t -60.32 -39.13 79.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.398 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.3 m -61.86 -37.78 85.78 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -177.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -88.11 8.58 26.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.836 0.351 . . . . 0.0 111.475 -177.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 54.1 mt -121.87 86.93 46.35 Favored Pre-proline 0 C--O 1.237 0.404 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 172.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -48.85 146.29 11.88 Favored 'Trans proline' 0 C--O 1.238 0.484 0 C-N-CA 123.674 2.916 . . . . 0.0 114.047 -173.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.428 ' HB ' ' O ' ' A' ' 131' ' ' LYS . 33.0 m -81.04 162.79 3.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.611 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.753 HD21 ' HB2' ' A' ' 35' ' ' GLU . 10.0 mp -96.19 146.15 24.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.814 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -75.03 -39.54 60.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.41 -176.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.557 HG22 HD11 ' A' ' 27' ' ' LEU . 62.8 m -124.02 128.48 49.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.735 -173.196 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -91.71 118.36 30.59 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 173.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -161.2 156.75 24.67 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.578 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.29 -164.55 15.85 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.65 177.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.91 5.69 2.86 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.78 2.32 . . . . 0.0 113.232 -176.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 51.6 mtm180 -70.74 -62.67 1.3 Allowed 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -84.33 97.87 9.7 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.656 HH22 ' HG2' ' A' ' 61' ' ' GLU . 15.1 mtp180 -63.26 -33.2 74.99 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.213 -173.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -70.93 -50.73 31.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.558 0.218 . . . . 0.0 111.034 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.557 HD11 HG22 ' A' ' 18' ' ' THR . 4.3 mm? -66.91 -28.74 68.55 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.218 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.569 ' CH2' HG22 ' A' ' 86' ' ' ILE . 72.0 t-105 -60.53 -45.48 93.7 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.889 172.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.549 HG22 ' O ' ' A' ' 25' ' ' ARG . 70.2 t -61.07 -42.9 94.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.231 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.416 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 12.1 mt-30 -58.19 -53.92 52.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.388 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -67.34 -28.75 68.23 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.737 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.4 tp -62.59 -46.56 87.76 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 8.4 mtpm? -56.46 -58.81 6.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.056 176.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 18.3 mm-40 -62.13 -39.31 92.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.523 -174.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.753 ' HB2' HD21 ' A' ' 16' ' ' LEU . 39.6 tt0 -67.36 -38.29 84.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.389 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.542 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.1 m-85 -64.17 -30.45 71.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.527 176.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 90.2 mm-40 -68.3 -42.59 79.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.141 176.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.3 m -61.23 -39.72 91.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.984 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.496 HD11 ' HA ' ' A' ' 36' ' ' TYR . 76.6 mt -60.66 -49.35 77.85 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.884 177.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.542 HG13 ' O ' ' A' ' 36' ' ' TYR . 84.3 mt -51.98 -44.7 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 120.79 0.329 . . . . 0.0 110.603 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.514 ' O ' ' HB2' ' A' ' 45' ' ' ASN . 18.6 tpt180 -58.71 -51.18 71.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.222 177.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -66.62 -42.93 86.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.648 0.261 . . . . 0.0 111.066 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 94.8 t -61.83 -47.85 91.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.548 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -63.57 -42.86 98.29 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.528 0.68 . . . . 0.0 109.705 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.514 ' HB2' ' O ' ' A' ' 41' ' ' ARG . 1.0 OUTLIER -53.77 -49.29 68.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.398 178.202 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -69.7 -43.25 72.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.439 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -66.49 -43.84 84.28 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -177.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -70.98 -23.85 62.29 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.987 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.52 8.41 7.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.732 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.529 ' HB3' ' CD2' ' A' ' 172' ' ' HIS . 27.4 t0 62.77 41.39 9.03 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.597 0.713 . . . . 0.0 110.515 177.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -141.52 87.44 2.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.508 174.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -101.46 101.81 12.48 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.542 ' HA ' ' CD1' ' A' ' 70' ' ' TRP . 52.6 p-90 -123.72 -1.37 8.46 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -173.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -154.21 158.16 39.88 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.96 -172.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.89 130.34 2.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.977 168.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.3 tp -124.53 131.47 53.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.427 -173.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -126.26 175.95 7.44 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.949 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.0 m -154.46 166.96 31.62 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.729 0.299 . . . . 0.0 110.826 -178.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -79.54 172.37 13.88 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 169.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -64.31 -26.04 68.31 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -174.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.656 ' HG2' HH22 ' A' ' 25' ' ' ARG . 37.4 mt-10 -80.25 -23.53 40.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.87 0.367 . . . . 0.0 110.834 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.69 17.91 73.48 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.962 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -86.11 -6.54 58.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.227 0.536 . . . . 0.0 110.969 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 50.5 mtm180 -142.0 120.77 12.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.469 176.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 24.9 m95 -106.11 130.06 54.08 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -146.45 137.76 24.45 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.274 0.559 . . . . 0.0 110.527 -175.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.93 -152.63 6.77 Favored Glycine 0 N--CA 1.442 -0.933 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.158 -178.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.697 ' HD3' ' CZ3' ' A' ' 70' ' ' TRP . 34.9 tttp -143.02 143.16 31.78 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -177.206 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.6 p -144.84 148.42 33.96 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.697 ' CZ3' ' HD3' ' A' ' 68' ' ' LYS . 0.7 OUTLIER -138.29 151.38 47.54 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.939 0.4 . . . . 0.0 110.902 179.119 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -117.71 138.09 52.25 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.383 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.2 mm -107.22 123.99 62.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.186 -176.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -159.5 123.17 3.73 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.393 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 57.26 55.55 5.79 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.809 0.693 . . . . 0.0 112.057 177.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.632 HD11 ' HA ' ' A' ' 168' ' ' LEU . 3.7 mm? 69.46 1.64 3.4 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.789 175.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 76.8 mt -107.18 138.14 43.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.085 0.469 . . . . 0.0 111.509 -174.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.1 ttmm -119.57 109.0 15.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.246 175.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -107.04 116.0 31.16 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.599 ' HB2' ' HE3' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -105.29 144.97 31.33 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.253 0.549 . . . . 0.0 111.519 -177.215 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -135.04 151.09 50.46 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.335 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.71 118.66 37.12 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.0 pt -113.31 147.04 17.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.63 0 CA-C-O 121.109 0.481 . . . . 0.0 111.187 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -150.69 153.06 34.9 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.242 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.567 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 39.1 p90 -158.27 155.46 28.92 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.406 176.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.475 ' O ' ' HB3' ' A' ' 95' ' ' PRO . 7.8 p-10 -95.06 156.86 16.14 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.015 -176.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.569 HG22 ' CH2' ' A' ' 28' ' ' TRP . 46.8 mm -109.76 90.43 9.07 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.988 175.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 11.7 Cg_endo -53.62 155.31 13.8 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.932 2.421 . . . . 0.0 112.751 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 39.6 mm -67.75 -21.12 26.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.515 0.674 . . . . 0.0 110.031 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.1 p -85.71 10.55 13.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.89 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.557 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 51.6 t80 -72.64 145.54 87.37 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.557 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 95.3 Cg_endo -94.75 11.99 46.46 Favored 'Cis proline' 0 C--N 1.35 0.608 0 C-N-CA 124.318 -1.117 . . . . 0.0 113.328 -0.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 23.7 m -62.75 -31.22 72.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.488 0.661 . . . . 0.0 110.304 178.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 32.0 m -114.01 134.18 55.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.016 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.49 145.05 78.65 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.454 -178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.475 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 19.3 Cg_exo -66.7 151.79 81.92 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.156 2.57 . . . . 0.0 112.395 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -93.34 100.48 12.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.353 -178.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.567 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.4 mt -71.97 121.67 22.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.815 -178.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -118.71 125.47 49.74 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.106 0.479 . . . . 0.0 111.114 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 24.3 t -118.32 87.2 29.44 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.428 175.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.74 -25.21 74.9 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 123.288 2.659 . . . . 0.0 113.761 -172.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.03 -17.86 60.92 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.88 -43.59 95.61 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 38.6 t70 55.06 26.35 8.04 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.825 0.703 . . . . 0.0 112.127 170.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 68.56 16.1 69.28 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.961 -0.637 . . . . 0.0 113.045 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.528 ' HZ2' ' HB2' ' A' ' 105' ' ' LYS . 4.6 ttmp? -76.16 -18.03 59.29 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.001 0.429 . . . . 0.0 110.783 -178.059 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.415 ' OG1' HD13 ' A' ' 153' ' ' LEU . 2.9 t -86.21 -165.22 1.19 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.982 -177.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -66.99 -154.8 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.74 0.305 . . . . 0.0 111.738 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -54.99 112.16 0.99 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 121.582 0.706 . . . . 0.0 111.562 -177.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 24.9 ttt -126.13 170.02 12.22 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.376 -173.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -96.1 -170.86 2.19 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? -60.13 135.93 57.87 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.042 0.448 . . . . 0.0 111.638 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 62.43 -126.6 38.16 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.493 -0.776 . . . . 0.0 113.122 175.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -112.33 16.74 24.42 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.215 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.1 mtpp -76.73 120.81 22.42 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.6 pt -75.64 155.15 6.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.959 0.409 . . . . 0.0 110.811 -178.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 7.9 p -97.54 114.85 26.83 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.009 -178.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.8 mt -100.12 142.56 31.43 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 174.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.5 t -71.1 156.31 39.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.075 0.464 . . . . 0.0 111.261 -176.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -66.48 -42.93 86.76 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -172.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.435 ' C ' ' HD2' ' A' ' 123' ' ' PRO . 12.6 m-70 -62.25 -14.68 40.92 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -178.224 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -66.87 -33.92 76.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.952 0.406 . . . . 0.0 110.141 176.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.593 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 37.9 mtpt -62.7 -52.39 65.04 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.073 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.593 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 31.2 Cg_exo -59.74 -35.56 94.17 Favored 'Trans proline' 0 C--N 1.359 1.096 0 C-N-CA 121.697 1.598 . . . . 0.0 112.028 173.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 59.1 tp -63.55 -44.54 93.89 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.551 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.4 ' O ' HG21 ' A' ' 129' ' ' VAL . 47.3 t-105 -57.94 -57.46 12.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.894 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.72 -29.96 71.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.719 -176.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 13.3 ttm180 -64.53 -30.94 71.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.221 -178.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -102.14 16.48 25.98 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.336 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.4 HG21 ' O ' ' A' ' 125' ' ' TRP . 93.9 t -106.49 134.46 19.79 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 172.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -83.27 -162.77 2.93 Favored 'Cis proline' 0 C--N 1.347 0.45 0 C-N-CA 124.208 -1.164 . . . . 0.0 114.001 3.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.428 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 68.1 mttm 74.67 7.73 4.39 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.441 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -89.99 175.47 7.17 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 177.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -164.9 155.37 26.73 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.107 -177.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.423 HD22 ' CE2' ' A' ' 84' ' ' PHE . 43.3 tp -65.4 -30.98 71.85 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 122.78 0.432 . . . . 0.0 111.068 -175.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.428 ' O ' ' HG2' ' A' ' 138' ' ' MET . . . -56.81 -33.02 66.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.411 0.624 . . . . 0.0 110.936 176.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -71.46 -32.25 68.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.367 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.6 tp -67.44 -40.13 85.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.258 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 135' ' ' ALA . 23.5 ptp -72.09 -36.54 69.52 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.866 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -75.07 -45.69 39.71 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 88.6 mt -93.97 -23.72 17.94 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -174.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -101.17 -65.83 0.79 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.851 -177.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.6 tp -59.26 -57.14 14.33 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -173.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.82 -61.98 6.32 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-N 116.156 -0.475 . . . . 0.0 113.819 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . 0.419 ' O ' HG22 ' A' ' 148' ' ' VAL . 53.2 Cg_exo -57.29 -35.07 98.85 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.717 2.278 . . . . 0.0 113.137 -179.011 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 45.9 t90 -64.31 -49.58 71.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.058 0.456 . . . . 0.0 109.917 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.39 -32.31 73.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.8 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.22 -12.57 60.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.993 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.419 HG22 ' O ' ' A' ' 144' ' ' PRO . 67.2 t -88.57 -56.14 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.672 0.272 . . . . 0.0 110.916 178.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.517 ' O ' ' HG ' ' A' ' 153' ' ' LEU . 7.7 mm-40 -80.49 -52.79 7.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -173.24 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.588 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 48.9 mm -55.21 -54.46 50.34 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -170.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.588 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 31.6 Cg_exo -60.4 -33.76 93.89 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.99 1.793 . . . . 0.0 112.314 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -75.03 -43.49 53.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.331 -177.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 149' ' ' GLU . 23.3 mt -56.98 -34.58 68.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.247 178.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 150' ' ' ILE . 73.0 mt -62.59 -49.59 83.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.552 177.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -68.96 -34.43 75.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.489 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -73.83 -16.95 61.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.879 0.371 . . . . 0.0 111.054 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.14 24.62 47.45 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.215 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 51.4 t -83.17 -33.29 10.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.557 0.694 . . . . 0.0 109.294 178.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 72.8 mt -93.21 122.59 44.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.241 174.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -59.88 105.1 0.35 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 123.57 0.544 . . . . 0.0 111.085 -176.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -108.28 84.05 1.88 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.316 0.579 . . . . 0.0 111.024 -179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm -86.22 18.45 3.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.62 -178.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 61.88 60.95 1.47 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.527 176.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -75.91 -34.21 59.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.825 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 61.1 m 59.61 102.14 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.348 0.594 . . . . 0.0 112.304 175.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -102.62 -62.93 1.21 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.826 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -140.5 157.87 44.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.559 -178.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . 0.632 ' HA ' HD11 ' A' ' 75' ' ' LEU . 7.1 mp -90.71 166.25 13.24 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.189 -174.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -72.63 121.18 19.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.558 178.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 20.1 p-80 -125.96 119.38 27.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.131 0.491 . . . . 0.0 110.584 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -89.35 144.12 26.31 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.79 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . 0.529 ' CD2' ' HB3' ' A' ' 50' ' ' ASP . 25.1 m80 -87.32 153.64 21.31 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.531 -176.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 10.3 p-80 -56.57 136.23 54.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.071 0.463 . . . . 0.0 110.618 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -102.15 164.9 11.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.948 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 . . . . . 0 C--O 1.245 0.839 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.189 177.619 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptp . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.435 0.159 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.27 158.95 26.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.64 0.257 . . . . 0.0 110.691 178.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -86.02 -16.38 38.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.301 0.572 . . . . 0.0 110.786 -176.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 45.0 mt-10 -69.88 -44.86 68.91 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.84 -177.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -65.01 -41.31 95.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.059 0.457 . . . . 0.0 110.179 175.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.421 ' O ' HG22 ' A' ' 10' ' ' VAL . 22.6 m -62.76 -46.25 88.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.182 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.415 ' HG2' ' O ' ' A' ' 4' ' ' GLU . 11.6 ptp180 -66.77 -29.68 69.69 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.117 -176.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.5 ttm180 -62.6 -47.98 81.41 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.425 ' O ' HG13 ' A' ' 13' ' ' ILE . 58.5 t -57.34 -46.36 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.721 178.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.421 HG22 ' O ' ' A' ' 6' ' ' THR . 67.5 t -60.16 -36.9 70.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.183 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.4 m -76.08 -37.99 57.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.73 -176.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -82.37 8.58 11.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.201 0.524 . . . . 0.0 110.593 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.464 HG12 ' HB2' ' A' ' 42' ' ' TYR . 71.1 mt -114.2 89.56 17.66 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.387 171.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -40.04 143.04 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.268 3.312 . . . . 0.0 114.202 -175.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 m -83.23 162.85 3.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.732 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.813 HD22 ' HB3' ' A' ' 35' ' ' GLU . 6.8 mp -95.96 134.77 38.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.68 -177.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -86.32 -30.84 21.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.275 0.559 . . . . 0.0 109.868 174.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 27.5 m -96.83 125.89 41.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.29 -176.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -132.04 104.2 6.69 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.129 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -149.76 173.65 13.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.019 -178.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.94 166.16 17.75 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.112 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -66.86 -1.87 6.77 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 123.322 2.682 . . . . 0.0 113.327 -177.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -72.48 -18.23 61.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.583 0.23 . . . . 0.0 111.471 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -116.6 112.19 20.94 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 175.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 29' ' ' VAL . 48.8 mtt180 -58.57 -51.48 69.71 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -173.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -72.62 -35.89 67.94 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.379 -0.528 . . . . 0.0 111.667 -173.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.05 -34.32 75.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.991 0.424 . . . . 0.0 110.207 174.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.417 ' O ' HD22 ' A' ' 32' ' ' LEU . 44.9 t-105 -66.01 -48.08 72.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.878 176.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 25' ' ' ARG . 80.0 t -63.2 -35.95 74.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 178.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.512 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 5.9 tt0 -66.94 -39.05 87.21 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.925 178.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.489 HH12 ' HG3' ' A' ' 91' ' ' PRO . 25.2 ttt85 -68.61 -38.28 80.45 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.17 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.59 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 1.7 mm? -52.68 -51.97 57.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.476 176.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 18.7 ptpt -67.52 -25.53 65.88 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.621 0.248 . . . . 0.0 111.132 -179.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 28.3 mm-40 -64.47 -62.53 1.54 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.766 175.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.813 ' HB3' HD22 ' A' ' 16' ' ' LEU . 12.1 pt-20 -73.1 -26.02 61.09 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.332 -177.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.59 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -52.42 -45.81 66.1 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 169.092 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.3 mm-40 -61.01 -42.4 98.37 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.524 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.8 m -59.03 -45.04 91.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.445 176.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.428 ' O ' HG23 ' A' ' 43' ' ' VAL . 77.7 mt -60.47 -55.45 33.36 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.798 178.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 79.9 mt -60.26 -39.24 80.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.049 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 41' ' ' ARG . 6.9 tpp85 -66.69 -41.22 88.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.647 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.464 ' HB2' HG12 ' A' ' 13' ' ' ILE . 86.5 t80 -66.27 -44.77 82.66 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.091 177.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 39' ' ' LEU . 92.3 t -59.76 -38.62 76.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.329 176.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -57.13 -59.87 4.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.263 0.554 . . . . 0.0 110.061 176.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -58.8 -35.49 72.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.356 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -68.45 -46.1 70.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.461 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -67.29 -28.52 68.08 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.148 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -67.64 -14.28 62.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.89 0.376 . . . . 0.0 110.89 177.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -101.34 14.88 30.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.216 174.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.6 t70 70.54 5.83 5.55 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.504 0.721 . . . . 0.0 111.487 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.503 ' OD1' ' HD1' ' A' ' 53' ' ' TRP . 23.7 t-20 -102.28 142.37 33.62 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.862 -0.524 . . . . 0.0 110.984 -176.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -158.09 111.43 2.44 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.503 ' HD1' ' OD1' ' A' ' 51' ' ' ASN . 56.1 p-90 -130.04 -3.03 4.55 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -172.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -152.42 156.52 39.67 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.072 -0.651 . . . . 0.0 111.67 -174.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -161.92 126.79 3.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.565 171.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.514 HD12 ' HA3' ' A' ' 67' ' ' GLY . 3.8 mm? -100.54 130.38 46.6 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.242 -174.5 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -120.83 160.41 23.47 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 172.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 p -154.34 174.9 14.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 120.964 0.411 . . . . 0.0 111.163 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -83.04 170.73 14.54 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 172.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -65.65 -24.89 67.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.681 0.276 . . . . 0.0 111.544 -176.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -71.4 -24.72 62.11 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.805 0.336 . . . . 0.0 110.686 176.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.67 23.53 77.91 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.539 -0.625 . . . . 0.0 111.539 -176.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.2 p -95.2 -39.23 10.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.139 0.495 . . . . 0.0 111.397 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.1 mmt-85 -110.12 116.82 32.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.25 177.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 39.1 m95 -110.34 133.93 52.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.346 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -129.84 128.56 42.53 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.072 176.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.514 ' HA3' HD12 ' A' ' 56' ' ' LEU . . . -126.62 138.4 10.62 Favored Glycine 0 N--CA 1.441 -0.978 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.255 -175.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -101.25 131.98 47.0 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 177.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 38.0 m -120.14 136.45 54.61 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.733 -176.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 24.8 m-90 -126.35 122.74 36.27 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.331 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -128.24 119.11 24.52 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.24 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.487 HD12 ' HA ' ' A' ' 77' ' ' LYS . 31.7 mm -101.76 113.92 39.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.96 175.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 23.4 t60 -154.18 140.58 18.71 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -176.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.3 t70 62.73 27.26 16.03 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.34 0.591 . . . . 0.0 109.898 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 66.42 12.4 8.64 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.837 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.8 mt -105.93 135.73 46.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.122 0.487 . . . . 0.0 110.956 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.487 ' HA ' HD12 ' A' ' 72' ' ' ILE . 63.4 tttp -97.98 119.25 36.28 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.742 177.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -141.1 143.45 34.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.098 0.475 . . . . 0.0 110.53 174.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -135.69 148.7 49.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.994 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -138.63 144.16 39.6 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -108.57 128.38 54.77 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 121.106 0.479 . . . . 0.0 109.73 174.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 29.2 pt -117.7 151.04 19.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.583 -175.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -139.21 153.82 47.94 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 174.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.536 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 31.2 p90 -156.38 151.35 26.22 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.481 177.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.544 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 29.5 t70 -98.73 145.29 27.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.998 -177.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.0 mm -107.7 89.97 5.74 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.627 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.544 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 22.4 Cg_exo -64.49 164.04 24.89 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.554 2.169 . . . . 0.0 111.982 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 57.2 mt -69.2 -18.5 22.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.38 0.61 . . . . 0.0 110.322 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -79.95 9.02 5.85 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.392 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.614 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 78.2 t80 -77.94 139.46 61.65 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.614 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 44.2 Cg_endo -95.82 13.09 41.28 Favored 'Cis proline' 0 C--N 1.349 0.573 0 C-N-CA 124.314 -1.119 . . . . 0.0 113.856 1.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 38.1 m -58.5 -31.91 68.31 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.356 0.598 . . . . 0.0 110.496 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 35.6 m -123.63 124.4 42.7 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.785 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.475 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -69.0 143.93 95.04 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.518 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 17.2 Cg_exo -68.22 155.53 69.05 Favored 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 123.31 2.673 . . . . 0.0 112.687 179.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -102.3 116.87 33.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.926 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.536 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 4.2 mp -88.46 117.95 33.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.429 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -90.24 -44.0 10.02 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.816 -175.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.418 ' CG1' ' HG ' ' A' ' 102' ' ' LEU . 17.9 t 63.52 86.58 0.14 Allowed Pre-proline 0 CA--C 1.535 0.399 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.889 -176.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -61.15 -28.14 85.02 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.957 2.438 . . . . 0.0 112.969 -175.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.92 -37.08 83.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.855 0.36 . . . . 0.0 110.876 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.445 ' HA ' ' HB3' ' A' ' 105' ' ' LYS . 60.8 mt -82.33 -10.78 58.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.741 -173.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -61.84 112.45 2.3 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 81.02 -12.29 37.71 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.34 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 102' ' ' LEU . 3.6 tppp? -86.33 -60.7 1.93 Allowed 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.629 HG21 HD13 ' A' ' 153' ' ' LEU . 66.4 m -75.1 119.94 19.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.707 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -77.7 72.28 4.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.465 0.65 . . . . 0.0 110.285 176.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.586 ' HG2' ' H ' ' A' ' 109' ' ' MET . 31.1 ttmt -166.15 -168.49 1.25 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.586 ' H ' ' HG2' ' A' ' 108' ' ' LYS . 65.6 mtt 69.51 100.1 0.06 Allowed 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.419 0.45 . . . . 0.0 110.322 -178.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -57.62 -47.99 80.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.632 -176.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.451 HH11 ' HD2' ' A' ' 111' ' ' ARG . 44.1 mtm105 -152.57 176.34 11.81 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 82.61 -54.58 4.93 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.391 175.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 83.34 70.47 1.35 Allowed Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 98' ' ' ALA . 16.5 ptpt -164.61 164.47 21.54 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -175.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.5 pt -73.46 135.24 28.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 120.966 0.412 . . . . 0.0 110.419 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.6 t -96.83 117.92 32.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.34 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.7 mt -98.21 164.19 12.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.337 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 3.5 t -72.14 152.09 42.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.078 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -68.41 -26.93 65.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.101 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -70.43 -18.51 63.01 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.64 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -67.12 -33.62 75.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.054 0.454 . . . . 0.0 110.035 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.4 ' HB2' ' CD ' ' A' ' 123' ' ' PRO . 41.8 mtpt -58.6 -58.94 15.47 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.842 -178.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.4 ' CD ' ' HB2' ' A' ' 122' ' ' LYS . 27.9 Cg_endo -63.94 -26.76 66.6 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 121.874 1.716 . . . . 0.0 112.451 178.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 64.5 tp -66.31 -47.24 74.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.968 0.414 . . . . 0.0 110.24 175.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -67.19 -51.42 53.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.624 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.05 -15.37 59.35 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.19 -176.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -78.55 -40.91 33.59 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.95 0.405 . . . . 0.0 110.786 177.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -105.16 70.53 0.9 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.105 0.479 . . . . 0.0 110.949 -173.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 68.2 t -130.9 128.69 22.43 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.267 176.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.46 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 78.0 Cg_endo -87.92 -139.83 0.15 OUTLIER 'Cis proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.728 -1.363 . . . . 0.0 112.91 1.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 50.6 mtmt 75.54 -7.62 1.75 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.496 0.718 . . . . 0.0 111.533 -178.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.7 m-30 -95.65 141.17 29.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.29 171.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -145.98 -174.06 17.79 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 42.7 tp -57.14 -38.31 73.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.78 0.29 . . . . 0.0 111.415 -176.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.56 -43.63 89.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.005 0.431 . . . . 0.0 111.173 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 20.2 m80 -70.99 -36.66 72.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.313 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.8 tp -60.31 -47.89 84.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.249 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.785 ' HE1' ' HA ' ' A' ' 138' ' ' MET . 18.2 mmt -63.96 -43.17 96.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.034 -178.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.14 75.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.951 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.8 mt -86.86 -33.31 19.84 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -176.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -98.6 -64.89 0.86 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.4 -0.905 . . . . 0.0 113.109 -176.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.7 tp -66.21 -44.26 84.34 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -173.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -51.8 -61.59 6.32 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.371 -0.442 . . . . 0.0 113.566 -178.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -62.42 -31.46 80.98 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.571 2.18 . . . . 0.0 112.37 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 52.3 t90 -62.66 -46.17 89.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.022 0.439 . . . . 0.0 110.097 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 86.8 mt -63.94 -33.11 74.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.784 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.6 -18.1 64.86 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.476 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 64.7 t -104.36 -54.5 6.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.493 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -77.21 -35.18 55.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -171.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.555 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 31.9 mm -59.62 -51.84 78.25 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 111.79 0.292 . . . . 0.0 111.79 -178.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.555 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 50.6 Cg_exo -55.12 -34.53 87.87 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.974 1.783 . . . . 0.0 112.129 175.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.87 -45.04 87.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.725 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.629 HD13 HG21 ' A' ' 106' ' ' THR . 4.2 mm? -67.94 -30.25 69.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.231 178.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 150' ' ' ILE . 65.5 mt -70.93 -42.1 77.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.139 0.495 . . . . 0.0 110.172 175.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -63.42 -42.61 98.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.904 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 43.0 tttp -67.98 -31.83 71.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.125 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 79.99 33.67 32.5 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.904 174.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.2 t -97.37 -14.76 7.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.021 0.439 . . . . 0.0 110.934 -177.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.7 mt -75.16 87.56 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.389 0.614 . . . . 0.0 109.658 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -86.09 119.31 26.25 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.96 -174.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 33.4 p80 -153.35 153.93 33.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.802 -1.09 . . . . 0.0 108.259 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -66.52 151.48 47.18 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 178.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 67.62 89.67 0.1 Allowed 'General case' 0 C--N 1.33 -0.247 0 O-C-N 123.91 0.756 . . . . 0.0 110.648 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -126.96 -35.47 2.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.93 176.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 8.9 p -137.15 133.54 35.37 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.85 -178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -91.84 172.62 8.34 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 173.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.4 100.54 0.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 173.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.51 137.91 50.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.338 0.59 . . . . 0.0 111.978 -170.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -109.18 147.62 32.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.401 175.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -74.33 100.76 3.85 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 165.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -35.98 108.83 0.08 Allowed 'General case' 0 N--CA 1.47 0.56 0 O-C-N 124.469 1.106 . . . . 0.0 113.801 -160.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 20.7 p80 -136.69 -37.27 0.68 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.404 176.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -87.33 -40.11 14.75 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -98.75 165.83 11.6 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.528 -1.214 . . . . 0.0 108.297 170.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 26.3 p80 . . . . . 0 C--O 1.246 0.904 0 CA-C-O 118.169 -0.92 . . . . 0.0 109.476 177.634 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.452 ' O ' ' HB2' ' A' ' 2' ' ' ALA . 18.4 mmt . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 120.825 0.345 . . . . 0.0 111.103 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.452 ' HB2' ' O ' ' A' ' 1' ' ' MET . . . 147.03 -20.2 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.499 1.52 . . . . 0.0 107.71 -169.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -107.99 -2.45 19.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.34 -1.3 . . . . 0.0 111.148 -174.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' A' ' 7' ' ' ARG . 0.8 OUTLIER -63.49 -35.18 79.59 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.507 -174.1 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.41 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -67.46 -44.25 79.08 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.279 0.562 . . . . 0.0 109.965 175.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.2 m -64.68 -45.7 85.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.488 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 0.3 OUTLIER -65.52 -30.0 70.71 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.282 -178.741 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -66.64 -41.65 87.93 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 5' ' ' ALA . 71.9 t -58.74 -46.1 90.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.319 177.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.1 t -66.42 -28.85 44.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.752 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.8 t -76.87 -36.27 56.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.946 -178.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -86.13 -4.31 59.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.429 . . . . 0.0 110.879 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 61.6 mt -119.06 86.36 31.69 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 173.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.15 149.51 27.67 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.665 2.91 . . . . 0.0 113.768 -172.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.8 m -76.23 175.1 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.037 178.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.416 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 6.3 mp -100.27 163.59 12.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.485 -179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.63 -39.7 5.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 172.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.613 ' HB ' ' HG3' ' A' ' 34' ' ' GLU . 23.0 m -88.92 135.86 33.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.148 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -150.02 121.44 7.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.51 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.617 ' H ' ' HD2' ' A' ' 31' ' ' ARG . . . -156.28 -178.99 7.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.277 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.5 168.56 19.76 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.058 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.74 -7.48 18.37 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 123.2 2.6 . . . . 0.0 113.2 -177.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.417 ' HE ' ' HB2' ' A' ' 23' ' ' ARG . 11.0 mtm180 -70.28 -51.26 31.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.638 0.732 . . . . 0.0 109.723 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.6 93.77 3.65 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.133 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.408 ' O ' HG21 ' A' ' 29' ' ' VAL . 97.9 mtt180 -55.75 -52.17 64.85 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -168.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.501 ' HG3' HD21 ' A' ' 27' ' ' LEU . 10.0 pt-20 -71.37 -33.93 69.99 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -174.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.501 HD21 ' HG3' ' A' ' 26' ' ' GLU . 4.2 mm? -75.48 -33.31 60.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.967 0.413 . . . . 0.0 110.341 178.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.498 ' CH2' HG23 ' A' ' 86' ' ' ILE . 64.1 t-105 -65.32 -50.67 64.76 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.126 177.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.408 HG21 ' O ' ' A' ' 25' ' ' ARG . 84.3 t -60.17 -32.68 51.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 121.123 0.487 . . . . 0.0 110.49 177.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.508 ' HB3' HG23 ' A' ' 18' ' ' THR . 16.2 tt0 -67.32 -49.21 65.06 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.249 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.617 ' HD2' ' H ' ' A' ' 20' ' ' ALA . 2.9 ptm180 -70.31 -27.58 64.5 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.374 -0.53 . . . . 0.0 110.066 178.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.426 ' HA ' HD23 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -62.84 -44.77 95.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.231 -0.441 . . . . 0.0 109.866 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.487 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 18.5 ptpt -73.38 -31.09 63.71 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.349 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.613 ' HG3' ' HB ' ' A' ' 18' ' ' THR . 6.1 mm-40 -57.35 -51.51 69.11 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.381 0.61 . . . . 0.0 109.69 172.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.543 ' OE1' ' HA3' ' A' ' 133' ' ' GLY . 5.3 tp10 -64.66 -39.64 94.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.075 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.423 ' O ' HG13 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -61.85 -42.18 98.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.798 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 15.4 mm100 -64.43 -39.2 93.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.899 0.38 . . . . 0.0 110.314 177.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.7 t -61.74 -43.14 99.43 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.884 175.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.415 ' O ' HG23 ' A' ' 43' ' ' VAL . 61.9 mt -59.86 -52.29 66.09 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.84 175.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 36' ' ' TYR . 77.7 mt -59.06 -33.28 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.87 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 41' ' ' ARG . 6.8 tpp180 -61.1 -44.6 97.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.275 177.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -68.6 -43.17 77.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.422 177.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.491 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 86.6 t -59.42 -42.02 86.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.655 178.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.44 -47.26 86.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.756 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -54.57 -41.51 69.94 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.371 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.484 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 89.3 m-20 -67.5 -41.28 84.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.141 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 74.0 mmtt -68.09 -27.57 66.59 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.244 -0.182 . . . . 0.0 110.808 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.18 -41.65 79.7 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.946 178.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -107.83 3.88 24.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.81 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.6 t70 59.14 31.46 21.29 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.5 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -97.17 16.04 20.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.469 -177.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.484 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 20.7 t0 -57.75 138.93 55.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.202 -178.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 59.7 p-90 -143.33 -0.25 1.11 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.167 -0.47 . . . . 0.0 112.104 -172.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -140.44 135.26 31.84 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 119.893 -0.723 . . . . 0.0 112.019 -170.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -130.33 125.04 33.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.056 174.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.1 126.91 49.43 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.873 0.368 . . . . 0.0 110.274 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -118.08 160.35 21.67 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.633 177.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.4 p -158.67 168.74 26.07 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.766 0.317 . . . . 0.0 110.834 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -75.72 172.88 11.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.025 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -71.93 -14.85 62.04 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -175.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.25 -18.22 29.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.853 0.358 . . . . 0.0 110.239 176.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.22 23.94 70.2 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 116.042 -0.527 . . . . 0.0 112.244 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.8 p -90.97 -4.35 56.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.025 0.441 . . . . 0.0 111.436 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -152.47 128.42 10.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -120.59 136.97 54.65 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.865 0.364 . . . . 0.0 110.69 -176.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.4 p90 -141.01 139.25 34.14 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.326 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -165.1 -177.73 37.81 Favored Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 119.427 -1.368 . . . . 0.0 113.128 -177.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.49 ' HD2' ' CZ2' ' A' ' 70' ' ' TRP . 22.7 ttmm -130.65 133.05 45.8 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 -177.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.414 ' O ' ' HA ' ' A' ' 79' ' ' GLU . 6.9 p -112.6 130.13 56.13 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.321 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.666 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 16.6 m-90 -103.64 131.11 51.09 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.57 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -118.22 119.51 34.89 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 175.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.416 HD11 ' HG3' ' A' ' 77' ' ' LYS . 15.7 mm -101.89 119.78 50.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.221 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -140.36 107.32 5.42 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.254 177.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.5 t70 55.07 64.75 1.69 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.548 173.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.674 HD11 ' HB3' ' A' ' 165' ' ' CYS . 3.6 mm? 67.12 2.08 2.62 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.658 175.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -107.4 137.45 45.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.762 0.315 . . . . 0.0 110.401 177.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.416 ' HG3' HD11 ' A' ' 72' ' ' ILE . 21.4 ttpt -118.0 113.87 22.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.263 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -112.4 122.19 47.0 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.666 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 8.2 pt-20 -115.26 140.13 49.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.988 0.423 . . . . 0.0 110.904 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -127.8 126.18 41.22 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.153 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -87.23 126.06 34.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.862 177.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 41.1 pt -125.25 153.42 32.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.92 -175.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -147.82 155.12 41.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.798 0.333 . . . . 0.0 110.502 176.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.408 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 44.2 p90 -165.21 159.28 17.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.288 177.093 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -104.28 170.15 8.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.259 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.498 HG23 ' CH2' ' A' ' 28' ' ' TRP . 47.7 mm -114.91 90.89 24.27 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.936 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 11.0 Cg_endo -53.52 159.74 6.02 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.249 2.633 . . . . 0.0 112.89 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.1 mm -71.66 -18.5 19.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.509 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 m -88.52 9.31 24.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.05 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.503 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 47.7 t80 -81.37 146.05 56.9 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.31 -0.404 . . . . 0.0 109.914 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.503 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 10.9 Cg_endo -92.99 12.81 51.03 Favored 'Cis proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.48 -1.05 . . . . 0.0 112.696 -2.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.4 m -59.38 -28.83 67.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.389 0.614 . . . . 0.0 110.61 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 74.0 m -128.51 132.52 48.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.557 173.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.62 144.67 69.87 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.214 -178.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -85.82 173.98 6.81 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.826 2.351 . . . . 0.0 112.332 178.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.626 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 45.1 mt-10 -109.09 116.99 33.01 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.296 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.408 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.8 mt -76.24 132.43 33.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.457 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.718 ' HA ' ' HA3' ' A' ' 113' ' ' GLY . . . -107.15 128.88 54.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.926 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 10.6 t -122.83 86.06 50.12 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -63.13 -17.94 62.61 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.855 2.37 . . . . 0.0 112.829 -175.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -81.09 -27.54 35.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.96 0.41 . . . . 0.0 111.006 -178.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 72.9 mt -88.42 -17.82 29.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.978 0.418 . . . . 0.0 110.13 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -57.54 112.59 1.48 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.031 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 82.93 -11.84 52.05 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.092 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.632 ' HZ3' ' HB2' ' A' ' 105' ' ' LYS . 4.9 ttmp? -93.47 -44.51 8.21 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 120.802 0.334 . . . . 0.0 110.789 -177.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.713 ' HB ' ' HB2' ' A' ' 109' ' ' MET . 20.0 m -71.19 145.27 49.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.194 178.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -47.03 -50.89 18.6 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 123.559 0.537 . . . . 0.0 111.086 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -128.53 112.96 14.88 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.713 ' HB2' ' HB ' ' A' ' 106' ' ' THR . 15.1 tpt -143.29 141.97 31.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.231 -175.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -73.15 157.67 36.76 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -73.71 119.1 17.46 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.423 -172.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 82.1 -60.11 4.83 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.802 -178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . 0.718 ' HA3' ' HA ' ' A' ' 98' ' ' ALA . . . -178.23 -107.53 0.22 Allowed Glycine 0 N--CA 1.437 -1.257 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 176.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.626 ' HA ' ' HB3' ' A' ' 96' ' ' GLU . 7.4 mtpm? 49.03 39.55 15.1 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 122.782 0.433 . . . . 0.0 111.389 178.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.6 pt -72.15 135.51 27.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.295 0.569 . . . . 0.0 110.957 -177.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 2.8 p -108.58 153.2 23.71 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.004 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.418 ' HB2' ' CD1' ' A' ' 121' ' ' PHE . 64.7 mt -91.37 -171.39 2.93 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.008 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.7 t -61.1 145.68 50.07 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -58.41 -30.69 67.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.492 -173.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -54.77 -30.98 58.1 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.169 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.418 ' CD1' ' HB2' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -69.19 -33.04 72.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.469 -175.561 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.432 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 10.0 tmtt? -58.77 -57.08 29.49 Favored Pre-proline 0 CA--C 1.541 0.618 0 CA-C-O 119.714 -0.184 . . . . 0.0 111.393 -173.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.432 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 35.6 Cg_endo -66.95 -34.95 27.91 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 121.672 1.581 . . . . 0.0 111.982 175.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 43.9 tp -60.98 -37.91 84.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.927 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.479 ' CZ3' HD13 ' A' ' 137' ' ' LEU . 63.7 t-105 -61.21 -54.71 40.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.484 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.48 -33.27 74.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.303 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 31.6 mtt180 -63.7 -37.12 86.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.465 177.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -83.47 -61.24 1.89 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -175.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.456 HG12 ' HA ' ' A' ' 130' ' ' PRO . 94.6 t -47.49 132.93 10.35 Favored Pre-proline 0 N--CA 1.471 0.602 0 O-C-N 123.627 0.579 . . . . 0.0 111.407 -175.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.476 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 91.7 Cg_endo -77.61 -164.65 4.04 Favored 'Cis proline' 0 C--N 1.35 0.643 0 C-N-CA 124.259 -1.142 . . . . 0.0 114.298 7.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 30.8 mttm 73.66 -9.87 1.15 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.867 -178.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.496 ' HZ ' HD13 ' A' ' 140' ' ' LEU . 6.0 t80 -106.68 151.36 25.21 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.543 ' HA3' ' OE1' ' A' ' 35' ' ' GLU . . . -166.96 -158.18 11.13 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 119.629 -1.272 . . . . 0.0 113.759 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 48.6 tp -63.22 -44.93 93.89 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.746 0.646 . . . . 0.0 112.746 -169.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.04 87.51 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.944 0.878 . . . . 0.0 110.002 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -72.7 -32.48 65.79 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.533 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.479 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 65.8 tp -66.66 -48.74 68.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.308 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 20.3 ptm -65.34 -34.83 79.24 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 121.071 -0.252 . . . . 0.0 111.073 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.18 -45.66 72.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.708 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.496 HD13 ' HZ ' ' A' ' 132' ' ' PHE . 76.2 mt -91.0 -16.06 28.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.825 -174.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -110.43 -67.34 0.56 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.259 -176.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.5 tp -60.97 -46.11 92.03 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 -174.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.5 -62.18 6.47 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.061 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.61 -33.84 96.71 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.705 2.27 . . . . 0.0 112.962 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 18.7 t90 -57.66 -52.67 64.48 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.241 0.543 . . . . 0.0 109.772 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 88.9 mt -67.47 -36.13 80.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.892 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.21 -24.15 67.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.362 -174.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 57.7 t -104.23 -54.72 6.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.78 -0.368 . . . . 0.0 111.905 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -73.99 -34.08 64.07 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -170.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.478 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.0 mm -66.52 -49.77 50.21 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -176.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.478 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 79.1 Cg_exo -50.21 -39.52 52.09 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 122.225 1.95 . . . . 0.0 112.95 177.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -70.6 -42.27 71.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.71 0.291 . . . . 0.0 110.491 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 23.2 tp -59.51 -35.71 74.67 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.071 0.462 . . . . 0.0 110.438 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 150' ' ' ILE . 69.2 mt -70.34 -53.69 21.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.692 177.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -64.47 -26.65 68.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.854 -175.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -70.77 -14.32 62.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.721 -178.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 90.92 16.66 54.01 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.764 176.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 59.9 t -80.95 -62.74 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.944 0.402 . . . . 0.0 110.284 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 13.2 pt -100.66 100.25 10.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.356 0.598 . . . . 0.0 111.261 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -128.97 106.86 9.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.64 177.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 37.6 m170 -98.03 176.01 5.91 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.17 175.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -89.61 177.23 6.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.918 0.39 . . . . 0.0 111.503 -176.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -50.5 109.08 0.27 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.198 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.853 ' HE2' ' HA ' ' A' ' 164' ' ' LYS . 10.2 mmpt? -88.2 -28.48 21.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.046 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . 0.674 ' HB3' HD11 ' A' ' 75' ' ' LEU . 38.6 t -136.22 151.06 49.3 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.223 -178.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -72.91 159.26 33.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.643 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -80.56 49.44 1.17 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.531 0.681 . . . . 0.0 110.104 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 96.0 mt -132.24 162.29 31.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.792 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.81 172.43 13.02 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 121.168 -0.213 . . . . 0.0 110.684 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -155.02 97.24 1.92 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.948 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 38.7 t60 -80.75 105.1 11.72 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.833 0.349 . . . . 0.0 110.357 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 7.3 p80 -93.38 126.7 38.65 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 175.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -65.95 120.79 13.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.335 -175.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 61.9 t-80 -104.96 128.89 53.42 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 174.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 56.9 p-80 . . . . . 0 C--O 1.245 0.827 0 CA-C-O 118.09 -0.957 . . . . 0.0 110.343 178.451 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.099 0 CA-C-O 121.053 0.454 . . . . 0.0 110.661 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.98 118.46 31.86 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.516 174.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.485 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 5.5 m-20 -65.01 141.43 58.77 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.544 -177.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -61.25 -29.53 69.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.066 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.444 ' O ' HG22 ' A' ' 9' ' ' VAL . . . -58.64 -51.21 70.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.818 174.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.5 m -57.98 -44.17 86.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.424 177.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.485 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 51.3 mmm-85 -59.4 -48.17 82.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.952 -178.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.3 -46.16 77.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.065 -177.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.444 HG22 ' O ' ' A' ' 5' ' ' ALA . 79.5 t -59.45 -48.07 88.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.304 -178.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 92.5 t -66.74 -26.99 38.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.966 0.412 . . . . 0.0 110.803 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -77.26 -54.22 6.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.424 -177.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -80.56 0.49 33.68 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.976 0.417 . . . . 0.0 111.708 -173.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.64 HG12 ' HB2' ' A' ' 42' ' ' TYR . 60.9 mt -108.97 87.96 5.1 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 169.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.494 ' HG2' ' HG3' ' A' ' 41' ' ' ARG . 80.7 Cg_exo -48.48 140.46 21.31 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 123.978 3.119 . . . . 0.0 114.006 -170.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.489 ' HB ' ' HG2' ' A' ' 131' ' ' LYS . 35.6 m -73.43 163.4 4.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.942 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mp -106.94 154.8 20.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.092 -175.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HB2' ' NZ ' ' A' ' 17' ' ' LYS . 9.0 mtmp? -99.91 -47.27 5.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.905 177.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.514 HG23 HD13 ' A' ' 27' ' ' LEU . 72.7 m -82.97 116.59 22.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.424 -177.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.477 ' OD1' ' HG3' ' A' ' 91' ' ' PRO . 38.4 t-20 -148.16 99.06 3.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.08 -58.08 0.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.508 -174.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 151.68 170.16 18.11 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.961 176.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.73 -13.36 17.96 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 123.042 2.494 . . . . 0.0 112.294 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.438 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 1.7 mmp_? -65.76 -33.85 76.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.758 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -93.43 107.34 19.2 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.478 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 mmp_? -58.22 -43.41 87.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.876 -176.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.43 -45.2 66.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.846 0.355 . . . . 0.0 110.681 -174.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.514 HD13 HG23 ' A' ' 18' ' ' THR . 4.5 mm? -73.18 -23.56 60.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.774 178.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 51.7 t-105 -70.66 -45.66 64.7 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 25' ' ' ARG . 99.5 t -60.78 -38.66 79.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.094 0.473 . . . . 0.0 110.029 175.244 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.57 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 0.7 OUTLIER -61.33 -37.27 82.67 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.459 174.813 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.561 HH22 ' HA2' ' A' ' 133' ' ' GLY . 2.4 mtp180 -64.5 -37.4 87.41 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.119 177.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -56.7 -42.69 79.57 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 175.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -60.12 -47.84 84.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.468 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.57 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 11.0 mm-40 -59.57 -49.77 76.46 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.836 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -62.07 -44.73 96.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.802 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.421 ' O ' HG13 ' A' ' 40' ' ' ILE . 8.4 m-30 -57.67 -46.66 83.97 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.452 0.168 . . . . 0.0 111.308 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -58.56 -46.78 86.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 0.0 110.684 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.8 t -66.84 -44.42 81.08 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.468 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.429 ' O ' HG23 ' A' ' 43' ' ' VAL . 58.5 mt -60.52 -53.88 52.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.216 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 36' ' ' TYR . 79.9 mt -57.71 -39.8 72.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.48 0.181 . . . . 0.0 110.702 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.494 ' HG3' ' HG2' ' A' ' 14' ' ' PRO . 5.9 mmp_? -59.63 -56.88 16.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.911 176.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.64 ' HB2' HG12 ' A' ' 13' ' ' ILE . 36.4 t80 -57.44 -50.07 74.2 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.355 -179.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.485 HG12 ' HE2' ' A' ' 47' ' ' LYS . 91.1 t -63.56 -37.52 79.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.162 -176.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 40' ' ' ILE . 2.7 tp10 -63.22 -49.82 72.66 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.342 0.591 . . . . 0.0 109.99 179.193 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -59.29 -36.59 75.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.568 177.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.451 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 65.6 t30 -73.2 -40.06 65.05 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.411 -177.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.485 ' HE2' HG12 ' A' ' 43' ' ' VAL . 66.5 mttm -63.04 -46.38 87.83 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.802 -178.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -71.8 -14.71 62.06 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.853 -175.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -89.81 -2.82 58.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.825 0.345 . . . . 0.0 110.452 175.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.2 t0 60.78 40.25 16.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.277 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -122.99 17.83 10.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.923 0.868 . . . . 0.0 109.505 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.451 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 22.4 t70 -62.3 101.47 0.23 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.827 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.42 ' HB2' ' O ' ' A' ' 70' ' ' TRP . 15.9 p-90 -111.13 -40.98 4.3 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -167.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.507 ' H ' ' HD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -124.1 162.34 23.75 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 121.776 -0.577 . . . . 0.0 111.762 -174.235 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -156.28 129.03 7.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.848 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -112.61 144.14 42.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.252 0.549 . . . . 0.0 111.759 -173.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -109.25 162.99 13.77 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 173.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.1 m -153.19 155.4 36.59 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.808 0.337 . . . . 0.0 110.904 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -81.49 168.73 17.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 169.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -73.87 -6.5 47.56 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.805 -174.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -84.8 -25.58 28.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.98 0.419 . . . . 0.0 110.258 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.04 18.23 74.43 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.2 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.0 p -90.38 -4.35 57.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -176.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 64' ' ' ARG . 12.8 ttp180 -151.99 128.37 10.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.788 0.328 . . . . 0.0 110.17 172.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -111.54 126.56 55.11 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.36 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -137.25 138.04 39.68 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.212 -175.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -172.66 -155.94 12.0 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.676 -0.774 . . . . 0.0 112.051 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -138.66 153.61 48.58 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.771 0.319 . . . . 0.0 110.406 -178.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.8 p -128.19 123.97 35.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.841 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.588 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 17.0 m-90 -102.11 121.56 42.43 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 175.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.411 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 11.1 t80 -118.99 124.5 47.14 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.175 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 41.6 mm -97.9 114.8 36.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -177.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -146.57 118.42 8.15 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.403 177.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.6 t0 62.1 41.95 10.32 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.333 0.587 . . . . 0.0 110.828 175.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mm? 70.44 5.04 5.19 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.693 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.537 HD22 ' HB2' ' A' ' 164' ' ' LYS . 83.2 mt -88.48 106.12 18.06 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.998 0.427 . . . . 0.0 110.199 176.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -94.28 93.61 7.84 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.411 ' CE1' ' HB3' ' A' ' 71' ' ' TYR . 30.1 p90 -118.22 138.85 52.05 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.067 0.46 . . . . 0.0 111.087 -177.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.588 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 0.7 OUTLIER -115.21 141.87 47.43 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.74 179.734 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -123.85 136.95 54.69 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.174 174.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -85.48 110.91 19.52 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.411 ' HA ' HG21 ' A' ' 99' ' ' VAL . 32.0 pt -115.16 155.62 16.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.016 -172.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -166.08 159.64 15.61 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.593 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 52.3 p90 -159.39 147.73 17.71 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.55 178.242 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -98.98 159.45 14.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.307 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.7 mm -106.6 90.32 4.91 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.328 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.18 148.5 18.09 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 123.102 2.535 . . . . 0.0 112.591 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 38.8 mm -71.66 -14.31 17.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.559 0.695 . . . . 0.0 110.091 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 2.9 p -84.21 7.65 18.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.423 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.721 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 63.5 t80 -69.63 144.65 94.2 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.721 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 37.8 Cg_endo -92.7 3.01 60.17 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 124.186 -1.173 . . . . 0.0 114.133 1.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.9 m -58.02 -41.71 83.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.459 0.647 . . . . 0.0 110.09 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.5 m -103.93 120.92 42.04 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.206 172.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.61 145.07 95.61 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.479 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.439 ' HD2' HD23 ' A' ' 137' ' ' LEU . 25.7 Cg_exo -62.63 115.38 2.87 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.64 2.227 . . . . 0.0 111.221 175.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.559 ' CB ' ' HD2' ' A' ' 114' ' ' LYS . 30.6 mt-10 -74.44 117.33 16.13 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.83 -175.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.593 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.5 mt -66.6 127.76 28.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 175.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.98 -78.0 0.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.142 -170.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.411 HG21 ' HA ' ' A' ' 82' ' ' ILE . 8.1 t 51.69 75.79 0.61 Allowed Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.598 -175.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.88 -21.16 56.14 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 123.096 2.531 . . . . 0.0 112.798 -175.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -63.61 -28.49 69.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.368 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 97.8 mt -77.62 -22.53 50.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.288 -177.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -68.67 -16.38 63.81 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.557 0.694 . . . . 0.0 110.726 -178.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -108.5 10.37 35.74 Favored Glycine 0 C--N 1.316 -0.535 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.891 176.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -115.49 -68.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.679 0.276 . . . . 0.0 111.497 -177.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.43 ' C ' ' H ' ' A' ' 108' ' ' LYS . 8.9 t -77.72 -27.61 50.65 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.486 -173.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 71.7 -35.23 0.32 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.52 0.728 . . . . 0.0 111.751 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.43 ' H ' ' C ' ' A' ' 106' ' ' THR . 94.6 mttt -81.67 83.29 7.13 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 172.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.479 ' HE1' HG21 ' A' ' 115' ' ' ILE . 9.3 tpt -149.38 157.1 43.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.528 -1.215 . . . . 0.0 109.338 -167.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.526 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 41.7 m-85 -70.04 122.41 19.32 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 172.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 59.6 mtt180 -74.9 6.4 4.1 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.369 -167.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -103.43 7.96 51.6 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 172.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 89.54 51.31 2.93 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.117 -0.563 . . . . 0.0 112.018 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.559 ' HD2' ' CB ' ' A' ' 96' ' ' GLU . 38.6 mmtt -138.89 143.49 38.75 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -178.208 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.479 HG21 ' HE1' ' A' ' 109' ' ' MET . 39.4 pt -76.34 152.9 5.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.825 179.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 39.0 t -88.71 106.54 18.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.461 -179.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.9 mt -92.68 -175.49 3.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.7 t -84.36 155.52 22.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.716 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -73.53 -24.58 60.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.701 -178.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -82.64 -2.73 54.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.088 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -69.83 -40.94 75.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.023 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.426 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 31.6 mmtp -63.77 -53.7 48.0 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.792 -177.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 16.1 Cg_endo -59.46 -32.08 95.79 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 121.738 1.626 . . . . 0.0 112.419 176.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.6 tp -69.43 -47.97 62.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.993 0.425 . . . . 0.0 110.312 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -61.12 -51.88 67.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.878 -177.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.24 -28.97 70.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.459 -177.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -68.88 -38.73 79.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.089 0.471 . . . . 0.0 110.241 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -66.78 -54.97 17.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.71 -176.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 59.3 t -42.22 125.29 2.76 Favored Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 124.188 0.93 . . . . 0.0 111.983 -173.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.444 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 85.4 Cg_endo -81.92 -132.45 0.09 OUTLIER 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.079 -1.217 . . . . 0.0 113.027 4.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.489 ' HG2' ' HB ' ' A' ' 15' ' ' VAL . 7.1 ttmm 70.34 -45.0 0.58 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 176.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -74.12 155.82 38.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.949 0.405 . . . . 0.0 110.837 -177.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.561 ' HA2' HH22 ' A' ' 31' ' ' ARG . . . -144.97 174.17 25.15 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.435 -175.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.434 HD12 ' CE2' ' A' ' 84' ' ' PHE . 47.8 tp -69.59 -37.17 76.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.781 0.324 . . . . 0.0 110.913 -175.47 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.09 -37.88 64.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.429 0.633 . . . . 0.0 110.695 174.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -71.23 -32.73 69.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.419 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.439 HD23 ' HD2' ' A' ' 95' ' ' PRO . 61.7 tp -65.6 -48.91 70.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.197 -178.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 22.9 ptp -67.25 -34.78 78.17 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.992 -177.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -75.47 -53.47 8.61 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.91 -17.31 44.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.821 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -95.49 -71.59 1.11 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.434 -0.889 . . . . 0.0 112.897 -177.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.476 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 44.5 tp -67.6 -36.51 81.0 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -172.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.88 -62.22 6.31 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.093 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -65.53 -26.63 54.38 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.601 2.201 . . . . 0.0 112.6 177.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -65.47 -39.37 91.89 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.921 0.391 . . . . 0.0 110.651 -178.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 96.3 mt -59.03 -32.88 70.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.828 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.78 1.68 14.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.785 -177.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 61.4 t -101.18 -55.86 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.854 0.359 . . . . 0.0 111.187 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -84.57 -46.63 11.37 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -174.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.474 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 48.0 mm -58.69 -54.46 56.01 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -169.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 12.2 Cg_endo -54.93 -38.98 92.66 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 122.299 1.999 . . . . 0.0 113.202 -175.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.505 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 38.6 t70 -81.68 -34.29 30.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.725 0.298 . . . . 0.0 110.275 -178.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.421 ' HG ' ' HB ' ' A' ' 158' ' ' VAL . 20.2 tp -59.95 -39.15 84.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.032 0.444 . . . . 0.0 110.481 178.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . 0.444 HG13 ' O ' ' A' ' 150' ' ' ILE . 60.5 mt -64.37 -44.02 97.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.223 0.535 . . . . 0.0 110.06 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -68.32 -28.82 67.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.127 -177.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 30.7 mtpp -71.86 -9.51 58.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.729 0.299 . . . . 0.0 110.959 176.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.45 26.2 40.28 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.379 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . 0.421 ' HB ' ' HG ' ' A' ' 153' ' ' LEU . 40.8 t -94.69 -28.91 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 0.0 110.23 179.016 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 58.8 mt -107.48 141.93 21.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.707 178.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -64.77 161.58 17.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.015 -177.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 40.7 m80 -83.87 -14.38 51.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.652 -174.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.527 ' HB2' HD21 ' A' ' 76' ' ' LEU . 73.6 mmtt 48.46 31.49 2.85 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 171.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 59.82 54.01 4.54 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.784 0.802 . . . . 0.0 111.162 -179.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.537 ' HB2' HD22 ' A' ' 76' ' ' LEU . 28.2 tttp -65.28 -39.11 92.15 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.42 173.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 2.2 p -68.47 152.95 44.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.344 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -54.85 126.87 26.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.592 174.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -69.83 90.27 0.6 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.393 0.616 . . . . 0.0 111.67 -173.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 77.5 mt -121.72 93.14 3.91 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 170.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.75 -168.27 1.85 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.968 -171.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -60.8 138.05 58.15 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.553 176.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 63.0 m170 -65.53 -26.29 67.83 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.682 -172.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -84.07 87.06 7.13 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -61.55 -68.2 0.34 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.495 -171.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -162.89 130.4 3.67 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.288 -177.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 . . . . . 0 C--O 1.247 0.946 0 CA-C-O 118.657 -0.687 . . . . 0.0 109.693 173.721 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.6 ttp . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 120.948 0.404 . . . . 0.0 110.296 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.17 110.04 22.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.538 176.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -104.04 126.96 51.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.242 0.544 . . . . 0.0 111.681 -175.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -68.8 -32.27 71.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.844 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -70.8 -45.87 63.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.787 0.327 . . . . 0.0 110.495 -178.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.451 ' O ' HG23 ' A' ' 10' ' ' VAL . 89.7 m -55.82 -52.94 62.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.261 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -61.74 -32.53 72.77 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.864 0.364 . . . . 0.0 110.873 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -63.89 -41.23 97.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.649 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.2 t -78.61 -42.48 25.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.128 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 6' ' ' THR . 82.5 t -59.62 -36.96 68.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.592 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.1 m -64.42 -25.15 67.89 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.029 0.442 . . . . 0.0 111.022 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.55 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 37.7 mt-10 -91.99 -13.99 30.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.429 -177.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 52.4 mt -107.69 89.91 5.68 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.616 0.246 . . . . 0.0 110.752 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.55 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 38.9 Cg_exo -55.73 158.34 13.8 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.545 2.83 . . . . 0.0 113.373 -174.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.547 ' HB ' ' O ' ' A' ' 131' ' ' LYS . 28.4 m -100.24 170.98 1.42 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.181 -178.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.532 ' HG ' ' HB3' ' A' ' 34' ' ' GLU . 9.4 mp -91.58 -177.71 4.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.538 -178.194 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -137.04 6.75 2.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.705 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.548 HG22 HD11 ' A' ' 27' ' ' LEU . 27.0 m -154.21 96.33 1.93 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.869 0.366 . . . . 0.0 110.834 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -111.24 110.08 20.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.942 0.401 . . . . 0.0 110.901 -177.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.443 ' O ' ' HD3' ' A' ' 91' ' ' PRO . . . -143.91 -178.37 5.89 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.345 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.15 165.5 54.05 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.988 -175.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -69.3 -15.94 39.14 Favored 'Trans proline' 0 CA--C 1.529 0.259 0 C-N-CA 123.368 2.712 . . . . 0.0 112.526 178.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.0 mtp-105 -83.32 -14.01 53.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.185 0.517 . . . . 0.0 110.072 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -80.48 64.35 5.25 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 170.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.4 mtm-85 -54.23 -43.35 70.79 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.876 -167.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.411 ' HG3' HD23 ' A' ' 27' ' ' LEU . 7.4 pt-20 -60.13 -45.27 93.59 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.651 0.263 . . . . 0.0 111.614 -178.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.548 HD11 HG22 ' A' ' 18' ' ' THR . 4.1 mm? -81.94 -19.92 39.73 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.949 0.404 . . . . 0.0 110.978 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.435 ' HE3' HH21 ' A' ' 31' ' ' ARG . 62.3 t-105 -65.76 -39.81 91.43 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.772 177.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 88.0 t -61.3 -42.37 93.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.091 176.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.503 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 26.6 tt0 -67.09 -42.56 84.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.367 0.603 . . . . 0.0 110.187 176.053 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.452 ' HD3' ' O ' ' A' ' 18' ' ' THR . 15.9 ttp-105 -63.56 -32.69 74.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.07 -179.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -59.7 -47.33 86.07 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.344 178.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 10.3 ptmm? -65.52 -33.63 76.37 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.462 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.532 ' HB3' ' HG ' ' A' ' 16' ' ' LEU . 29.8 mm-40 -64.56 -48.98 73.0 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.837 0.351 . . . . 0.0 110.23 177.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -59.88 -44.47 94.18 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.461 ' O ' HG13 ' A' ' 40' ' ' ILE . 11.0 m-85 -59.38 -46.54 88.37 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.213 178.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -65.25 -37.79 88.32 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.468 0.173 . . . . 0.0 111.468 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.7 t -61.58 -43.39 98.95 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.746 -0.465 . . . . 0.0 109.746 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.472 ' O ' HG23 ' A' ' 43' ' ' VAL . 92.4 mt -64.84 -52.53 56.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.998 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.5 mt -55.84 -37.63 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.177 -177.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -57.27 -47.71 80.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.857 0.361 . . . . 0.0 110.96 177.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -68.62 -38.57 80.66 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.5 t -60.31 -43.27 93.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.865 178.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -57.42 -53.41 58.43 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 120.737 0.303 . . . . 0.0 110.437 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -54.22 -45.7 72.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.34 0.59 . . . . 0.0 111.07 176.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.556 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 26.3 t30 -71.62 -45.95 60.56 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.012 -0.994 . . . . 0.0 112.045 -170.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -72.9 -31.19 64.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.481 0.182 . . . . 0.0 111.297 -175.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -71.67 -26.99 62.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.904 0.383 . . . . 0.0 110.497 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -89.18 -5.23 57.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.882 0.372 . . . . 0.0 110.494 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 t70 67.44 16.26 9.97 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.438 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -91.96 8.79 35.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.718 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.556 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 24.5 t70 -51.44 110.87 0.5 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.006 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 67.7 p-90 -123.97 8.22 8.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.22 -170.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -158.02 143.55 16.94 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.063 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.417 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -125.44 124.37 41.28 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 173.889 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.492 HD21 ' HA3' ' A' ' 67' ' ' GLY . 65.5 mt -135.69 133.65 38.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.0 111.621 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -138.31 157.18 46.75 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 171.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.525 ' HB3' ' CE2' ' A' ' 65' ' ' TRP . 30.9 p -103.67 164.78 11.45 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 120.661 0.267 . . . . 0.0 110.41 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -79.88 -179.14 6.8 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 171.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -68.83 -21.05 64.32 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.818 -171.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -88.25 -21.81 24.29 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.795 0.331 . . . . 0.0 110.818 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.63 2.09 84.5 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.127 -0.558 . . . . 0.0 112.407 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.48 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . 20.8 p -90.45 -7.25 53.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.756 0.312 . . . . 0.0 111.493 -177.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -136.41 129.63 31.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.039 0.447 . . . . 0.0 110.891 173.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.525 ' CE2' ' HB3' ' A' ' 58' ' ' SER . 38.3 m95 -112.87 138.03 50.33 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.747 176.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -137.87 145.06 41.74 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.01 -178.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.492 ' HA3' HD21 ' A' ' 56' ' ' LEU . . . -177.8 -150.69 8.72 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.183 -1.008 . . . . 0.0 112.651 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -147.1 139.21 24.5 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -174.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 23.2 p -125.84 138.31 53.81 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 175.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 13.9 p90 -157.4 135.74 11.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.812 0.339 . . . . 0.0 110.378 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -145.76 151.42 37.94 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.1 mm -88.24 121.4 38.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.019 0.438 . . . . 0.0 110.759 -175.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -129.69 112.52 13.74 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.031 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.47 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 0.8 OUTLIER 59.11 38.36 23.84 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.546 0.528 . . . . 0.0 111.229 179.508 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.4 mm? 75.4 -6.95 1.87 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.238 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.8 mt -79.98 107.49 12.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.914 0.388 . . . . 0.0 110.018 177.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -89.73 108.34 19.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.823 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -130.99 151.22 51.64 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.686 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -134.58 150.61 50.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.335 -178.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -131.99 119.84 21.62 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.032 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.402 ' O ' ' HD2' ' A' ' 100' ' ' PRO . 68.9 m-20 -72.16 119.06 15.81 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 172.099 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.457 HG23 HG21 ' A' ' 99' ' ' VAL . 30.7 pt -118.06 143.52 28.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 121.12 0.486 . . . . 0.0 111.819 -172.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -135.14 166.39 23.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.442 172.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.54 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 49.1 p90 -166.18 145.24 5.88 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.023 173.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -103.18 152.66 21.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.159 0.504 . . . . 0.0 110.664 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.48 ' HB ' ' HA ' ' A' ' 63' ' ' THR . 49.1 mm -104.37 90.82 3.47 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.855 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -62.54 166.63 13.0 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.671 2.247 . . . . 0.0 112.319 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 34.1 mt -70.1 -9.94 13.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.66 0.743 . . . . 0.0 110.582 -178.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.8 p -86.43 -13.62 45.68 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.332 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.575 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 72.2 t80 -73.51 143.5 82.48 Favored Pre-proline 0 C--N 1.326 -0.42 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.575 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 10.9 Cg_endo -94.1 14.96 44.12 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 124.703 -0.957 . . . . 0.0 113.172 0.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.5 m -65.81 -30.34 70.95 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.583 0.706 . . . . 0.0 109.738 177.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.3 m -122.06 150.64 41.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.521 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.24 144.68 92.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.427 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -77.61 156.23 31.82 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.66 2.24 . . . . 0.0 111.872 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -93.06 109.82 21.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.097 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.54 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 52.9 mt -76.01 128.82 37.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 177.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.38 -62.72 1.25 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.991 -173.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.457 HG21 HG23 ' A' ' 82' ' ' ILE . 21.2 t 60.39 83.15 0.21 Allowed Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.151 -173.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.402 ' HD2' ' O ' ' A' ' 81' ' ' ASP . 27.5 Cg_endo -62.17 -20.93 71.56 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.015 2.477 . . . . 0.0 113.462 -173.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -71.79 -25.32 61.96 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.858 0.361 . . . . 0.0 111.19 -178.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 86.8 mt -97.3 16.41 20.07 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.246 -0.284 . . . . 0.0 110.895 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -59.89 92.62 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.476 -177.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 68.44 21.86 74.57 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.939 -0.573 . . . . 0.0 113.346 174.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -98.56 -45.69 6.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.94 0.37 . . . . 0.0 110.821 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.519 ' HG1' HD22 ' A' ' 153' ' ' LEU . 33.6 m -66.94 -51.35 56.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.502 0.668 . . . . 0.0 110.524 178.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -160.47 -164.08 1.19 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.822 -178.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -71.46 106.17 3.85 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 176.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 6.1 tpt -66.32 132.88 49.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.499 -174.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -90.2 145.49 24.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.091 -173.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.21 32.34 17.28 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.018 174.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 90.39 -55.11 3.53 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.868 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -170.03 52.94 0.2 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.363 -179.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -124.24 142.49 51.2 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.2 pt -80.48 159.15 4.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.917 0.389 . . . . 0.0 111.221 -177.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 20.8 p -99.94 118.81 37.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.501 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.4 mt -86.74 176.35 7.78 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.552 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.437 HG22 ' HB2' ' A' ' 121' ' ' PHE . 8.7 t -71.59 149.67 45.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.398 179.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -64.5 -38.33 90.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.362 -175.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -71.75 -9.35 58.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.457 -177.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.437 ' HB2' HG22 ' A' ' 118' ' ' THR . 70.6 t80 -69.72 -34.69 74.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.736 0.303 . . . . 0.0 111.036 -178.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.403 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 14.5 mmmm -61.94 -53.58 58.59 Favored Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -177.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.536 ' O ' ' HG3' ' A' ' 127' ' ' ARG . 19.7 Cg_endo -61.61 -37.09 71.95 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 121.701 1.601 . . . . 0.0 111.8 174.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 63.9 tp -57.2 -47.03 82.32 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.921 0.391 . . . . 0.0 110.589 178.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.543 ' O ' HG21 ' A' ' 129' ' ' VAL . 29.5 t-105 -60.29 -53.06 62.17 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.001 177.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -58.06 -38.87 77.12 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.319 -175.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 123' ' ' PRO . 98.1 mtt180 -63.24 -26.69 68.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.685 0.278 . . . . 0.0 111.581 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -108.85 21.71 16.87 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.121 0.486 . . . . 0.0 111.053 -174.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.543 HG21 ' O ' ' A' ' 125' ' ' TRP . 68.8 t -107.77 136.43 19.69 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.959 175.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.436 ' HA ' HG11 ' A' ' 129' ' ' VAL . 1.4 Cg_endo -86.35 -158.3 1.36 Allowed 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 124.193 -1.169 . . . . 0.0 112.948 0.188 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.547 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 55.5 mttp 75.77 -0.55 3.17 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.168 0.987 . . . . 0.0 111.956 -177.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.43 ' HZ ' HD11 ' A' ' 140' ' ' LEU . 4.3 t80 -72.53 163.95 27.2 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.158 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -151.67 165.38 30.54 Favored Glycine 0 C--O 1.236 0.265 0 C-N-CA 120.209 -0.996 . . . . 0.0 112.801 -174.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.422 HD23 HD13 ' A' ' 39' ' ' LEU . 48.2 tp -58.01 -46.74 84.76 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.52 0.728 . . . . 0.0 112.595 -172.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.46 -30.02 51.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.323 0.583 . . . . 0.0 111.8 -177.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -71.13 -31.23 67.47 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.566 -178.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 35.7 tp -58.79 -47.48 84.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.026 0.441 . . . . 0.0 110.815 178.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.449 ' HA ' ' HB3' ' A' ' 142' ' ' LEU . 1.3 mpt? -67.01 -39.35 87.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.903 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -69.86 -42.08 73.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.176 -177.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.43 HD11 ' HZ ' ' A' ' 132' ' ' PHE . 84.0 mt -95.01 -24.29 16.99 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -173.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -119.66 -63.69 0.27 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.098 -1.048 . . . . 0.0 113.755 -174.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.449 ' HB3' ' HA ' ' A' ' 138' ' ' MET . 1.4 tm? -57.99 -51.94 67.57 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -172.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.84 -61.17 7.75 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 121.312 -0.471 . . . . 0.0 113.134 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . 0.475 ' O ' HG22 ' A' ' 148' ' ' VAL . 77.3 Cg_exo -52.36 -36.58 69.31 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.884 2.389 . . . . 0.0 113.14 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -62.99 -49.0 76.42 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.788 0.328 . . . . 0.0 110.344 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 91.6 mt -60.1 -41.79 93.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.537 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.04 -8.61 46.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.316 -176.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.475 HG22 ' O ' ' A' ' 144' ' ' PRO . 94.7 t -106.44 -55.59 5.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.651 0.263 . . . . 0.0 111.362 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -79.84 -42.83 23.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.907 -170.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.558 ' O ' HG13 ' A' ' 154' ' ' ILE . 49.0 mm -59.66 -52.67 72.34 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -172.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.53 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 70.3 Cg_exo -53.45 -34.56 72.23 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.349 2.033 . . . . 0.0 113.488 -178.068 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.591 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 9.2 m-20 -86.26 -27.07 24.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.947 0.403 . . . . 0.0 110.875 178.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.642 ' HG ' ' HB ' ' A' ' 158' ' ' VAL . 15.7 tp -70.5 -26.79 63.76 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.146 0.498 . . . . 0.0 110.193 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . 0.558 HG13 ' O ' ' A' ' 150' ' ' ILE . 69.1 mt -66.05 -49.56 75.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.736 175.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 1.4 pp0? -69.92 -20.17 63.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.188 -176.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 67.6 mttm -77.11 -16.64 59.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.077 0.465 . . . . 0.0 110.269 174.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 90.45 17.15 53.72 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.851 177.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . 0.642 ' HB ' ' HG ' ' A' ' 153' ' ' LEU . 58.7 t -88.71 -40.46 13.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.797 0.332 . . . . 0.0 110.705 -178.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.559 HD11 HD23 ' A' ' 153' ' ' LEU . 48.1 mm -67.09 127.32 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.325 178.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -83.36 117.55 23.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.197 0.522 . . . . 0.0 111.956 -176.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -171.8 127.51 0.61 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 172.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.5 ' HB3' ' OE2' ' A' ' 163' ' ' GLU . 6.8 ttpm? -58.05 -46.16 85.83 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 123.296 0.373 . . . . 0.0 111.378 -173.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.5 ' OE2' ' HB3' ' A' ' 162' ' ' LYS . 2.7 mp0 -78.25 101.12 6.97 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.25 177.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.532 ' HB3' ' HZ3' ' A' ' 164' ' ' LYS . 10.0 mtpm? -104.06 -13.93 16.1 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.203 0.525 . . . . 0.0 109.674 174.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 79.5 m -124.15 159.0 31.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.236 173.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -68.58 149.77 48.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.827 0.346 . . . . 0.0 111.505 -175.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.437 ' HA ' ' OE1' ' A' ' 167' ' ' GLN . 5.5 tp60 -88.06 118.69 27.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.728 -178.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 45.9 tp -80.62 144.76 32.1 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.961 -177.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -79.88 120.46 24.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.108 0.48 . . . . 0.0 109.943 173.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -94.81 126.58 40.22 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.467 -173.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 75.5 t60 55.37 53.39 9.96 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 123.86 0.725 . . . . 0.0 111.093 173.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 22.3 t-160 -85.51 113.23 21.61 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.145 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -61.28 123.56 18.08 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.4 0.619 . . . . 0.0 110.741 -176.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -94.94 147.48 23.34 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.386 -174.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 33.4 p-80 . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.301 177.498 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -122.6 89.29 3.08 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.778 -178.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 52.09 79.46 0.11 Allowed 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.93 0.768 . . . . 0.0 112.531 176.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.9 mp0 -61.19 -35.37 76.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.656 177.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.447 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -64.91 -43.51 92.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.782 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.432 ' O ' HG21 ' A' ' 10' ' ' VAL . 25.7 m -64.13 -35.63 81.41 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.576 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -62.42 -39.88 94.74 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 120.855 0.359 . . . . 0.0 110.285 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.419 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 44.0 ttt85 -65.7 -38.17 88.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.686 178.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 5' ' ' ALA . 97.5 t -60.48 -41.03 86.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.937 0.399 . . . . 0.0 110.546 177.138 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.432 HG21 ' O ' ' A' ' 6' ' ' THR . 59.7 t -69.16 -27.17 33.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 121.099 0.476 . . . . 0.0 110.354 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.3 t -73.55 -32.47 64.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.231 177.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 8' ' ' ARG . 44.3 mt-10 -81.49 -28.26 34.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.877 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 51.0 mt -104.73 87.56 1.86 Allowed Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 174.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -50.18 141.71 30.22 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.884 3.056 . . . . 0.0 113.636 -169.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.4 m -69.33 149.53 10.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.369 177.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.542 HD22 HH22 ' A' ' 31' ' ' ARG . 6.4 mp -99.98 153.95 18.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.196 0.522 . . . . 0.0 111.571 -175.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.2 mttt -98.22 -49.67 4.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.619 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.429 ' HG1' ' NE2' ' A' ' 30' ' ' GLN . 7.4 m -75.17 108.05 7.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.606 -170.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -105.7 90.41 3.39 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -145.04 145.63 31.55 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.492 -177.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.1 167.49 41.75 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.149 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.28 -13.47 38.33 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 123.217 2.611 . . . . 0.0 113.088 -176.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -74.14 -24.6 59.44 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.801 0.334 . . . . 0.0 110.869 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -89.4 94.27 9.83 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 25' ' ' ARG . 43.3 mtm105 -60.11 -51.58 69.02 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -164.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -73.75 -29.94 62.51 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.496 -175.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -76.6 -26.52 55.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.904 0.383 . . . . 0.0 110.199 175.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.52 ' CH2' HG21 ' A' ' 86' ' ' ILE . 55.3 t-105 -64.2 -44.73 91.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.982 175.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.52 -41.35 81.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.353 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.683 ' HG3' ' HE3' ' A' ' 33' ' ' LYS . 53.5 tt0 -64.63 -44.0 91.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.308 177.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.542 HH22 HD22 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -54.52 -45.08 73.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.721 177.16 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.6 mp -62.88 -46.24 88.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.592 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.683 ' HE3' ' HG3' ' A' ' 30' ' ' GLN . 20.7 pttp -68.26 -38.88 82.23 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.904 -176.12 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 6.6 mm-40 -68.26 -45.13 74.0 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.712 0.292 . . . . 0.0 110.634 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.519 ' HA ' HD23 ' A' ' 16' ' ' LEU . 10.0 tp10 -61.91 -42.51 99.17 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.084 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -63.84 -30.55 71.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.49 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.678 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 81.8 mm-40 -62.32 -49.51 75.33 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 m -63.72 -38.15 90.04 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.897 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.456 ' O ' HG23 ' A' ' 43' ' ' VAL . 92.8 mt -61.22 -55.92 26.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 177.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 87.2 mt -62.27 -36.22 73.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.78 -178.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -55.24 -47.17 75.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.991 175.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.514 ' CD2' ' HE2' ' A' ' 138' ' ' MET . 11.1 t80 -72.45 -41.03 66.56 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.354 -179.043 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.6 t -59.54 -39.05 78.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 120.736 0.303 . . . . 0.0 110.804 178.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -55.14 -54.83 38.31 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.4 -46.6 83.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.31 178.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -56.07 -51.41 67.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.623 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -63.16 -32.57 73.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.627 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -65.34 -36.73 84.9 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.006 0.431 . . . . 0.0 110.59 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -85.68 2.42 45.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.802 178.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.1 t70 64.51 23.02 12.83 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.844 0.831 . . . . 0.0 110.866 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -114.08 76.62 1.0 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.502 177.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -72.91 104.7 4.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.277 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.488 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -75.53 -61.22 1.99 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.458 -168.645 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.488 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 3.3 p90 -162.48 172.34 15.65 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.794 -173.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.503 ' NH2' ' HH2' ' A' ' 70' ' ' TRP . 4.5 ptp180 -141.79 133.32 26.82 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.5 tp -121.23 123.48 42.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.164 0.507 . . . . 0.0 110.545 -173.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -109.23 164.42 12.47 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.658 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.9 m -141.93 156.2 45.49 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 179.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -74.57 162.93 28.3 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 168.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -70.63 -4.8 25.16 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -171.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -98.57 -16.13 19.24 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.142 0.496 . . . . 0.0 110.471 173.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.69 15.61 75.75 Favored Glycine 0 CA--C 1.52 0.392 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.597 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.3 p -86.33 -3.37 58.97 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -158.76 120.31 3.44 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -105.22 145.59 30.43 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -178.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -153.34 158.92 42.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.457 -176.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 166.83 -150.53 17.61 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.564 -0.826 . . . . 0.0 112.078 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.561 ' HD3' ' HB2' ' A' ' 79' ' ' GLU . 38.9 ttmt -133.21 140.95 47.82 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 -178.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.5 t -134.56 138.12 44.34 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.759 ' HB3' ' HA ' ' A' ' 79' ' ' GLU . 22.5 p90 -148.12 159.4 43.97 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.225 -0.59 . . . . 0.0 111.06 178.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.416 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 64.3 t80 -124.34 129.47 50.77 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.877 -176.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 49.9 mm -100.01 118.56 46.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 179.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.428 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 82.4 t60 -146.5 119.1 8.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.07 -0.513 . . . . 0.0 109.646 -178.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.463 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 0.9 OUTLIER 63.84 31.93 13.72 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.418 0.449 . . . . 0.0 110.151 -175.687 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.2 mm? 71.84 -3.75 2.11 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.43 -176.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.565 HD22 ' HE2' ' A' ' 164' ' ' LYS . 93.1 mt -65.12 123.75 20.34 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.726 0.298 . . . . 0.0 110.417 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -114.01 108.38 16.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.296 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.484 ' CE1' HG21 ' A' ' 150' ' ' ILE . 0.5 OUTLIER -129.94 109.83 11.19 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.22 177.368 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.759 ' HA ' ' HB3' ' A' ' 70' ' ' TRP . 11.4 pt-20 -96.64 143.71 27.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.091 -176.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -132.96 136.68 46.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.041 177.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -82.19 127.61 33.33 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 176.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 48.0 pt -126.52 158.38 36.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.121 0.486 . . . . 0.0 111.284 -175.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -159.26 170.16 22.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.793 174.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.537 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 39.4 p90 -167.93 146.59 4.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.118 0.485 . . . . 0.0 110.411 173.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -89.76 167.11 13.13 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.342 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.52 HG21 ' CH2' ' A' ' 28' ' ' TRP . 47.2 mm -114.36 89.46 17.87 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.572 -177.091 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -63.2 163.46 22.97 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.802 2.335 . . . . 0.0 111.925 175.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.425 HD12 ' N ' ' A' ' 88' ' ' ILE . 2.0 mp -62.31 -23.79 33.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-O 121.145 0.498 . . . . 0.0 110.938 -178.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.535 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 1.3 p -72.79 -12.75 61.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -178.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -73.02 141.0 81.02 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -97.55 8.63 36.05 Favored 'Cis proline' 0 N--CA 1.458 -0.564 0 C-N-CA 124.437 -1.068 . . . . 0.0 112.895 -0.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 25.2 m -60.6 -32.92 72.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.409 0.623 . . . . 0.0 110.429 -178.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.535 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 29.6 m -126.3 132.58 51.61 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 172.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.3 144.74 97.43 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.693 0.282 . . . . 0.0 111.509 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -82.51 158.35 16.81 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.693 2.262 . . . . 0.0 112.24 177.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -83.31 115.83 22.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.223 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.537 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 5.0 mp -73.9 131.38 35.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.294 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.431 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -100.72 123.0 44.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.933 0.396 . . . . 0.0 110.904 -179.022 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.0 t -129.33 87.09 54.56 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.37 178.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.75 -19.37 45.94 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 123.273 2.648 . . . . 0.0 113.917 -173.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.462 ' O ' ' HD3' ' A' ' 105' ' ' LYS . 7.8 tp10 -84.53 3.86 34.6 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.971 0.415 . . . . 0.0 110.985 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.7 mt -123.38 22.01 9.37 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 122.161 -0.337 . . . . 0.0 111.005 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -69.29 89.32 0.47 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.113 0.483 . . . . 0.0 111.146 -177.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 60.49 25.44 63.05 Favored Glycine 0 CA--C 1.52 0.358 0 CA-C-N 115.395 -0.821 . . . . 0.0 113.915 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 101' ' ' GLU . 19.8 ptmt -116.08 13.41 15.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.178 0.489 . . . . 0.0 111.835 -177.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.2 t -123.12 -16.92 6.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.095 0.474 . . . . 0.0 110.118 172.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -170.7 -168.13 0.65 Allowed 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -177.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -65.1 -39.86 93.73 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.488 ' HE3' HG23 ' A' ' 115' ' ' ILE . 8.3 tpt 65.63 98.69 0.04 OUTLIER 'General case' 0 N--CA 1.461 0.12 0 O-C-N 124.079 0.862 . . . . 0.0 110.946 175.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -78.77 4.94 12.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.958 -175.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.442 ' HG3' ' SG ' ' A' ' 116' ' ' CYS . 30.5 mmt180 -120.01 -81.5 0.63 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.828 0.347 . . . . 0.0 110.186 175.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 153.63 -111.09 0.47 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.875 -0.678 . . . . 0.0 111.773 178.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -80.19 -11.95 83.77 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.859 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 98' ' ' ALA . 17.5 ptpt -105.06 140.32 38.41 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 178.11 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.488 HG23 ' HE3' ' A' ' 109' ' ' MET . 2.8 pp -101.03 161.58 3.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.516 -179.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.442 ' SG ' ' HG3' ' A' ' 111' ' ' ARG . 73.3 m -138.47 161.93 35.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.019 178.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.4 mt -103.75 167.74 9.59 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.795 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.0 t -57.81 156.52 8.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.143 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -50.8 -36.33 36.6 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.282 -178.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.43 ' O ' ' HD2' ' A' ' 123' ' ' PRO . 19.4 m170 -67.06 -21.58 65.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.591 -172.046 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -68.65 -36.55 78.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.217 -178.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.565 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 26.8 ttpp -60.97 -49.52 88.74 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -174.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.565 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 20.7 Cg_exo -66.82 -39.41 14.86 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 121.662 1.575 . . . . 0.0 112.19 174.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 51.4 tp -59.69 -49.28 78.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.129 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.402 ' O ' HG21 ' A' ' 129' ' ' VAL . 58.9 t-105 -57.62 -52.21 66.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.908 -176.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.09 -13.29 62.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.597 -176.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -91.82 -26.73 18.38 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.944 0.402 . . . . 0.0 110.376 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -85.35 -44.46 12.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.209 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.491 HG13 ' HA ' ' A' ' 130' ' ' PRO . 91.9 t -51.97 138.9 34.07 Favored Pre-proline 0 N--CA 1.471 0.577 0 O-C-N 123.704 0.627 . . . . 0.0 111.093 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.491 ' HA ' HG13 ' A' ' 129' ' ' VAL . 4.7 Cg_exo -81.48 -152.38 0.78 Allowed 'Cis proline' 0 C--N 1.353 0.814 0 C-N-CA 124.574 -1.011 . . . . 0.0 113.118 3.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm 76.02 -20.67 0.35 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.657 0.783 . . . . 0.0 111.322 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.418 ' H ' ' C ' ' A' ' 130' ' ' PRO . 0.1 OUTLIER -81.8 -179.28 7.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.74 0.305 . . . . 0.0 110.546 179.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -179.86 -179.57 48.79 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.14 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 55.5 tp -66.75 -37.21 84.19 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 122.625 0.37 . . . . 0.0 111.204 -176.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.31 -38.8 77.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.406 0.622 . . . . 0.0 110.404 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -71.67 -32.45 67.89 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.009 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 57.5 tp -66.55 -45.57 78.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.454 -179.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.514 ' HE2' ' CD2' ' A' ' 42' ' ' TYR . 0.0 OUTLIER -70.0 -35.94 74.77 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.119 -177.397 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -76.63 -50.47 13.69 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 86.9 mt -89.58 -14.06 35.89 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -173.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -108.16 -63.42 0.56 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.632 -179.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.493 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 60.9 tp -67.59 -40.83 84.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.471 0.177 . . . . 0.0 111.462 -175.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.08 -61.48 6.52 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.24 -0.505 . . . . 0.0 113.259 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . 0.43 ' O ' HG23 ' A' ' 148' ' ' VAL . 45.0 Cg_exo -59.17 -33.76 98.3 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.58 2.186 . . . . 0.0 112.568 177.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -62.7 -41.74 99.29 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.036 0.446 . . . . 0.0 110.424 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 97.9 mt -59.72 -36.14 75.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.628 177.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.79 -9.7 58.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.556 -178.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 144' ' ' PRO . 60.4 t -91.82 -56.04 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.668 0.271 . . . . 0.0 111.135 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -89.63 -41.59 11.88 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -172.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.555 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.9 mm -56.2 -52.86 69.53 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -172.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.555 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 51.0 Cg_exo -55.44 -40.87 83.13 Favored 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.04 1.827 . . . . 0.0 112.356 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -68.79 -39.99 79.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.234 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.558 HD12 ' HD2' ' A' ' 156' ' ' LYS . 21.7 tp -64.41 -28.93 70.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.983 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . 0.55 HG13 ' O ' ' A' ' 150' ' ' ILE . 78.8 mt -63.92 -53.28 46.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.571 177.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -69.64 -14.43 62.81 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.175 0.512 . . . . 0.0 110.22 -178.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . 0.558 ' HD2' HD12 ' A' ' 153' ' ' LEU . 28.1 ttmt -69.03 -13.55 62.51 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.769 -178.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 91.6 -16.7 58.54 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.275 173.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.9 p -73.45 -31.58 33.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.701 0.286 . . . . 0.0 110.932 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.541 HD11 HD23 ' A' ' 153' ' ' LEU . 57.4 mt -88.39 120.81 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.496 178.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -77.76 96.33 4.88 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 175.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -57.31 113.04 1.58 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.421 -174.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 64.0 mmtt -87.3 179.1 6.67 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.613 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 60.42 16.25 6.18 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 165.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.565 ' HE2' HD22 ' A' ' 76' ' ' LEU . 69.8 mmtt -84.69 -14.64 47.85 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.324 175.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 73.6 m 61.85 86.2 0.11 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.418 175.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -98.64 144.97 27.33 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 172.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -80.66 85.56 6.02 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.124 0.488 . . . . 0.0 111.902 -174.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 6.5 mp -109.62 92.62 4.12 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 168.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -81.3 77.06 8.22 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.833 0.825 . . . . 0.0 110.428 -174.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -85.95 94.18 9.13 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 172.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 15.5 t60 -53.16 124.92 15.78 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.653 0.595 . . . . 0.0 111.237 -172.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -75.41 90.13 2.67 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.412 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -80.91 157.21 25.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.452 -176.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -61.27 130.69 47.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.757 178.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 29.2 t-80 . . . . . 0 C--O 1.245 0.816 0 CA-C-O 118.793 -0.622 . . . . 0.0 109.733 178.434 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.03 94.18 6.13 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.962 0.41 . . . . 0.0 109.915 176.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.504 ' HB2' ' OG1' ' A' ' 6' ' ' THR . 3.1 m-20 -67.88 139.99 56.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.302 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -60.04 -36.53 77.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.737 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.418 ' O ' HG22 ' A' ' 9' ' ' VAL . . . -65.44 -47.17 77.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.354 176.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.504 ' OG1' ' HB2' ' A' ' 3' ' ' ASP . 22.2 m -57.78 -54.74 43.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.355 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -62.53 -36.41 82.5 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.496 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.2 tpm_? -61.34 -44.5 97.08 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.794 0.331 . . . . 0.0 110.435 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.464 ' O ' HG13 ' A' ' 13' ' ' ILE . 92.0 t -67.5 -46.58 82.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.818 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.47 HG22 ' O ' ' A' ' 6' ' ' THR . 88.7 t -58.01 -45.28 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.885 -177.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.2 m -65.7 -19.37 65.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -103.59 13.22 33.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.655 0.264 . . . . 0.0 111.266 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 9' ' ' VAL . 52.1 mt -122.4 89.53 49.3 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.04 161.06 5.34 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.549 2.833 . . . . 0.0 113.723 -175.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.443 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 35.6 m -97.56 179.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.983 -179.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.97 HD22 ' HB3' ' A' ' 35' ' ' GLU . 7.1 mp -108.1 154.08 22.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.271 -176.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HG2' ' OE1' ' A' ' 34' ' ' GLU . 36.1 mmtm -78.85 -66.47 0.86 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.536 0.684 . . . . 0.0 109.176 171.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.4 m -75.68 126.64 31.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.686 -176.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -120.77 81.82 1.82 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.415 0.626 . . . . 0.0 109.887 171.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -125.83 -173.38 2.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.895 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -127.27 -177.19 14.75 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.204 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.453 ' HD2' ' O ' ' A' ' 88' ' ' ILE . 39.3 Cg_exo -61.94 -5.4 6.11 Favored 'Trans proline' 0 CA--C 1.533 0.45 0 C-N-CA 123.265 2.644 . . . . 0.0 113.254 -179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.3 mtm105 -67.22 -41.64 85.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.305 0.574 . . . . 0.0 110.015 175.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.524 ' HB3' HD22 ' A' ' 27' ' ' LEU . 5.6 m-20 -92.44 95.11 9.46 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.102 177.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -58.69 -47.17 85.44 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -170.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -72.33 -38.69 68.57 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.085 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 24' ' ' ASP . 3.6 mm? -68.58 -29.19 67.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.003 0.43 . . . . 0.0 110.252 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.492 ' O ' HD22 ' A' ' 32' ' ' LEU . 63.3 t-105 -62.24 -47.69 83.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.978 175.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 50.7 t -57.26 -35.1 47.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.644 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.2 -39.01 75.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.911 176.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.683 ' NH2' ' HG3' ' A' ' 91' ' ' PRO . 27.5 ttt-85 -64.26 -39.78 94.65 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.054 -0.351 . . . . 0.0 110.054 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.492 HD22 ' O ' ' A' ' 28' ' ' TRP . 4.0 mm? -52.72 -58.48 6.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.002 177.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -61.7 -35.48 78.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 121.248 -0.181 . . . . 0.0 111.105 -177.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.549 ' OE1' ' HG2' ' A' ' 17' ' ' LYS . 46.0 mm-40 -62.34 -54.63 37.68 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.484 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.97 ' HB3' HD22 ' A' ' 16' ' ' LEU . 15.5 pt-20 -77.57 -27.08 51.33 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.515 -177.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.551 ' O ' HG13 ' A' ' 40' ' ' ILE . 2.0 m-85 -55.06 -45.0 75.26 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 169.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -59.98 -41.58 92.31 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.86 0.362 . . . . 0.0 110.598 176.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.3 t -60.81 -43.7 97.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.938 176.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.464 ' O ' HG23 ' A' ' 43' ' ' VAL . 79.2 mt -61.35 -49.97 74.81 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.878 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.0 mt -53.1 -43.36 48.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.58 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.87 -44.26 97.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.682 0.277 . . . . 0.0 110.49 -179.297 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -66.8 -41.3 87.79 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.854 0.359 . . . . 0.0 110.204 177.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.5 HG12 ' HE2' ' A' ' 47' ' ' LYS . 80.4 t -59.92 -42.93 91.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.731 178.385 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 44.0 mt-10 -55.83 -54.08 48.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.506 177.213 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -61.13 -50.26 73.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.662 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.657 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 10.5 t30 -72.39 -32.46 66.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.285 -169.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.5 ' HE2' HG12 ' A' ' 43' ' ' VAL . 42.8 mtmt -71.33 -45.53 62.78 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.845 176.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -69.61 -18.73 63.63 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.236 0.541 . . . . 0.0 110.226 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.13 -2.3 47.88 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.806 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.5 t70 59.62 37.7 22.39 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.842 0.829 . . . . 0.0 109.329 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -133.44 29.29 3.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.135 -173.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.657 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 9.6 p-10 -69.16 105.34 2.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.691 0.758 . . . . 0.0 110.012 178.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 43.5 p-90 -108.94 10.43 26.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.309 -170.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 37.2 p90 -158.05 156.93 31.94 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.651 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.421 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 21.6 mmm180 -130.08 123.77 31.23 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.99 -1.004 . . . . 0.0 108.934 171.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 52.0 mt -123.56 124.62 43.22 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.149 0.5 . . . . 0.0 110.63 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -116.6 150.17 38.48 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.3 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.4 m -106.77 147.63 29.43 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.059 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -77.78 172.33 13.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 172.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -62.06 -23.45 66.5 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -175.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -91.99 -20.68 21.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.694 -177.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.66 16.9 80.01 Favored Glycine 0 C--O 1.228 -0.223 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.588 -175.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.0 p -98.79 -16.72 18.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.969 0.414 . . . . 0.0 111.367 -176.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -136.99 125.85 24.12 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.497 179.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 34.1 m95 -109.42 137.65 46.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.1 p90 -145.08 160.26 41.68 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.463 -176.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.421 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 162.75 -159.33 31.68 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.33 -0.938 . . . . 0.0 112.51 178.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -121.23 146.83 46.4 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.898 0.38 . . . . 0.0 110.972 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 51.1 t -112.34 123.96 51.42 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 168.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.439 ' HD1' ' HG2' ' A' ' 79' ' ' GLU . 6.9 m0 -106.02 122.07 45.41 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.788 -177.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -118.74 118.66 32.22 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 176.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 30.8 mm -99.88 119.95 48.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -127.62 115.34 18.62 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.04 -176.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.479 ' C ' HD22 ' A' ' 75' ' ' LEU . 39.7 m-20 67.65 -85.8 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 124.027 0.829 . . . . 0.0 110.432 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.479 HD22 ' C ' ' A' ' 74' ' ' ASP . 3.0 mm? -137.04 0.63 2.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.882 0.372 . . . . 0.0 110.108 178.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.541 ' CD2' ' HA ' ' A' ' 164' ' ' LYS . 61.8 mt -108.69 149.61 28.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.335 -170.474 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -110.19 119.64 39.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.784 179.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -110.06 115.13 29.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.439 ' HG2' ' HD1' ' A' ' 70' ' ' TRP . 30.5 mt-10 -100.63 136.56 40.32 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.635 -175.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -128.93 116.76 19.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.814 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.73 131.83 36.74 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 176.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.449 HG22 HG22 ' A' ' 99' ' ' VAL . 23.3 pt -126.21 147.9 30.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.909 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -155.09 141.6 18.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.761 178.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.569 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 44.7 p90 -156.25 147.29 22.18 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.362 0.601 . . . . 0.0 111.652 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.519 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 5.2 p-10 -92.26 156.29 17.39 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.433 178.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.7 mm -104.88 90.87 3.83 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.403 179.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.519 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 71.5 Cg_exo -48.53 148.78 7.7 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.3 2.667 . . . . 0.0 113.189 -178.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.453 ' O ' ' HD2' ' A' ' 22' ' ' PRO . 50.3 mm -58.43 -27.54 33.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.1 -178.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.738 HG21 ' HB ' ' A' ' 92' ' ' THR . 4.1 m -93.52 17.58 11.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.964 0.411 . . . . 0.0 111.588 -178.173 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.48 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 87.4 t80 -68.56 138.24 91.07 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 174.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.683 ' HG3' ' NH2' ' A' ' 31' ' ' ARG . 35.7 Cg_endo -97.83 12.35 33.59 Favored 'Cis proline' 0 C--N 1.346 0.446 0 C-N-CA 124.377 -1.093 . . . . 0.0 113.096 -1.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.738 ' HB ' HG21 ' A' ' 89' ' ' THR . 24.3 m -56.38 -35.82 68.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.401 0.619 . . . . 0.0 109.805 177.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 52.5 m -117.86 125.31 50.27 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.368 -0.833 . . . . 0.0 108.761 171.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.76 144.75 97.67 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-O 120.779 0.323 . . . . 0.0 111.528 -174.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -71.52 124.91 10.72 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.777 2.318 . . . . 0.0 111.8 177.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.686 ' HB3' ' HD2' ' A' ' 114' ' ' LYS . 36.9 mt-10 -75.94 103.42 6.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.792 178.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.569 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 58.3 mt -70.01 136.36 26.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.626 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -112.96 130.1 56.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.686 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.449 HG22 HG22 ' A' ' 82' ' ' ILE . 36.3 t -121.56 88.18 46.3 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.944 179.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -55.6 -29.53 70.54 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.999 2.466 . . . . 0.0 113.308 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -66.73 -36.25 82.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.777 0.322 . . . . 0.0 111.315 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 85.3 mt -90.96 1.06 57.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.972 0.415 . . . . 0.0 111.059 -177.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -65.24 109.58 2.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.821 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 98.58 -27.57 18.98 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.363 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -80.67 -12.41 59.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.888 0.375 . . . . 0.0 111.71 -175.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 t -137.81 148.2 45.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.923 0.392 . . . . 0.0 110.427 177.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -84.82 174.45 9.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.731 176.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.417 ' HG2' ' O ' ' A' ' 108' ' ' LYS . 37.0 ttmt 66.87 12.13 8.73 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.57 0.7 . . . . 0.0 110.282 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.486 ' HE2' HG23 ' A' ' 115' ' ' ILE . 13.0 tpt -94.28 27.17 3.0 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.677 -173.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.672 ' O ' ' HG3' ' A' ' 111' ' ' ARG . 88.2 m-85 50.4 58.66 5.26 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.856 -177.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.672 ' HG3' ' O ' ' A' ' 110' ' ' TYR . 0.0 OUTLIER 50.32 16.02 0.24 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.372 1.069 . . . . 0.0 112.874 -176.601 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.48 123.21 5.16 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.974 -0.632 . . . . 0.0 112.741 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 129.09 -80.14 0.36 Allowed Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.437 175.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.686 ' HD2' ' HB3' ' A' ' 96' ' ' GLU . 71.3 mmtt -85.68 137.99 32.44 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.598 0.237 . . . . 0.0 110.625 -176.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.486 HG23 ' HE2' ' A' ' 109' ' ' MET . 46.7 pt -76.83 157.61 5.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.428 0.633 . . . . 0.0 111.918 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 49.5 t -125.29 113.53 17.73 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.1 173.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 88.3 mt -81.9 -82.2 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.984 -176.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.6 t -163.39 154.42 16.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.368 -177.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -62.54 -30.03 71.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.504 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.6 t60 -73.4 -20.05 60.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.215 -175.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -68.54 -40.01 80.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.892 -174.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -61.35 -55.05 47.09 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -174.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.11 -32.77 83.35 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.702 1.601 . . . . 0.0 112.164 175.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.53 -43.51 76.58 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.892 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.525 ' O ' HG21 ' A' ' 129' ' ' VAL . 70.0 t-105 -61.56 -57.48 11.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.53 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.36 -30.06 68.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.929 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -77.7 -23.04 49.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.814 0.34 . . . . 0.0 111.529 -177.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -106.0 10.29 32.29 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.525 HG21 ' O ' ' A' ' 125' ' ' TRP . 97.6 t -87.63 139.68 31.5 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.507 ' HA ' HG11 ' A' ' 129' ' ' VAL . 64.8 Cg_endo -95.6 -146.19 0.16 OUTLIER 'Cis proline' 0 C--N 1.353 0.77 0 C-N-CA 124.972 -0.845 . . . . 0.0 113.781 5.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.479 ' H ' ' HB2' ' A' ' 130' ' ' PRO . 49.3 mtmt 75.07 11.06 3.63 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.698 -176.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -91.64 144.61 25.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.985 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -146.57 167.42 28.09 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 178.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 43.6 tp -55.24 -33.13 62.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.143 0.471 . . . . 0.0 111.692 -177.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.87 -47.27 77.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.987 0.422 . . . . 0.0 111.43 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -71.29 -38.45 71.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.463 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.4 HD12 ' CZ3' ' A' ' 125' ' ' TRP . 67.2 tp -65.33 -44.57 87.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.43 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 15.8 tpt -66.56 -47.97 71.12 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.927 0.394 . . . . 0.0 110.916 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.2 -44.8 64.7 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.131 -175.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.8 mt -94.74 -0.24 54.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.796 0.331 . . . . 0.0 111.665 -174.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -113.24 -75.12 0.69 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.282 -0.961 . . . . 0.0 112.722 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.44 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 9.8 tt -67.49 -36.56 81.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.676 0.274 . . . . 0.0 110.832 -175.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.67 -61.85 6.86 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.177 -0.535 . . . . 0.0 113.274 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . 0.436 ' O ' HG21 ' A' ' 148' ' ' VAL . 32.9 Cg_exo -60.14 -33.04 95.32 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.549 2.166 . . . . 0.0 112.53 177.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 60.3 t90 -60.08 -39.55 86.48 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.903 0.383 . . . . 0.0 110.747 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 95.2 mt -58.04 -41.81 84.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.751 178.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.57 -15.06 63.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.819 -176.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.436 HG21 ' O ' ' A' ' 144' ' ' PRO . 56.3 t -88.06 -42.49 14.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.469 -177.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -104.02 -44.38 5.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -173.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.54 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.3 mm -55.99 -52.74 70.17 Favored Pre-proline 0 CA--C 1.54 0.562 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -170.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.54 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 51.8 Cg_exo -56.46 -31.62 86.47 Favored 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 122.01 1.807 . . . . 0.0 112.929 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -86.96 -26.72 23.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.833 0.349 . . . . 0.0 110.731 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.492 HD22 HD12 ' A' ' 159' ' ' ILE . 24.8 tp -70.21 -40.52 74.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.998 178.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 73.6 mt -63.19 -44.51 99.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.229 176.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.452 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . 6.3 tp60 -69.44 -22.94 63.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.06 -177.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -83.19 -2.21 54.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.169 0.509 . . . . 0.0 110.303 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 72.05 24.18 76.88 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 115.817 -0.629 . . . . 0.0 113.025 175.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 40.2 t -84.53 -31.34 7.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.216 0.531 . . . . 0.0 110.722 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.492 HD12 HD22 ' A' ' 153' ' ' LEU . 53.8 mt -94.83 125.79 47.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.53 -179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -64.79 143.23 58.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.301 176.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -89.5 104.84 17.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.107 0.48 . . . . 0.0 109.905 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.88 159.74 16.03 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.756 -178.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 60.82 33.22 20.09 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 123.813 0.696 . . . . 0.0 111.551 -177.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.541 ' HA ' ' CD2' ' A' ' 76' ' ' LEU . 34.5 mtmm -62.03 -55.93 24.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.932 0.396 . . . . 0.0 110.421 -179.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 67.7 m -95.84 85.94 4.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.129 0.49 . . . . 0.0 109.982 176.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -98.85 -48.29 4.97 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.866 -178.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.424 ' HA ' ' OE1' ' A' ' 167' ' ' GLN . 5.9 tp60 -136.83 135.62 38.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.39 -174.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 58.6 tp -74.78 -37.56 62.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.605 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -89.71 125.17 35.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.67 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -113.64 -2.83 13.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.986 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -72.93 104.33 4.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.079 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -153.83 154.82 34.64 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.101 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -137.05 135.45 37.55 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.264 -177.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 12.0 p-80 -115.59 163.49 15.7 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 177.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 . . . . . 0 C--O 1.242 0.7 0 CA-C-O 118.516 -0.754 . . . . 0.0 109.658 176.903 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.08 131.62 21.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.584 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -80.42 -15.43 56.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.201 0.524 . . . . 0.0 110.393 178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -60.6 -46.39 90.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.71 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.441 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -56.81 -47.38 80.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.395 -179.071 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.7 m -64.0 -36.67 84.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.054 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.17 -37.17 72.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.008 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -61.46 -38.84 88.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.894 0.378 . . . . 0.0 110.416 175.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 5' ' ' ALA . 88.5 t -57.28 -52.73 52.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.414 176.061 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 65.0 t -64.52 -35.32 74.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.504 -177.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.6 m -70.45 -36.28 73.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.801 -177.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -96.52 -16.93 20.84 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -176.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.423 HD12 HG13 ' A' ' 9' ' ' VAL . 25.6 mt -108.56 90.21 7.0 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 177.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -40.12 128.24 2.15 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.959 3.106 . . . . 0.0 113.872 -174.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.5 m -76.26 146.03 9.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.654 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mp -100.94 131.64 46.72 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.109 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -110.7 -29.38 8.03 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.16 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.6 m -68.32 97.17 0.71 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.455 175.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -134.76 128.41 32.82 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.809 0.337 . . . . 0.0 110.588 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -146.97 -37.39 0.22 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.514 178.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.47 161.36 10.89 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.935 -0.65 . . . . 0.0 111.599 178.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -69.47 -7.45 20.99 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.73 2.286 . . . . 0.0 112.303 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.415 ' CG ' HG22 ' A' ' 88' ' ' ILE . 22.8 mmm180 -88.6 -3.01 58.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.718 178.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -112.76 103.55 11.56 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.596 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -61.09 -52.18 66.01 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -170.28 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.544 ' HG3' HD23 ' A' ' 27' ' ' LEU . 11.0 pt-20 -72.87 -38.92 66.85 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.576 -0.45 . . . . 0.0 112.018 -171.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.544 HD23 ' HG3' ' A' ' 26' ' ' GLU . 4.0 mm? -71.98 -31.15 65.98 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.682 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 -68.21 -33.0 73.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.131 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.596 HG23 ' O ' ' A' ' 25' ' ' ARG . 67.0 t -58.2 -49.98 79.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.641 177.007 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -61.08 -47.25 87.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.784 0.326 . . . . 0.0 110.549 178.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.535 HH22 ' HA2' ' A' ' 133' ' ' GLY . 45.9 ttt-85 -64.44 -35.24 80.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -176.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -60.59 -53.17 60.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.81 -177.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? -67.06 -41.14 86.96 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.046 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -64.71 -38.06 89.7 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.868 -179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -66.85 -36.32 82.07 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.446 ' O ' HG13 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -65.0 -46.94 79.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.25 178.731 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -63.03 -34.75 78.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.814 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.531 ' HG ' ' HB1' ' A' ' 135' ' ' ALA . 48.4 t -60.16 -46.64 88.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.866 174.502 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.511 ' O ' HG23 ' A' ' 43' ' ' VAL . 84.1 mt -61.02 -51.5 68.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.807 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.459 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 80.5 mt -56.81 -40.84 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.339 -178.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -45.6 87.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.037 0.446 . . . . 0.0 110.304 178.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -67.63 -34.97 78.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.341 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 39' ' ' LEU . 84.1 t -62.35 -40.78 89.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.319 175.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 49.3 mt-10 -58.78 -48.75 80.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.906 0.384 . . . . 0.0 110.198 175.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -57.48 -40.25 78.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.837 177.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.52 -51.99 65.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.795 176.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.45 ' HE2' HG13 ' A' ' 43' ' ' VAL . 65.3 mttm -64.29 -28.86 70.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.384 -176.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -59.17 -41.03 87.44 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.638 175.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -90.56 -1.53 57.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.143 0.496 . . . . 0.0 110.49 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.0 t70 69.38 10.54 7.78 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.853 -178.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -95.76 68.17 2.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.521 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -81.67 86.6 6.38 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -97.85 -2.76 40.13 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -165.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.49 ' HB2' ' HG ' ' A' ' 69' ' ' CYS . 6.1 p90 -159.13 153.27 23.64 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.777 -0.769 . . . . 0.0 111.666 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -134.62 128.54 33.34 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 171.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.9 tp -131.08 125.13 32.38 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.58 -173.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -136.3 169.14 18.13 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.4 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 61.5 p -152.25 177.9 10.07 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.126 -179.025 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.461 ' OD1' ' HB2' ' A' ' 61' ' ' GLU . 4.2 p30 -71.52 163.89 26.88 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 168.569 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -73.38 -9.89 59.16 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.787 0.327 . . . . 0.0 111.737 -174.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.461 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 9.1 mm-40 -74.57 -36.43 63.06 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 171.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.99 20.97 69.11 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.509 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.3 p -90.74 -15.13 30.77 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.872 0.368 . . . . 0.0 111.556 -178.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 43.4 mtm180 -146.31 126.17 13.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.219 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.4 ' CD2' ' HB3' ' A' ' 58' ' ' SER . 50.0 m95 -114.26 158.27 21.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.693 -175.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -154.95 152.72 30.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.317 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.41 -162.61 29.47 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.336 178.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.416 ' HE3' ' HB2' ' A' ' 68' ' ' LYS . 35.6 ttmt -152.63 147.0 25.63 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.946 -0.391 . . . . 0.0 109.946 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.49 ' HG ' ' HB2' ' A' ' 54' ' ' PHE . 58.8 m -118.41 135.23 54.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.357 179.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 31.3 m-90 -114.52 121.69 44.28 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 176.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.438 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 47.8 t80 -120.66 122.95 41.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.195 0.521 . . . . 0.0 110.56 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 27.8 mm -102.87 114.14 41.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.557 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 14.5 t60 -130.21 105.23 7.78 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.137 179.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.424 ' C ' ' H ' ' A' ' 76' ' ' LEU . 20.3 t70 48.08 74.07 0.18 Allowed 'General case' 0 N--CA 1.465 0.297 0 O-C-N 124.307 1.004 . . . . 0.0 111.914 177.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 72.65 -33.52 0.27 Allowed 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.276 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.424 ' H ' ' C ' ' A' ' 74' ' ' ASP . 90.5 mt -74.87 123.56 25.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.032 0.444 . . . . 0.0 111.19 -178.052 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -115.66 119.01 34.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.213 177.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.417 ' CE1' ' HD2' ' A' ' 71' ' ' TYR . 7.1 p90 -140.03 144.96 37.17 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.503 177.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.04 148.8 50.12 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.333 -174.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -120.61 126.08 49.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.672 -177.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -88.2 114.85 25.23 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.48 HG23 HG23 ' A' ' 99' ' ' VAL . 47.9 pt -124.89 150.07 29.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.282 0.563 . . . . 0.0 112.137 -172.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -156.18 159.58 39.1 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.649 175.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.487 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 43.7 p90 -165.13 163.61 20.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.92 0.39 . . . . 0.0 110.741 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -112.16 157.6 20.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.654 -178.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.429 ' HA ' ' HD2' ' A' ' 87' ' ' PRO . 49.5 mm -107.26 90.32 5.57 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.657 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 19.8 Cg_endo -56.37 157.86 17.06 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 122.996 2.464 . . . . 0.0 112.948 -177.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.415 HG22 ' CG ' ' A' ' 23' ' ' ARG . 70.1 mt -61.85 -26.41 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.289 -179.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.7 p -81.41 9.24 7.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.112 -0.494 . . . . 0.0 112.228 -176.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.461 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 67.5 t80 -72.93 141.18 81.48 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.461 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 97.0 Cg_endo -96.68 14.23 36.98 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.335 -1.111 . . . . 0.0 113.53 1.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.6 m -64.6 -35.53 81.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.372 0.606 . . . . 0.0 110.343 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.0 m -111.99 131.34 55.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 174.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.438 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -77.59 143.29 67.62 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 120.634 0.254 . . . . 0.0 111.166 -178.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 5.9 Cg_exo -79.97 123.51 5.19 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.208 2.606 . . . . 0.0 111.357 176.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 1.015 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 1.4 mp0 -84.59 126.16 33.09 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.178 -179.096 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.487 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 61.7 mt -72.86 134.6 29.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.459 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.43 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -105.89 128.93 54.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.721 0.296 . . . . 0.0 110.358 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.48 HG23 HG23 ' A' ' 82' ' ' ILE . 14.3 t -128.41 86.44 57.8 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.404 -178.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.8 -27.03 83.99 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 122.911 2.408 . . . . 0.0 112.814 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -65.11 -27.37 68.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.122 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.447 ' HB2' ' HE1' ' A' ' 109' ' ' MET . 72.7 mt -96.87 2.94 52.31 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.689 -176.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -64.15 118.76 9.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.792 0.329 . . . . 0.0 110.746 178.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 85.78 -21.94 13.17 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.995 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -74.61 -45.87 42.19 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -179.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.7 t -107.5 155.55 19.95 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.628 176.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -85.36 -36.99 20.39 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.777 -177.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -82.18 50.5 1.6 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 121.141 0.496 . . . . 0.0 111.486 -174.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.447 ' HE1' ' HB2' ' A' ' 102' ' ' LEU . 54.7 ttm -125.49 124.22 40.87 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 172.153 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -85.36 159.57 19.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.216 0.531 . . . . 0.0 111.94 -172.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 60.1 mtm-85 -59.88 110.78 1.25 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.157 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 146.7 -27.06 1.64 Allowed Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 -174.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 102.13 -4.38 52.11 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.987 174.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 1.015 ' HD3' ' HB2' ' A' ' 96' ' ' GLU . 92.8 mttt -100.42 158.14 16.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.107 0.48 . . . . 0.0 111.211 -177.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 39.5 pt -78.96 176.57 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.846 -176.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 48.3 t -124.46 154.31 40.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.018 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 89.7 mt -124.97 -171.14 2.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.475 -176.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 7.1 t -89.91 158.48 17.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.919 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -62.93 -32.54 73.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.879 -177.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -73.95 -18.29 60.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.252 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -71.57 -38.27 70.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.344 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.422 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 73.4 mmtt -55.67 -58.76 13.97 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -176.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.422 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 38.2 Cg_endo -66.7 -34.61 31.22 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 121.744 1.629 . . . . 0.0 111.871 178.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.4 tp -60.83 -46.34 90.95 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.595 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.503 ' CZ3' HD11 ' A' ' 137' ' ' LEU . 40.8 t-105 -57.83 -57.08 14.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.698 178.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.87 -24.23 67.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.258 -174.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 -85.28 -20.52 29.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.714 0.292 . . . . 0.0 110.975 -177.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -105.81 36.53 2.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.125 0.488 . . . . 0.0 111.465 -177.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 98.2 t -116.77 130.96 24.18 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.473 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 89.6 Cg_endo -85.03 -149.64 0.49 Allowed 'Cis proline' 0 C--N 1.348 0.505 0 C-N-CA 123.973 -1.261 . . . . 0.0 113.267 1.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 99.3 mttt 75.98 9.16 3.41 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.862 0.865 . . . . 0.0 111.027 -174.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -114.94 165.6 12.69 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.535 ' HA2' HH22 ' A' ' 31' ' ' ARG . . . -163.15 175.17 39.49 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.957 -178.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 44.6 tp -67.61 -38.79 84.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.724 0.297 . . . . 0.0 110.606 -177.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.531 ' HB1' ' HG ' ' A' ' 38' ' ' SER . . . -60.7 -35.94 77.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.399 0.618 . . . . 0.0 110.415 176.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -71.55 -33.5 69.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.305 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.503 HD11 ' CZ3' ' A' ' 125' ' ' TRP . 54.8 tp -64.21 -35.62 81.39 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.844 177.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.1 mmt -69.8 -45.03 68.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.919 0.39 . . . . 0.0 110.873 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.59 -44.12 67.98 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.856 -177.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.3 mt -96.42 0.85 51.06 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -174.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.54 -68.78 0.22 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.812 -178.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 58.6 tp -65.38 -41.0 94.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.663 0.268 . . . . 0.0 111.104 -176.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.0 -61.9 6.46 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.413 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . 0.482 ' O ' HG23 ' A' ' 148' ' ' VAL . 24.0 Cg_endo -64.19 -30.37 64.71 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.492 2.128 . . . . 0.0 112.728 177.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 85.4 t90 -59.66 -45.93 90.56 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.016 0.436 . . . . 0.0 110.479 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 96.7 mt -58.53 -35.36 72.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.953 179.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.28 0.41 32.9 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -176.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 144' ' ' PRO . 89.6 t -95.0 -55.39 6.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.893 0.378 . . . . 0.0 111.098 178.208 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -96.26 -41.3 8.74 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -173.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.537 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 44.6 mm -55.96 -53.61 61.32 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -169.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.537 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 50.9 Cg_exo -54.88 -42.73 66.13 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.853 1.702 . . . . 0.0 112.302 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -74.44 -29.59 61.55 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.476 0.655 . . . . 0.0 110.441 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.518 ' HB3' HD11 ' A' ' 159' ' ' ILE . 13.9 tp -69.1 -34.15 74.63 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.642 178.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 150' ' ' ILE . 79.8 mt -63.98 -43.21 97.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.375 175.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -66.11 -28.05 68.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.187 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . 0.498 ' HE2' HD11 ' A' ' 153' ' ' LEU . 37.2 mtmm -76.72 -20.6 56.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.816 0.341 . . . . 0.0 110.73 177.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 92.86 -8.02 76.58 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.916 -0.659 . . . . 0.0 114.045 170.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.4 p -67.06 -30.61 50.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 117.012 0.406 . . . . 0.0 111.642 -175.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.518 HD11 ' HB3' ' A' ' 153' ' ' LEU . 36.3 mt -67.68 153.11 9.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.518 178.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -50.84 138.32 19.01 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.081 0.467 . . . . 0.0 111.246 178.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 17.5 m80 -140.49 99.19 3.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.988 -177.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -94.88 -59.61 1.87 Allowed 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -89.17 147.24 24.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.419 174.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -126.82 -76.1 0.58 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.618 175.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 26.2 t 68.75 2.4 3.46 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.003 178.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -122.15 107.59 12.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.351 0.596 . . . . 0.0 110.149 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -89.91 75.8 7.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.62 0.724 . . . . 0.0 110.782 -174.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 98.3 mt -115.39 135.95 53.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 172.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -112.85 118.29 34.5 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.244 0.545 . . . . 0.0 112.094 -172.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 56.7 m170 -94.8 174.35 7.14 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 169.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 18.2 m80 -70.03 136.29 50.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.148 0.499 . . . . 0.0 110.518 178.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -67.54 -46.14 73.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.949 -169.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -78.27 130.77 36.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.269 0.557 . . . . 0.0 111.712 -175.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 23.0 p80 -152.6 171.67 17.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.23 -0.896 . . . . 0.0 108.851 172.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 45.6 p-80 . . . . . 0 C--O 1.247 0.945 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 175.398 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.3 mtt . . . . . 0 N--CA 1.481 1.089 0 CA-C-O 120.958 0.408 . . . . 0.0 109.983 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.87 164.35 35.59 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.294 -179.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.436 ' HA ' ' OG1' ' A' ' 6' ' ' THR . 38.8 t70 70.71 1.47 3.72 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.808 0.692 . . . . 0.0 111.834 176.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.1 -52.65 64.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.71 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.462 ' O ' HG22 ' A' ' 9' ' ' VAL . . . -66.73 -40.57 88.42 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.281 -177.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.491 ' O ' HG22 ' A' ' 10' ' ' VAL . 0.7 OUTLIER -66.54 -46.89 74.63 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -175.938 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -66.27 -28.0 68.37 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.044 0.45 . . . . 0.0 110.203 -179.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -67.7 -43.54 79.85 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.154 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 5' ' ' ALA . 86.2 t -63.41 -40.72 90.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.462 177.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.491 HG22 ' O ' ' A' ' 6' ' ' THR . 91.6 t -64.12 -27.29 42.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.95 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.6 m -69.12 -26.68 65.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.737 0.303 . . . . 0.0 110.832 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -94.12 -7.82 41.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.772 0.32 . . . . 0.0 111.843 176.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.448 HG12 ' HB2' ' A' ' 42' ' ' TYR . 45.6 mt -118.55 86.75 29.68 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 175.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.641 ' HD2' ' HA ' ' A' ' 38' ' ' SER . 73.2 Cg_exo -49.3 151.99 6.04 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.71 2.94 . . . . 0.0 113.878 -172.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.586 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 30.2 m -85.15 151.83 3.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.414 178.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.498 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 7.1 mp -86.81 134.57 33.54 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.316 -179.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -91.41 -44.15 9.31 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.064 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 m -66.13 -74.8 0.1 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.627 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.44 ' OD1' ' HG3' ' A' ' 91' ' ' PRO . 38.8 t30 45.83 43.66 10.19 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.333 176.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.59 -84.49 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.378 -176.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 167.12 172.54 34.45 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.86 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -71.0 -11.34 29.09 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 123.184 2.589 . . . . 0.0 112.464 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 mtp-105 -66.94 -48.6 68.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.616 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.495 ' HB3' HD21 ' A' ' 27' ' ' LEU . 15.0 m-20 -84.31 104.9 14.72 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.567 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 72.5 mtm180 -58.12 -51.8 68.19 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.517 ' HG2' HD22 ' A' ' 27' ' ' LEU . 1.4 pm0 -72.83 -26.28 61.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.642 0.258 . . . . 0.0 111.405 -177.059 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.517 HD22 ' HG2' ' A' ' 26' ' ' GLU . 3.9 mm? -80.29 -30.95 38.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.709 0.29 . . . . 0.0 110.653 178.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.417 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 60.5 t-105 -67.35 -46.83 72.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.167 177.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 90.9 t -60.74 -38.36 78.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.943 0.402 . . . . 0.0 110.445 177.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -70.55 -32.89 70.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.901 0.382 . . . . 0.0 110.161 177.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 67.0 ttt-85 -69.21 -33.16 72.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.123 177.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 90.5 mt -58.39 -42.48 87.18 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.975 174.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -59.55 -47.52 85.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.282 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -54.94 -48.37 73.23 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.945 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -61.84 -48.2 81.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.084 178.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -65.11 -32.3 73.93 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -178.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -58.96 -45.3 90.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.228 0.537 . . . . 0.0 109.994 174.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.641 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 8.3 m -70.77 -44.22 67.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.57 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.427 ' O ' HG22 ' A' ' 43' ' ' VAL . 80.1 mt -60.17 -55.35 34.86 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.25 -179.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 85.9 mt -58.05 -46.52 88.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.72 -176.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -58.81 -49.03 79.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.649 -0.25 . . . . 0.0 110.786 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.448 ' HB2' HG12 ' A' ' 13' ' ' ILE . 67.6 t80 -63.06 -49.85 72.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.711 0.291 . . . . 0.0 111.106 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.612 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 93.8 t -59.49 -45.69 93.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.904 -177.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -67.29 -35.0 78.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.667 0.27 . . . . 0.0 111.109 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -60.14 -39.9 87.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.749 0.309 . . . . 0.0 110.256 173.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.439 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 4.9 m-20 -71.65 -32.44 67.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.856 177.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.612 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 34.0 mmtp -57.79 -43.86 85.9 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.209 0.528 . . . . 0.0 110.047 174.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -72.76 -21.46 61.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.933 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -91.72 2.17 56.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.361 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.7 t70 63.43 23.76 13.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.583 0.706 . . . . 0.0 110.874 178.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.439 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 16.9 t30 -125.3 66.52 1.14 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.691 0.758 . . . . 0.0 110.48 -178.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -86.27 106.45 17.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.283 -0.871 . . . . 0.0 108.882 174.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 45.9 p-90 -120.61 6.85 10.52 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -168.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -162.83 154.23 17.65 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.826 -0.75 . . . . 0.0 112.157 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -138.54 124.4 19.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.003 167.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.7 tp -117.13 124.54 49.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.709 -177.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -131.55 155.56 47.27 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.841 -174.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.6 t -149.12 176.99 10.01 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.105 0.479 . . . . 0.0 110.827 -177.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -86.11 176.73 7.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.463 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.437 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 41.5 mmtm -66.53 -19.94 65.9 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -174.753 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -87.36 -17.58 32.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.714 0.292 . . . . 0.0 110.408 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.13 28.63 73.17 Favored Glycine 0 C--N 1.332 0.354 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.552 -179.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.5 p -85.83 -33.1 21.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.04 0.448 . . . . 0.0 111.812 -177.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -129.18 116.1 18.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.661 -179.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -102.33 128.19 49.0 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -136.5 159.46 41.72 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.978 -176.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 172.34 -165.75 38.39 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 119.867 -1.159 . . . . 0.0 112.372 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.5 pttm -142.38 139.74 31.82 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.041 0.448 . . . . 0.0 110.624 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 79' ' ' GLU . 45.7 m -112.49 153.31 27.63 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.263 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 26.0 m-90 -117.67 123.57 46.43 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.025 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -117.96 120.56 38.21 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 177.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.9 mm -88.21 114.71 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.892 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -148.35 110.63 4.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.401 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.7 t70 66.83 62.93 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.338 175.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.3 mt 68.57 -13.12 0.33 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.143 -0.935 . . . . 0.0 113.158 173.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 78.9 mt -109.06 136.67 48.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.259 0.552 . . . . 0.0 111.869 -175.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -93.44 112.22 24.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.287 174.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -97.86 130.26 44.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.715 -0.22 . . . . 0.0 111.043 -178.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.403 ' HA ' ' O ' ' A' ' 69' ' ' CYS . 1.7 mp0 -96.97 136.1 38.02 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 174.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -126.19 123.93 39.3 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -88.82 131.3 35.14 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.144 0.497 . . . . 0.0 110.054 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.495 HG21 HG22 ' A' ' 99' ' ' VAL . 46.5 pt -131.78 151.37 35.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.602 -178.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -153.22 155.33 36.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.83 174.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 35.3 p90 -159.05 152.73 23.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.4 176.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.517 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 2.2 p30 -97.94 155.24 17.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.673 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.6 mm -106.25 91.12 5.3 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.979 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.517 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 51.4 Cg_exo -54.75 153.89 22.81 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.882 2.388 . . . . 0.0 112.373 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 43.4 mt -61.25 -24.93 34.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.179 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.2 p -88.83 13.32 12.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.049 -178.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.563 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 61.4 t80 -77.59 145.65 71.78 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 176.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.563 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 50.2 Cg_endo -91.45 14.25 50.44 Favored 'Cis proline' 0 C--N 1.349 0.571 0 C-N-CA 124.305 -1.123 . . . . 0.0 114.072 0.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 86.4 m -62.02 -44.65 96.25 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.02 0.438 . . . . 0.0 110.128 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 39.2 m -102.64 119.39 38.75 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.036 174.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.71 144.48 91.05 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -78.81 172.73 14.6 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 122.9 2.4 . . . . 0.0 112.868 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.596 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 19.5 mt-10 -107.75 122.18 46.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.197 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.4 ' O ' HG12 ' A' ' 115' ' ' ILE . 34.8 mm -75.55 124.38 33.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.508 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.53 ' HB1' ' HG2' ' A' ' 114' ' ' LYS . . . -109.38 129.53 55.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.928 0.394 . . . . 0.0 111.162 179.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.495 HG22 HG21 ' A' ' 82' ' ' ILE . 21.9 t -123.52 86.58 52.39 Favored Pre-proline 0 C--O 1.237 0.401 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.832 178.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.69 -31.36 94.7 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.289 2.659 . . . . 0.0 113.753 -173.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -68.58 -28.8 67.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.842 0.353 . . . . 0.0 110.973 -177.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 82.4 mt -97.42 13.26 30.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.666 0.269 . . . . 0.0 111.175 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.75 106.39 0.4 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.715 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 88.8 -1.15 83.26 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.974 178.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -93.55 -16.0 24.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.887 0.375 . . . . 0.0 110.842 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.49 ' HB ' HD23 ' A' ' 153' ' ' LEU . 3.3 t -135.88 151.34 49.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.098 -178.033 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -84.32 0.97 47.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.964 179.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -86.96 16.48 4.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.477 ' HG2' HG22 ' A' ' 106' ' ' THR . 22.8 mmt -97.01 130.79 44.28 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.952 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 5.0 m-30 -109.22 -72.99 0.7 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.189 0.519 . . . . 0.0 110.426 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -94.19 85.89 4.79 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.566 -175.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 65.73 -102.47 0.7 Allowed Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.112 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -106.66 6.6 38.34 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.192 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.596 ' HD3' ' HB2' ' A' ' 96' ' ' GLU . 84.5 mttt -86.31 124.4 32.63 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.084 0.469 . . . . 0.0 110.419 177.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.4 HG12 ' O ' ' A' ' 97' ' ' ILE . 37.4 pt -76.73 158.01 5.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.227 -176.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 25.8 p -91.94 124.04 35.75 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.604 178.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 89.0 mt -86.71 161.1 18.61 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.3 173.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.1 t -69.95 153.51 43.15 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.002 0.43 . . . . 0.0 111.268 -173.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -58.13 -49.62 76.32 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.883 -177.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -68.61 -4.07 14.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.69 -176.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -66.13 -47.39 74.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.863 -0.153 . . . . 0.0 110.96 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.509 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 39.6 mmtm -59.65 -51.97 77.29 Favored Pre-proline 0 CA--C 1.537 0.449 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.52 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.509 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 50.0 Cg_exo -56.44 -41.4 76.57 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 121.941 1.761 . . . . 0.0 112.193 174.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 45.4 tp -67.14 -38.04 84.83 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.01 0.433 . . . . 0.0 110.673 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.4 ' O ' HG21 ' A' ' 129' ' ' VAL . 66.8 t-105 -59.07 -57.44 13.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.294 178.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.21 -21.7 65.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.562 -178.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 123' ' ' PRO . 48.5 ttt180 -71.54 -29.34 64.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.482 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -98.61 -39.61 8.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.503 -177.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.538 HG11 ' HA ' ' A' ' 130' ' ' PRO . 70.5 t -57.52 142.84 76.35 Favored Pre-proline 0 CA--C 1.533 0.319 0 O-C-N 123.373 0.421 . . . . 0.0 110.261 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.538 ' HA ' HG11 ' A' ' 129' ' ' VAL . 5.0 Cg_exo -79.12 -163.07 3.21 Favored 'Cis proline' 0 C--N 1.355 0.872 0 C-N-CA 125.008 -0.83 . . . . 0.0 113.838 2.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.586 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 96.7 mttt 72.81 -18.53 0.35 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.545 0.738 . . . . 0.0 111.611 -178.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.457 ' H ' ' C ' ' A' ' 130' ' ' PRO . 8.8 t80 -77.01 158.51 30.55 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.131 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -159.63 -179.59 34.54 Favored Glycine 0 C--O 1.236 0.235 0 C-N-CA 119.999 -1.096 . . . . 0.0 112.84 -174.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.413 HD12 HD22 ' A' ' 137' ' ' LEU . 58.8 tp -64.38 -37.48 87.67 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 122.999 0.52 . . . . 0.0 111.195 -175.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.63 -40.68 75.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.523 0.678 . . . . 0.0 110.66 177.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -71.32 -35.37 71.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.968 178.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.413 HD22 HD12 ' A' ' 134' ' ' LEU . 50.2 tp -66.07 -37.12 85.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.167 178.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.819 ' HA ' ' HE3' ' A' ' 138' ' ' MET . 17.9 mmt -62.21 -48.18 81.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.865 0.364 . . . . 0.0 110.441 177.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.89 -49.12 49.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.086 -177.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.4 10.18 37.3 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -172.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -124.23 -67.19 0.2 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.295 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.582 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 53.7 tp -65.79 -42.51 90.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.788 -0.206 . . . . 0.0 111.038 -177.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.43 -61.44 6.99 Favored Glycine 0 CA--C 1.525 0.662 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.627 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . 0.412 ' O ' HG23 ' A' ' 148' ' ' VAL . 17.0 Cg_endo -59.59 -37.38 88.75 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.555 2.17 . . . . 0.0 112.799 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 68.6 t90 -61.44 -44.38 97.21 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.963 0.411 . . . . 0.0 110.248 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 94.2 mt -59.04 -36.19 74.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.007 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.0 -15.64 61.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.85 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 144' ' ' PRO . 61.4 t -93.02 -53.96 7.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.282 -178.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -90.75 -43.53 10.04 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -171.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.471 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.3 mm -59.51 -49.91 89.82 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -169.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 146' ' ' LEU . 50.5 Cg_exo -56.06 -30.81 80.27 Favored 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 122.105 1.87 . . . . 0.0 112.879 -178.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -87.26 -37.87 16.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 109.994 177.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.574 HD22 ' HD3' ' A' ' 156' ' ' LYS . 0.2 OUTLIER -59.24 -42.76 91.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.554 -179.865 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 72.0 mt -64.47 -39.63 86.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.018 0.437 . . . . 0.0 110.353 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -66.09 -27.31 67.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.026 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . 0.574 ' HD3' HD22 ' A' ' 153' ' ' LEU . 59.6 mtpt -63.93 -22.25 66.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.788 175.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 72.74 16.45 77.95 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.409 178.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 17.0 m -92.46 -6.18 10.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.072 0.463 . . . . 0.0 111.308 -178.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.462 HD11 HD11 ' A' ' 153' ' ' LEU . 55.6 mt -94.74 101.48 12.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.125 175.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . 0.461 ' OE1' ' HA ' ' A' ' 160' ' ' GLN . 6.0 tp60 -79.17 123.31 27.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 176.599 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -142.57 147.48 35.97 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -175.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.448 ' HD2' ' N ' ' A' ' 162' ' ' LYS . 4.0 mptp? -69.76 167.49 17.03 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.02 -164.88 1.62 Allowed 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.838 -172.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.82 -18.82 53.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 -169.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 49.3 t -71.0 -33.12 70.09 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.056 -0.403 . . . . 0.0 110.746 -177.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -90.67 18.88 5.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.769 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -62.86 147.12 51.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.974 0.416 . . . . 0.0 110.773 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 58.6 tp -130.33 122.38 27.8 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.611 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -76.96 95.13 4.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.85 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 15.2 p80 -86.82 65.39 8.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.858 0.837 . . . . 0.0 111.083 -177.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -136.73 92.06 2.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.747 174.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 -87.81 -39.88 14.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.344 -172.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.59 147.7 26.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.415 -177.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -83.81 -38.44 21.25 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 174.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 24.5 m80 . . . . . 0 C--O 1.247 0.929 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.498 172.564 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ptm . . . . . 0 N--CA 1.482 1.174 0 CA-C-O 120.688 0.28 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.34 86.62 6.53 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -174.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.464 ' HB2' ' HG1' ' A' ' 6' ' ' THR . 2.3 m-20 70.34 135.15 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 O-C-N 123.953 0.783 . . . . 0.0 113.112 173.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -72.88 -27.66 62.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.374 177.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.454 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -67.63 -42.83 81.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.969 -178.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.464 ' HG1' ' HB2' ' A' ' 3' ' ' ASP . 6.0 m -56.5 -54.52 44.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.097 -178.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -64.91 -31.89 73.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.091 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -64.3 -44.36 91.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.606 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 5' ' ' ALA . 66.0 t -62.86 -38.51 82.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.469 179.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.45 HG21 ' O ' ' A' ' 6' ' ' THR . 61.6 t -62.66 -33.1 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.178 179.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -69.92 -25.66 63.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.479 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.413 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 42.6 mt-10 -93.63 -13.07 28.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.882 0.373 . . . . 0.0 111.227 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.7 mt -113.76 87.06 11.63 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.413 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 50.9 Cg_exo -54.58 147.04 50.44 Favored 'Trans proline' 0 C--O 1.237 0.463 0 C-N-CA 123.453 2.768 . . . . 0.0 113.175 -173.234 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.486 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.7 m -72.34 161.38 4.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.192 176.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.698 HD22 ' HG3' ' A' ' 31' ' ' ARG . 10.2 mp -79.97 134.7 36.27 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.114 0.483 . . . . 0.0 111.532 -173.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.471 ' HB3' ' HG3' ' A' ' 34' ' ' GLU . 59.6 tttm -60.25 -44.08 95.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.852 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.511 HG23 HD12 ' A' ' 27' ' ' LEU . 31.7 m -129.38 130.02 45.49 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.946 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.648 ' HA ' ' HD3' ' A' ' 31' ' ' ARG . 16.8 m120 -120.43 119.63 33.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.752 0.311 . . . . 0.0 110.519 174.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -153.75 170.7 20.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.084 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.45 167.19 42.64 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.291 -178.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -72.56 3.65 4.1 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.397 2.732 . . . . 0.0 113.027 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.601 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 1.1 mmp_? -94.17 -26.24 16.77 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.308 0.575 . . . . 0.0 109.903 174.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -83.43 75.87 9.96 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 172.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -53.98 -41.95 68.45 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -169.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -58.25 -52.1 67.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.212 0.53 . . . . 0.0 110.911 179.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.511 HD12 HG23 ' A' ' 18' ' ' THR . 3.1 mm? -76.7 -23.51 53.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.743 -177.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.547 ' CH2' HG22 ' A' ' 86' ' ' ILE . 28.5 t-105 -64.29 -52.1 60.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.462 175.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.5 t -63.5 -33.71 63.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.084 0.468 . . . . 0.0 110.054 178.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -70.28 -42.81 71.6 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.495 178.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.698 ' HG3' HD22 ' A' ' 16' ' ' LEU . 51.5 ttp85 -64.54 -42.96 95.38 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 176.32 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -54.53 -50.01 68.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.722 -177.74 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.04 -33.13 71.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.532 0.206 . . . . 0.0 111.143 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.471 ' HG3' ' HB3' ' A' ' 17' ' ' LYS . 71.0 mm-40 -70.23 -45.63 66.12 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.286 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.558 ' HB3' HD21 ' A' ' 16' ' ' LEU . 15.3 pt-20 -75.01 -27.46 60.13 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.161 177.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.524 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -55.28 -44.27 75.53 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 169.445 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -63.96 -38.81 92.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.691 176.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.9 t -61.44 -40.23 93.71 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.031 -0.532 . . . . 0.0 109.711 174.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.432 ' O ' HG22 ' A' ' 43' ' ' VAL . 52.7 mt -63.31 -40.51 97.54 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.659 174.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 36' ' ' TYR . 77.4 mt -61.43 -35.56 67.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.868 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.425 ' O ' ' HB3' ' A' ' 44' ' ' GLU . 0.5 OUTLIER -66.75 -36.33 82.19 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.115 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -68.74 -47.74 65.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.928 176.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.432 HG22 ' O ' ' A' ' 39' ' ' LEU . 87.4 t -62.05 -32.6 54.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.328 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.425 ' HB3' ' O ' ' A' ' 41' ' ' ARG . 28.1 tt0 -52.89 -59.21 4.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.361 176.188 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -57.21 -36.77 71.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.289 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -64.02 -43.82 94.42 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.679 176.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.489 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 7.6 mmpt? -68.52 -37.01 79.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.78 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -57.9 -35.3 70.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.98 0.419 . . . . 0.0 110.47 177.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -96.23 -2.29 46.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.091 178.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.9 t70 60.36 20.93 10.49 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.907 0.861 . . . . 0.0 110.442 -177.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -112.87 60.15 0.64 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.59 -177.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -85.9 86.15 7.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 122.045 0.926 . . . . 0.0 109.902 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -83.22 -7.37 59.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.06 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.462 ' HZ ' HD22 ' A' ' 56' ' ' LEU . 60.6 t80 -115.49 122.39 45.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.829 -173.045 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.68 124.48 38.01 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 176.185 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.462 HD22 ' HZ ' ' A' ' 54' ' ' PHE . 19.3 tp -144.94 124.95 13.53 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.772 -175.176 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -109.09 159.6 16.74 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.031 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 m -132.88 161.74 33.41 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.636 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -93.53 171.74 8.71 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 173.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -62.0 -28.3 69.48 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 -175.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.0 -23.7 48.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.791 0.329 . . . . 0.0 110.607 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.21 7.88 84.96 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.954 -0.641 . . . . 0.0 111.584 -172.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.9 p -83.24 -14.85 52.34 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -174.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -134.11 130.54 37.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.064 0.459 . . . . 0.0 111.029 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 46.0 m95 -118.65 126.29 51.62 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.342 175.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -139.82 140.3 36.57 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.088 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -175.68 -160.35 23.16 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.216 -0.993 . . . . 0.0 112.554 -178.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.511 ' HG2' ' HA ' ' A' ' 81' ' ' ASP . 96.7 mttt -144.19 154.93 43.64 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.956 0.408 . . . . 0.0 110.769 -176.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 62.6 m -112.35 132.13 55.16 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.795 175.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.509 ' CD1' ' HG2' ' A' ' 79' ' ' GLU . 3.2 m-90 -107.58 122.59 46.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.213 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -130.45 120.03 23.57 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.058 0.456 . . . . 0.0 109.823 172.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.7 mp -98.53 117.29 43.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.639 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.433 ' HB3' ' HE2' ' A' ' 78' ' ' TYR . 39.3 t60 -139.06 117.97 12.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.99 -176.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 60.34 52.21 4.95 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.812 0.695 . . . . 0.0 111.037 176.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.0 mt 70.62 1.96 3.91 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.631 176.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 163' ' ' GLU . 63.1 mt -111.08 128.71 55.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.088 0.471 . . . . 0.0 111.512 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -93.24 107.22 19.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.424 174.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.433 ' HE2' ' HB3' ' A' ' 73' ' ' HIS . 77.8 m-85 -89.93 123.37 33.8 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.509 ' HG2' ' CD1' ' A' ' 70' ' ' TRP . 33.1 mt-10 -111.08 134.92 52.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.809 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -132.93 117.72 18.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.511 ' HA ' ' HG2' ' A' ' 68' ' ' LYS . 5.7 p-10 -87.84 136.91 32.75 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.156 0.503 . . . . 0.0 111.031 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.486 HG23 ' HB ' ' A' ' 99' ' ' VAL . 37.0 pt -136.22 149.66 27.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.486 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.48 153.04 37.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.351 0.596 . . . . 0.0 110.938 173.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -161.7 158.2 25.58 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.109 177.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -107.16 173.29 6.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.143 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.547 HG22 ' CH2' ' A' ' 28' ' ' TRP . 50.4 mm -111.81 89.22 10.92 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.922 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -63.89 162.61 28.18 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.446 2.097 . . . . 0.0 111.905 177.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.418 HD11 ' N ' ' A' ' 88' ' ' ILE . 3.0 mp -61.97 -23.41 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.271 -177.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.536 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 12.1 p -68.36 -18.74 64.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.873 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.628 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 62.8 t80 -77.02 141.32 67.46 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.628 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 83.7 Cg_endo -95.44 11.39 44.44 Favored 'Cis proline' 0 N--CA 1.458 -0.595 0 C-N-CA 124.454 -1.061 . . . . 0.0 113.749 2.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 33.3 m -60.77 -42.17 96.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.428 0.632 . . . . 0.0 110.18 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.536 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 31.9 m -121.7 125.98 47.88 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.464 175.251 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.68 144.0 98.75 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.605 -0.271 . . . . 0.0 110.713 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.401 ' HD3' ' CD1' ' A' ' 90' ' ' TYR . 82.6 Cg_endo -82.0 150.18 15.9 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.65 2.234 . . . . 0.0 112.135 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.409 ' CD ' ' HZ1' ' A' ' 114' ' ' LYS . 42.2 mt-10 -79.94 100.35 8.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.911 179.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.508 ' HB ' HD13 ' A' ' 115' ' ' ILE . 56.6 mt -67.38 130.75 32.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.18 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -105.19 137.47 42.91 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.947 0.403 . . . . 0.0 110.711 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.486 ' HB ' HG23 ' A' ' 82' ' ' ILE . 3.8 p -128.8 88.09 52.91 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-O 121.478 0.656 . . . . 0.0 110.431 177.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 99' ' ' VAL . 16.1 Cg_endo -56.29 -30.47 80.69 Favored 'Trans proline' 0 CA--C 1.529 0.255 0 C-N-CA 123.258 2.638 . . . . 0.0 113.496 -174.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -67.79 -40.4 83.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.906 0.384 . . . . 0.0 111.183 -179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.475 HD22 ' HG3' ' A' ' 105' ' ' LYS . 87.7 mt -85.99 5.47 33.16 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -174.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.17 -17.12 62.55 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.081 0.467 . . . . 0.0 110.673 -176.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -128.43 11.54 6.39 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.125 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.475 ' HG3' HD22 ' A' ' 102' ' ' LEU . 75.3 mmtt -95.63 -53.16 3.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.261 0.553 . . . . 0.0 109.627 179.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.508 ' HB ' HD13 ' A' ' 153' ' ' LEU . 13.3 t -113.23 146.35 39.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.529 -176.41 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -95.44 14.42 22.68 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.217 0.532 . . . . 0.0 110.782 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.434 ' HD3' ' OG1' ' A' ' 106' ' ' THR . 26.2 mtpt -101.18 22.33 12.55 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.686 -177.589 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.402 ' HG2' HG22 ' A' ' 106' ' ' THR . 25.0 mmt -100.66 163.3 12.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.047 -179.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.653 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 45.2 m-85 -91.86 178.02 6.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.745 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 60.3 mtp85 -81.23 109.31 15.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.34 -177.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 116.7 -134.59 11.42 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -176.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -118.48 70.22 0.32 Allowed Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 177.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.653 ' HB2' ' HB2' ' A' ' 110' ' ' TYR . 42.1 mttm -131.89 122.76 26.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.823 -0.189 . . . . 0.0 111.197 -172.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.508 HD13 ' HB ' ' A' ' 97' ' ' ILE . 46.2 pt -113.65 143.71 22.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 172.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.526 ' HB2' ' HE2' ' A' ' 110' ' ' TYR . 49.4 t -119.44 125.86 49.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.777 0.322 . . . . 0.0 110.206 -179.594 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.523 HD12 ' HA3' ' A' ' 141' ' ' GLY . 47.5 mt -77.65 -80.4 0.11 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.198 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.536 ' OG1' ' HB2' ' A' ' 121' ' ' PHE . 24.0 p -141.85 156.75 45.53 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.67 -43.0 77.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.902 0.382 . . . . 0.0 110.613 -177.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.43 ' C ' ' HD2' ' A' ' 123' ' ' PRO . 5.9 p80 -76.63 -5.54 48.23 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.56 -176.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.536 ' HB2' ' OG1' ' A' ' 118' ' ' THR . 56.4 t80 -71.22 -34.61 70.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.077 0.465 . . . . 0.0 109.868 176.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.594 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 16.6 mtpp -60.56 -52.28 73.86 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.787 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.594 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 31.6 Cg_exo -60.2 -41.25 52.73 Favored 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 121.769 1.646 . . . . 0.0 112.113 172.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 52.1 tp -61.31 -44.0 97.93 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.97 -177.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.462 ' O ' HG21 ' A' ' 129' ' ' VAL . 50.4 t-105 -61.42 -57.16 13.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.319 179.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.01 -29.43 69.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.954 -0.567 . . . . 0.0 112.037 -176.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -66.01 -43.07 88.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.507 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.505 ' HB2' ' CE2' ' A' ' 132' ' ' PHE . 55.5 m-80 -97.41 -0.11 46.82 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -168.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.462 HG21 ' O ' ' A' ' 125' ' ' TRP . 97.7 t -55.67 136.19 71.37 Favored Pre-proline 0 N--CA 1.466 0.346 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 174.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.432 ' HA ' HG12 ' A' ' 129' ' ' VAL . 70.3 Cg_endo -97.11 -142.25 0.14 OUTLIER 'Cis proline' 0 C--N 1.352 0.712 0 C-N-CA 124.73 -0.946 . . . . 0.0 113.589 4.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.486 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 35.8 mtmm 75.53 1.4 3.61 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.875 0.87 . . . . 0.0 111.119 -176.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.505 ' CE2' ' HB2' ' A' ' 128' ' ' ASN . 11.3 m-85 -79.95 160.39 25.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.675 175.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -166.01 170.41 40.71 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 -178.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.633 HD13 ' HE1' ' A' ' 138' ' ' MET . 33.4 tp -59.57 -35.23 73.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.952 0.376 . . . . 0.0 111.306 -174.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.05 -41.31 83.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.06 0.457 . . . . 0.0 110.969 177.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -71.75 -37.1 70.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.506 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 63.7 tp -65.53 -46.53 79.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.245 -178.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.633 ' HE1' HD13 ' A' ' 134' ' ' LEU . 24.2 mmt -67.45 -39.61 85.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.295 -178.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.49 -47.53 60.08 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -176.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.8 mt -83.45 -16.44 45.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.314 -175.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . 0.523 ' HA3' HD12 ' A' ' 117' ' ' LEU . . . -112.32 -74.88 0.71 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.316 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 40.6 tp -61.02 -41.96 97.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.77 -62.87 5.77 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 121.074 -0.584 . . . . 0.0 113.423 -177.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -66.2 -27.42 48.74 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.285 1.99 . . . . 0.0 112.285 178.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 59.1 t90 -63.52 -52.56 60.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.284 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 91.2 mt -61.62 -32.8 72.96 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.623 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.13 -15.78 63.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.484 -178.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 92.5 t -106.58 -45.23 7.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.792 0.33 . . . . 0.0 110.727 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . 0.425 ' CD ' ' HZ1' ' A' ' 108' ' ' LYS . 23.1 tp10 -67.53 -52.57 37.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.74 -175.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.477 ' O ' HG13 ' A' ' 154' ' ' ILE . 46.3 mm -55.92 -54.35 53.12 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -172.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 17.4 Cg_endo -58.35 -39.56 83.15 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 121.84 1.694 . . . . 0.0 112.257 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -68.23 -38.3 81.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.272 0.558 . . . . 0.0 110.246 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.582 HD11 ' HD3' ' A' ' 156' ' ' LYS . 31.1 tp -70.14 -36.03 74.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.948 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 150' ' ' ILE . 77.2 mt -64.25 -41.93 93.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.991 0.424 . . . . 0.0 110.33 176.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -67.1 -13.93 62.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.545 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . 0.582 ' HD3' HD11 ' A' ' 153' ' ' LEU . 21.4 mtpp -69.17 -16.93 63.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.687 0.279 . . . . 0.0 110.939 174.098 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 81.0 7.49 88.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.366 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . 0.697 HG23 HG13 ' A' ' 159' ' ' ILE . 27.7 m -88.31 -15.39 9.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.155 0.502 . . . . 0.0 110.437 178.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.697 HG13 HG23 ' A' ' 158' ' ' VAL . 56.8 mt -127.2 152.11 34.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.562 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 75.32 80.26 0.1 Allowed 'General case' 0 N--CA 1.461 0.122 0 O-C-N 124.05 0.844 . . . . 0.0 111.092 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -81.17 -38.91 26.33 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.537 175.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.651 ' HG2' ' OE1' ' A' ' 163' ' ' GLU . 16.6 ttpp 179.47 162.5 0.88 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . 0.651 ' OE1' ' HG2' ' A' ' 162' ' ' LYS . 0.0 OUTLIER -75.86 -175.75 3.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.078 0.466 . . . . 0.0 111.596 -176.583 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.467 ' HZ2' ' HB3' ' A' ' 164' ' ' LYS . 7.7 mtpm? -79.45 -29.47 41.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.768 -174.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 2.3 p -89.17 -179.22 5.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.993 0.425 . . . . 0.0 111.926 -174.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -110.42 -41.4 4.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.097 -178.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -137.35 107.28 6.29 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.477 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 3.1 pp -97.06 -13.64 22.1 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.163 -179.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -78.13 166.65 22.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.484 0.659 . . . . 0.0 112.174 -176.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 -94.79 -179.36 4.83 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.377 -177.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -87.63 -48.54 7.81 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -90.08 95.61 10.29 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -79.35 85.64 5.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.384 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -81.68 -24.65 36.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.797 178.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 82.8 t60 . . . . . 0 C--O 1.247 0.923 0 CA-C-O 118.301 -0.857 . . . . 0.0 109.291 174.554 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 120.64 0.257 . . . . 0.0 111.471 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.0 107.74 18.88 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -170.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 53.78 34.71 19.72 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.681 171.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.42 ' HA ' ' HG3' ' A' ' 7' ' ' ARG . 11.0 pt-20 -64.55 -28.08 69.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.771 179.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.436 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -65.55 -48.36 72.72 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.988 176.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.7 m -59.18 -49.57 77.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.331 -179.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.452 ' HD3' ' N ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -68.9 -23.63 64.21 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.533 -177.875 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.452 ' N ' ' HD3' ' A' ' 7' ' ' ARG . 10.2 ttp180 -71.92 -39.13 69.71 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.835 0.35 . . . . 0.0 110.188 177.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 5' ' ' ALA . 95.0 t -61.56 -45.2 99.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.591 177.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.9 t -67.17 -33.5 63.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.024 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -73.37 -41.76 63.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.39 -175.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -87.78 -0.76 57.37 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -175.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.43 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 57.8 mt -115.06 89.07 18.75 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 173.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.2 Cg_endo -49.99 151.22 8.92 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.951 3.101 . . . . 0.0 113.904 -172.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.7 m -83.39 157.83 3.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.744 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.441 HD12 ' N ' ' A' ' 16' ' ' LEU . 6.2 mp -100.48 147.63 25.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.509 -177.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -83.07 -39.61 20.96 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 175.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.9 m -87.59 121.4 29.97 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.738 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -145.72 120.65 9.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.784 172.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -159.07 -55.17 0.06 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.17 -178.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 121.82 -169.19 14.64 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.721 -0.752 . . . . 0.0 111.94 177.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -72.75 5.13 3.08 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.102 2.535 . . . . 0.0 112.04 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -74.23 -30.97 62.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.184 178.67 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.542 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 1.4 t0 -120.38 104.39 9.98 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 79.1 mtp180 -61.83 -40.92 96.98 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -170.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -66.09 -43.51 87.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.146 0.498 . . . . 0.0 110.244 179.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.542 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 3.8 mm? -74.05 -23.53 59.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.668 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 46.5 t-105 -63.65 -39.05 93.36 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.452 174.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 60.0 t -64.5 -41.99 93.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.008 175.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.2 mm100 -59.17 -44.99 92.17 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.522 175.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.509 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 25.1 tpt180 -60.3 -44.71 95.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.546 178.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.418 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 1.4 mm? -58.41 -49.29 77.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.061 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.405 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 15.2 ptpt -70.76 -38.07 73.45 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.882 -175.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -66.95 -43.3 83.5 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.363 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.566 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 11.4 tp10 -68.88 -30.54 69.07 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.229 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.431 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.2 t80 -64.31 -43.48 94.54 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -60.14 -43.44 95.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.316 0.579 . . . . 0.0 109.858 174.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.422 ' HB3' ' O ' ' A' ' 35' ' ' GLU . 16.9 t -56.38 -46.57 80.04 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.848 175.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.61 HD23 ' HB1' ' A' ' 135' ' ' ALA . 82.2 mt -61.6 -55.34 31.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.913 178.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 36' ' ' TYR . 89.7 mt -52.22 -43.78 39.91 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.098 -178.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -45.28 91.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.86 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -71.3 -42.43 68.66 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.049 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.494 HG13 ' HE3' ' A' ' 47' ' ' LYS . 88.8 t -61.17 -44.31 98.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.767 0.317 . . . . 0.0 110.385 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.3 -38.6 85.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.626 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -57.65 -40.48 79.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.45 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.524 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 96.1 m-20 -62.24 -44.65 96.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.818 0.342 . . . . 0.0 110.487 177.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.494 ' HE3' HG13 ' A' ' 43' ' ' VAL . 89.4 mttt -64.64 -37.36 87.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.107 0.479 . . . . 0.0 110.647 178.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -70.68 -19.94 62.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.018 178.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -97.23 -1.38 44.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.287 175.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 65.27 30.69 11.1 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.994 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.524 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 8.2 t30 -131.52 93.52 3.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.925 0.393 . . . . 0.0 111.016 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -99.35 110.33 22.84 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 176.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 51.8 p-90 -124.24 -0.12 8.32 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -172.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.418 ' HA ' ' HA ' ' A' ' 69' ' ' CYS . 11.0 p90 -161.14 141.49 11.05 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.382 177.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -135.12 129.81 34.48 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 174.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.4 tp -147.23 126.52 13.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.931 -168.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -111.74 163.51 14.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.798 0.332 . . . . 0.0 110.28 176.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.441 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 10.9 p -125.41 157.34 37.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.109 -178.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -68.92 167.94 14.68 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.75 171.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -70.24 -19.15 63.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.393 0.616 . . . . 0.0 109.37 173.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -72.46 -32.94 66.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.16 173.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.8 8.85 84.91 Favored Glycine 0 C--N 1.333 0.411 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.079 -174.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.0 p -89.56 -30.21 18.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.028 0.442 . . . . 0.0 111.308 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 65.9 mtt180 -114.77 133.8 55.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.58 179.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.441 ' CD2' ' HB3' ' A' ' 58' ' ' SER . 49.9 m95 -124.12 126.65 46.55 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.004 175.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -136.04 148.23 48.27 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.036 -174.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.89 -144.18 8.36 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.183 -0.767 . . . . 0.0 111.183 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.3 ptpp? -159.77 150.69 19.33 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 117.037 0.419 . . . . 0.0 110.959 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 54' ' ' PHE . 25.0 p -116.06 147.67 41.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.379 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.552 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 29.5 m-90 -115.15 129.16 56.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.351 179.202 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -118.53 124.21 46.98 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.3 mm -86.0 120.2 35.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.155 178.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -124.28 108.42 12.21 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.732 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.3 t0 64.44 -85.02 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.197 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 75' ' ' LEU . 2.3 mm? -132.64 6.61 4.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.751 0.31 . . . . 0.0 111.218 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.8 mp -112.38 147.25 36.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.17 0.51 . . . . 0.0 111.21 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -116.54 98.19 6.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.578 -177.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.521 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 74.8 m-85 -93.14 133.22 36.55 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.301 -175.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.552 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 0.8 OUTLIER -110.28 136.54 49.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.409 0.623 . . . . 0.0 110.861 175.567 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.469 ' O ' HG22 ' A' ' 82' ' ' ILE . 91.4 m-85 -122.12 117.02 25.27 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.347 175.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.85 117.65 9.25 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.469 HG22 ' O ' ' A' ' 80' ' ' PHE . 36.8 pt -118.51 161.64 17.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.475 0.655 . . . . 0.0 111.855 -171.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -165.42 161.83 19.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.007 175.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.558 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 55.6 p90 -162.64 167.16 23.62 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 123.182 0.301 . . . . 0.0 110.339 173.057 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -119.02 158.42 25.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.404 -178.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.1 mm -106.93 90.4 5.27 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.828 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -60.14 160.95 20.86 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.579 2.186 . . . . 0.0 112.087 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 27.2 mt -73.84 -5.2 6.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.475 0.655 . . . . 0.0 110.727 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.83 8.4 17.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.291 176.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -77.64 142.0 65.58 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 174.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -97.31 16.72 32.57 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.229 -1.155 . . . . 0.0 113.043 -1.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.2 m -59.56 -37.81 79.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.463 0.649 . . . . 0.0 110.453 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.9 m -122.66 142.26 50.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.606 176.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.81 144.8 96.32 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.823 178.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.0 144.7 99.44 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.87 2.38 . . . . 0.0 112.364 177.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.23 104.54 14.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.517 -176.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.558 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 58.8 mt -72.7 131.4 34.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.424 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -92.62 -74.81 0.51 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.103 -173.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.424 HG22 HG22 ' A' ' 97' ' ' ILE . 17.7 t 61.49 82.38 0.22 Allowed Pre-proline 0 N--CA 1.466 0.369 0 CA-C-O 121.249 0.547 . . . . 0.0 110.233 -174.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.71 -14.51 42.03 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 123.263 2.642 . . . . 0.0 113.74 -170.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -79.36 -31.41 42.94 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.718 0.294 . . . . 0.0 111.12 -177.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.7 mt -83.5 -7.67 59.49 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.726 -174.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -61.81 124.0 19.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.735 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 89.97 -8.3 80.08 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.552 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -101.08 -55.28 2.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.91 0.386 . . . . 0.0 110.259 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.1 t -87.88 150.75 23.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.84 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -98.34 4.08 48.61 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.853 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -95.07 20.61 8.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.514 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 54.1 mtt -111.6 142.52 43.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.211 175.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -126.54 154.55 43.68 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.594 ' HE ' ' HA ' ' A' ' 111' ' ' ARG . 2.5 tpm_? 72.38 -50.18 0.7 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.91 0.757 . . . . 0.0 111.059 -176.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 171.45 -109.24 0.31 Allowed Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 178.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . 0.477 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . -86.74 60.61 4.46 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.434 177.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -147.1 116.73 7.09 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 177.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 39.7 pt -75.92 153.86 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.002 0.43 . . . . 0.0 111.202 -177.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 27.4 t -105.1 123.76 48.37 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.044 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.9 mt -71.58 161.86 30.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.261 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.3 p -67.88 159.74 29.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.025 0.441 . . . . 0.0 111.568 -176.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -61.51 -24.94 66.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.335 -0.848 . . . . 0.0 112.125 -173.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -93.39 -37.29 12.06 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.989 -0.285 . . . . 0.0 111.18 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -71.94 -35.84 69.73 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 -173.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.402 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 63.2 tttm -57.97 -52.28 75.62 Favored Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -177.064 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 56.6 Cg_endo -72.23 -25.44 18.81 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 121.826 1.684 . . . . 0.0 112.396 175.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 53.1 tp -62.44 -38.18 88.77 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.686 178.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.458 ' O ' HG22 ' A' ' 129' ' ' VAL . 57.1 t-105 -54.53 -55.44 29.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.941 0.401 . . . . 0.0 110.557 177.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -71.52 -14.19 62.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.163 -177.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.429 ' HD3' ' O ' ' A' ' 127' ' ' ARG . 3.3 tmt_? -80.54 -28.24 37.37 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -88.14 -39.14 14.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.572 -177.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.48 HG11 ' HA ' ' A' ' 130' ' ' PRO . 95.6 t -49.67 135.53 19.12 Favored Pre-proline 0 N--CA 1.472 0.653 0 O-C-N 123.512 0.508 . . . . 0.0 111.198 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.48 ' HA ' HG11 ' A' ' 129' ' ' VAL . 59.7 Cg_endo -86.51 -146.61 0.32 Allowed 'Cis proline' 0 C--N 1.353 0.77 0 C-N-CA 124.425 -1.073 . . . . 0.0 113.48 5.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.468 ' H ' ' HB2' ' A' ' 130' ' ' PRO . 42.9 mmtm 72.89 -37.61 0.39 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.32 0.648 . . . . 0.0 112.035 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.428 ' H ' ' C ' ' A' ' 130' ' ' PRO . 1.4 t80 -64.97 158.05 26.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.007 0.432 . . . . 0.0 111.215 -178.12 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.509 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -141.66 175.16 22.65 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.753 -175.18 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.403 ' H ' ' CD ' ' A' ' 35' ' ' GLU . 53.0 tp -72.29 -39.7 68.1 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.724 0.409 . . . . 0.0 111.33 -174.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.61 ' HB1' HD23 ' A' ' 39' ' ' LEU . . . -60.72 -30.82 70.21 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.481 0.657 . . . . 0.0 110.444 177.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -67.68 -32.98 74.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.055 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.418 ' HB2' ' CZ3' ' A' ' 125' ' ' TRP . 59.4 tp -68.6 -36.72 79.07 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.914 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 59.5 mtt -65.73 -42.01 91.52 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.309 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -77.82 -50.32 12.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.227 -177.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.7 mt -93.62 -6.14 47.16 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -171.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -117.02 -67.56 0.38 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.263 -0.97 . . . . 0.0 112.753 -177.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 58.8 tp -60.33 -48.93 79.63 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 122.154 0.182 . . . . 0.0 111.482 -175.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.74 -61.64 6.87 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 121.256 -0.497 . . . . 0.0 113.143 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . 0.401 ' O ' HG23 ' A' ' 148' ' ' VAL . 50.8 Cg_exo -56.08 -37.71 95.92 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.629 2.219 . . . . 0.0 112.797 177.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 64.8 t90 -61.99 -46.69 88.11 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.914 0.388 . . . . 0.0 110.569 -179.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 97.2 mt -61.7 -37.69 85.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.187 0.518 . . . . 0.0 110.647 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.13 -9.72 56.5 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.798 -178.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 144' ' ' PRO . 85.0 t -70.53 -55.98 12.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.648 -179.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -141.81 11.16 2.03 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -175.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.493 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 29.7 mm -69.3 -50.75 19.12 Favored Pre-proline 0 CA--C 1.535 0.404 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.502 174.018 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 15.0 Cg_endo -59.12 -31.23 95.09 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.763 1.642 . . . . 0.0 111.189 171.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.456 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 30.0 t70 -66.39 -45.0 81.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.402 178.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.581 ' HA ' ' HD3' ' A' ' 156' ' ' LYS . 41.0 tp -56.01 -38.81 71.0 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.518 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 62.7 mt -68.19 -44.41 84.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.669 177.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -69.98 -23.07 63.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.356 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . 0.581 ' HD3' ' HA ' ' A' ' 153' ' ' LEU . 28.8 mtpp -65.67 -18.19 65.14 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.849 176.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 85.8 26.1 36.08 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.67 -177.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 54.6 t -86.52 -43.85 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.976 0.417 . . . . 0.0 110.14 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 60.6 mt -107.73 114.53 46.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.48 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -113.61 122.17 46.4 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 177.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -133.16 132.72 41.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.802 0.334 . . . . 0.0 110.799 -173.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -77.21 -82.41 0.08 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.733 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 82.0 mm-40 -113.1 170.83 7.93 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.352 -175.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.418 ' C ' ' H ' ' A' ' 166' ' ' ASN . 34.6 mtmm -93.9 -41.41 9.62 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 173.027 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 69.6 m 70.13 -13.21 0.45 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 114.619 -1.173 . . . . 0.0 112.526 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . 0.418 ' H ' ' C ' ' A' ' 164' ' ' LYS . 27.6 p30 -101.43 143.79 31.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.179 0.514 . . . . 0.0 110.607 177.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -104.11 132.91 49.88 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.504 177.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 45.1 tp -71.7 103.16 2.99 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 173.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -61.46 144.88 53.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.254 -170.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -108.14 101.53 10.75 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.916 -174.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -122.49 121.54 36.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.475 -0.784 . . . . 0.0 108.97 177.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -85.66 149.0 25.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.535 0.683 . . . . 0.0 112.38 -172.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -84.44 123.08 29.85 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.369 171.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -54.11 -38.87 65.86 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 -171.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 44.7 t60 . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.463 -0.779 . . . . 0.0 109.442 175.769 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 121.009 0.433 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.83 40.55 1.0 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.523 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -64.06 124.91 22.84 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.724 -179.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -67.73 -30.92 70.53 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.707 -178.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.402 ' O ' HG22 ' A' ' 9' ' ' VAL . . . -54.67 -48.91 71.79 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.85 0.357 . . . . 0.0 110.814 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.492 ' O ' HG22 ' A' ' 10' ' ' VAL . 28.1 m -60.54 -53.84 52.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.433 -179.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.412 ' HD3' ' N ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -64.65 -28.9 69.92 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.807 0.337 . . . . 0.0 111.325 -176.063 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.412 ' N ' ' HD3' ' A' ' 7' ' ' ARG . 54.3 mtp180 -70.5 -36.56 73.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.679 0.276 . . . . 0.0 110.912 178.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 5' ' ' ALA . 99.5 t -72.88 -44.08 58.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.389 176.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 6' ' ' THR . 44.4 t -68.0 -14.36 18.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.196 0.522 . . . . 0.0 110.711 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.2 t -69.09 -34.33 74.94 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.127 174.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -96.65 -21.29 17.71 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.985 0.421 . . . . 0.0 110.369 178.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.3 mt -117.42 81.81 14.4 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 174.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -76.81 174.25 13.16 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 123.142 2.561 . . . . 0.0 113.852 -168.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.1 m -79.66 152.3 4.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.308 176.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 9.4 mp -86.9 134.66 33.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.771 -177.189 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.519 ' HD2' ' N ' ' A' ' 17' ' ' LYS . 12.2 mptt -87.2 -31.61 20.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.049 0.452 . . . . 0.0 110.238 -178.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.452 ' O ' ' HG3' ' A' ' 31' ' ' ARG . 11.6 m -93.64 105.76 17.78 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.603 176.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -125.24 133.36 52.73 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.803 0.335 . . . . 0.0 111.27 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -165.63 167.62 17.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.088 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.76 170.67 23.18 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.685 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -61.85 -10.62 17.86 Favored 'Trans proline' 0 N--CA 1.476 0.465 0 C-N-CA 123.232 2.621 . . . . 0.0 112.999 -177.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.822 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 0.4 OUTLIER -69.24 -27.02 65.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.953 177.936 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -112.91 97.52 6.59 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.465 ' O ' HG23 ' A' ' 29' ' ' VAL . 37.3 mtt180 -66.8 -29.68 69.69 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -176.098 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -62.68 -53.36 55.58 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.086 0.47 . . . . 0.0 110.195 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -75.62 -26.74 58.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.829 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.445 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 74.7 t-105 -64.42 -46.5 82.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.768 177.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 25' ' ' ARG . 68.1 t -60.03 -40.9 84.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 120.743 0.306 . . . . 0.0 110.455 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -67.42 -42.69 82.81 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.67 177.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.452 ' HG3' ' O ' ' A' ' 18' ' ' THR . 38.6 ttt-85 -65.18 -34.45 78.4 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.532 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.409 HD21 ' HA ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -63.56 -43.92 95.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.567 -178.237 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.613 ' HZ1' ' HB3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -74.32 -26.92 60.46 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.933 179.778 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -71.57 -35.91 70.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.141 0.496 . . . . 0.0 109.858 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.401 ' CD ' ' H ' ' A' ' 134' ' ' LEU . 10.1 tp10 -64.42 -40.73 96.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.395 174.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.4 ' HD2' ' HA ' ' A' ' 33' ' ' LYS . 5.3 m-85 -55.03 -40.39 70.16 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.913 175.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 71.8 mm-40 -58.71 -49.26 78.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.208 0.528 . . . . 0.0 110.261 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.6 t -62.16 -39.56 93.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.656 179.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.514 HD21 ' HB2' ' A' ' 135' ' ' ALA . 94.4 mt -65.09 -54.94 22.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.155 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 83.6 mt -54.13 -45.32 65.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.061 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -43.99 97.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.035 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -65.12 -43.69 91.16 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.745 0.307 . . . . 0.0 110.906 -179.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 39' ' ' LEU . 55.3 t -73.39 -43.0 56.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.475 -176.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.63 -29.01 64.18 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -178.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -65.63 -31.38 72.38 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 174.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.587 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 13.1 m-80 -71.49 -39.34 70.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.319 175.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -62.6 -33.28 74.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.049 176.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -66.82 -14.8 63.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 111.07 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -106.04 5.03 29.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.326 175.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.8 t70 63.33 27.7 15.44 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.99 0.9 . . . . 0.0 109.985 -176.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.587 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 11.9 t30 -122.07 72.06 1.02 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.692 -175.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -92.56 88.99 6.54 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 9.6 p-90 -99.89 -8.15 24.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.498 -0.773 . . . . 0.0 112.363 -170.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -161.43 144.88 12.68 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.707 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 55' ' ' ARG . 37.2 mtm180 -143.16 124.31 14.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.066 171.511 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.462 ' HA ' ' HA3' ' A' ' 67' ' ' GLY . 5.1 tt -131.05 127.81 39.0 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.439 -169.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -121.41 177.06 5.35 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.121 -175.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.441 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 78.6 p -146.26 174.72 11.09 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.516 ' OD1' ' HB2' ' A' ' 61' ' ' GLU . 4.8 p30 -73.12 166.57 22.86 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 167.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.646 ' HA ' ' HE3' ' A' ' 60' ' ' LYS . 0.3 OUTLIER -76.12 -5.57 47.25 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.026 0.441 . . . . 0.0 111.264 -175.31 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.516 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 6.7 mm-40 -78.89 -32.68 45.93 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 171.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.34 13.39 83.63 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.662 177.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -92.26 -5.53 52.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.861 0.363 . . . . 0.0 111.791 -177.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.41 ' HB3' HD22 ' A' ' 59' ' ' ASN . 15.3 ttm180 -151.2 128.01 10.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.016 177.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.461 ' HB3' HD22 ' A' ' 56' ' ' LEU . 46.6 m95 -115.37 149.57 37.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.368 -176.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -156.11 140.65 16.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.473 -178.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.462 ' HA3' ' HA ' ' A' ' 56' ' ' LEU . . . -175.41 -174.91 42.4 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 119.897 -1.144 . . . . 0.0 112.637 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.7 mttp -117.8 145.25 44.66 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.9 0.381 . . . . 0.0 110.735 -178.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 48.5 t -130.75 127.5 38.89 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.528 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . 0.547 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 7.8 p90 -130.28 132.77 46.07 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.66 -178.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -118.29 143.71 46.38 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 42.8 mm -105.24 116.15 48.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 120.842 0.353 . . . . 0.0 110.829 -175.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -127.47 106.6 9.3 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.415 ' C ' ' H ' ' A' ' 76' ' ' LEU . 5.1 m-20 52.22 58.49 5.37 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.918 0.761 . . . . 0.0 111.247 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.2 mm? 73.34 -22.46 0.23 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.44 176.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.415 ' H ' ' C ' ' A' ' 74' ' ' ASP . 88.5 mt -72.22 118.07 14.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.713 0.292 . . . . 0.0 110.404 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -105.96 135.7 46.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.204 178.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.405 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 7.4 p90 -143.74 114.73 7.81 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.688 179.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.547 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 0.6 OUTLIER -106.09 136.43 45.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.559 177.914 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -117.04 139.19 51.0 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.469 178.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -93.15 115.62 28.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.175 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 pt -127.13 152.34 35.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.483 -178.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.11 161.71 42.22 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.992 0.425 . . . . 0.0 110.303 176.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.551 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 48.0 p90 -160.09 152.06 20.34 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.44 -179.47 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.51 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 7.2 p-10 -100.8 167.91 9.99 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.978 0.418 . . . . 0.0 110.14 178.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.1 mm -109.2 89.5 6.99 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.399 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 37.1 Cg_exo -56.55 164.11 6.05 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 123.095 2.53 . . . . 0.0 112.529 -178.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 35.0 mt -74.36 -10.96 14.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.365 0.603 . . . . 0.0 110.226 -178.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.1 p -80.91 -6.82 59.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.948 176.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.555 ' CG ' ' HA ' ' A' ' 91' ' ' PRO . 51.2 t80 -75.86 144.15 75.78 Favored Pre-proline 0 C--N 1.328 -0.352 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.555 ' HA ' ' CG ' ' A' ' 90' ' ' TYR . 24.2 Cg_endo -94.04 11.82 49.31 Favored 'Cis proline' 0 N--CA 1.458 -0.614 0 C-N-CA 124.244 -1.148 . . . . 0.0 113.937 2.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 19.1 m -65.04 -36.11 83.32 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.175 0.512 . . . . 0.0 110.355 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 49.9 m -113.43 140.56 47.97 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.739 175.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.52 146.24 95.99 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.752 179.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.53 153.91 76.27 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.646 2.231 . . . . 0.0 112.5 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -81.66 90.74 6.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.956 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.551 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 65.3 mt -74.9 119.84 23.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.263 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -107.06 130.75 54.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.787 0.327 . . . . 0.0 111.505 -176.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 19.7 t -130.55 77.27 76.16 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 173.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -66.25 -21.79 54.34 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 123.073 2.515 . . . . 0.0 112.538 -176.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -57.88 -33.33 68.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.894 0.378 . . . . 0.0 111.272 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 87.5 mt -86.72 1.97 50.23 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -173.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.18 -16.14 63.87 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.39 0.614 . . . . 0.0 110.772 -176.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -131.21 26.3 3.96 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.631 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -117.88 -59.33 1.92 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.123 0.487 . . . . 0.0 109.876 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.3 t -108.27 -164.74 0.98 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.438 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -55.43 148.64 14.85 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.14 0.275 . . . . 0.0 110.308 178.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.441 ' HB2' ' HE3' ' A' ' 108' ' ' LYS . 18.9 ptmt -69.35 150.75 46.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.348 0.594 . . . . 0.0 111.312 -173.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 25.3 mmt -88.83 163.55 15.61 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.275 176.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -70.5 -54.46 12.13 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.283 -176.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -161.93 129.19 3.91 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.203 -177.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 85.0 8.14 82.75 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.791 -0.719 . . . . 0.0 113.802 169.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 63.14 24.35 67.06 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.126 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -86.99 149.49 24.73 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 42.9 pt -73.05 146.23 10.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.489 . . . . 0.0 111.362 -175.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 33.8 m -100.02 128.4 46.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.53 -179.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 91.9 mt -120.61 159.8 24.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.535 -178.095 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.0 t -65.0 150.13 48.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.632 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.16 -21.39 59.31 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.25 176.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -66.54 -30.26 70.53 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.945 0.402 . . . . 0.0 110.802 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -68.96 -34.7 75.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.331 -175.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.479 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 50.1 mtpt -58.66 -58.65 17.64 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.752 -174.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.479 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 43.2 Cg_endo -69.06 -31.09 24.39 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.796 1.664 . . . . 0.0 112.075 176.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 55.6 tp -60.42 -49.38 77.79 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.479 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.535 ' O ' HG21 ' A' ' 129' ' ' VAL . 51.2 t-105 -60.03 -56.38 22.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.687 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.05 -24.73 68.05 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -174.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -78.77 -26.11 44.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.961 0.41 . . . . 0.0 110.759 -179.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -96.07 5.4 51.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.042 -177.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.535 HG21 ' O ' ' A' ' 125' ' ' TRP . 86.3 t -96.15 138.11 21.64 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 174.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.498 ' HA ' HG13 ' A' ' 129' ' ' VAL . 63.0 Cg_endo -90.8 -160.92 1.28 Allowed 'Cis proline' 0 C--N 1.347 0.463 0 C-N-CA 124.302 -1.124 . . . . 0.0 113.49 4.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 53.8 mttp 75.09 5.14 4.27 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.999 0.812 . . . . 0.0 111.861 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -90.82 134.66 34.27 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -108.21 155.42 16.2 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.402 -177.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.401 ' H ' ' CD ' ' A' ' 35' ' ' GLU . 52.7 tp -64.34 -37.85 88.97 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 122.824 0.45 . . . . 0.0 111.39 -174.497 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.514 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -54.66 -30.32 55.04 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.393 0.616 . . . . 0.0 111.337 179.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -67.66 -31.26 71.12 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.385 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 58.7 tp -65.15 -35.38 80.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.715 178.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -65.61 -44.8 85.46 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.97 0.414 . . . . 0.0 110.522 176.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -73.61 -41.12 63.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.254 -176.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.0 mt -98.1 -6.94 30.6 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -173.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -129.29 -63.69 0.11 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.174 -1.012 . . . . 0.0 113.203 -177.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.6 tp -57.82 -50.97 71.51 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -175.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.55 -62.0 6.79 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.16 -0.543 . . . . 0.0 113.598 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -58.47 -31.69 94.77 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.498 2.132 . . . . 0.0 113.107 -179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 51.1 t90 -65.9 -50.08 65.75 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.044 0.45 . . . . 0.0 110.033 179.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.11 -37.92 89.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.668 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.25 -14.25 60.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.185 -176.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 96.1 t -105.45 -50.54 8.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.8 0.333 . . . . 0.0 111.689 -179.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -81.68 -32.76 31.62 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -171.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.492 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 38.7 mm -67.2 -54.32 20.23 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -175.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.4 Cg_endo -52.45 -41.02 70.04 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 122.446 2.097 . . . . 0.0 112.8 -178.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . 0.473 ' O ' ' HB2' ' A' ' 156' ' ' LYS . 32.2 t70 -67.89 -37.16 81.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.577 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.458 ' HG ' HG13 ' A' ' 159' ' ' ILE . 30.9 tp -69.62 -31.41 69.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.696 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 150' ' ' ILE . 72.2 mt -67.19 -53.82 29.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.41 176.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -70.42 -15.98 62.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.4 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 152' ' ' ASP . 20.3 ttmm -68.64 -18.18 64.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.921 175.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 87.83 21.32 47.25 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.281 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 51.7 t -99.96 -44.95 11.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.731 0.301 . . . . 0.0 111.115 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . 0.458 HG13 ' HG ' ' A' ' 153' ' ' LEU . 52.2 mt -79.53 93.06 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.378 0.608 . . . . 0.0 110.458 -179.373 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -120.14 86.34 2.55 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.811 178.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -84.99 -34.0 22.46 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.168 -176.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -156.38 152.61 27.76 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.411 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.13 163.19 5.06 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 172.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -48.25 -56.65 7.44 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 123.326 0.391 . . . . 0.0 111.666 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . 0.437 ' C ' ' H ' ' A' ' 167' ' ' GLN . 33.7 m 54.64 43.73 29.73 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.031 0.443 . . . . 0.0 110.607 178.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -75.85 29.25 0.11 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.035 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.437 ' H ' ' C ' ' A' ' 165' ' ' CYS . 1.1 tm0? -74.81 93.04 2.56 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 173.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 83.9 mt -84.96 130.29 34.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.823 -174.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -82.0 135.07 35.4 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.091 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -81.44 112.96 19.17 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.672 177.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -88.11 115.18 25.41 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 35.9 m80 -48.77 -58.01 5.46 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.556 0.535 . . . . 0.0 111.508 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -141.78 125.8 17.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.886 0.375 . . . . 0.0 111.104 176.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 32.4 p-80 -99.88 -30.85 11.8 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 170.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 . . . . . 0 C--O 1.243 0.734 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.827 173.293 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.7 tpp . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 121.079 0.466 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.14 140.14 27.78 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.192 177.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -71.92 125.5 27.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.685 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -64.61 -32.6 74.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.615 -176.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.455 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -69.02 -45.4 70.61 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.875 0.369 . . . . 0.0 110.495 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.462 ' O ' HG23 ' A' ' 10' ' ' VAL . 88.8 m -58.77 -48.39 81.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.384 179.318 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.0 ppt_? -70.08 -20.22 63.22 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.104 -178.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -71.23 -46.09 61.84 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 171.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.463 ' O ' HG13 ' A' ' 13' ' ' ILE . 83.7 t -57.21 -45.05 84.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.419 176.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 6' ' ' THR . 85.6 t -57.73 -43.18 83.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.643 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.4 p -70.29 -20.64 63.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.795 0.331 . . . . 0.0 111.542 -178.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -97.55 0.72 47.94 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.118 0.485 . . . . 0.0 110.584 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 9' ' ' VAL . 60.3 mt -113.74 88.57 14.12 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 115.409 -0.814 . . . . 0.0 108.82 173.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.426 ' HD2' ' HA ' ' A' ' 38' ' ' SER . 78.0 Cg_exo -47.16 141.96 12.37 Favored 'Trans proline' 0 C--O 1.237 0.431 0 C-N-CA 123.605 2.87 . . . . 0.0 113.798 -171.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.7 m -82.61 165.71 2.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.735 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.829 HD21 ' HB3' ' A' ' 35' ' ' GLU . 7.6 mp -101.76 134.89 44.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.97 -176.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -87.81 -34.01 18.42 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.584 0.707 . . . . 0.0 109.64 174.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.523 HG22 ' HB3' ' A' ' 30' ' ' GLN . 19.7 m -110.82 118.78 37.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.233 -177.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.426 ' HA ' ' CG ' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -152.89 136.81 16.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.27 0.557 . . . . 0.0 111.674 176.382 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -157.13 173.15 17.43 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.154 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.0 161.31 52.06 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.211 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.15 3.32 1.68 Allowed 'Trans proline' 0 N--CA 1.473 0.273 0 C-N-CA 123.074 2.516 . . . . 0.0 112.554 -178.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -72.61 -23.83 60.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.864 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -112.24 108.91 18.3 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.503 ' O ' HG22 ' A' ' 29' ' ' VAL . 64.0 mtt180 -69.66 -36.24 75.87 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -173.412 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -71.96 -46.09 58.68 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.091 -175.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.42 -25.88 64.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 64.0 t-105 -69.3 -45.3 69.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.385 176.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.503 HG22 ' O ' ' A' ' 25' ' ' ARG . 73.1 t -60.75 -42.47 92.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 110.718 177.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.523 ' HB3' HG22 ' A' ' 18' ' ' THR . 9.8 tt0 -70.12 -31.82 69.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.135 0.493 . . . . 0.0 110.032 178.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.597 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 2.9 tmt_? -61.44 -40.07 93.13 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 174.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.44 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 6.5 mp -62.43 -41.74 98.93 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.894 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.404 ' HE2' ' HB2' ' A' ' 33' ' ' LYS . 7.7 ptmm? -66.31 -33.3 75.41 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.597 -178.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 21.6 mm-40 -64.6 -51.83 60.65 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.166 0.508 . . . . 0.0 110.385 177.748 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.829 ' HB3' HD21 ' A' ' 16' ' ' LEU . 17.2 pt-20 -75.34 -29.19 59.89 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.503 -176.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -60.36 -43.58 96.39 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 176.481 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -62.04 -38.13 87.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.403 175.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.426 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 8.8 t -62.71 -46.76 86.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.202 176.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.478 HD23 ' HZ ' ' A' ' 54' ' ' PHE . 66.2 mt -60.12 -55.61 31.71 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.083 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 77.9 mt -59.19 -39.21 78.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.15 -176.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.0 tpp180 -63.12 -45.53 91.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.479 -178.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -67.22 -44.55 79.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.956 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 39' ' ' LEU . 93.5 t -61.89 -42.45 94.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.254 178.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -57.67 -49.31 76.92 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.57 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -54.11 -45.36 71.85 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.322 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -77.33 -28.47 53.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.879 0.371 . . . . 0.0 110.67 -177.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.618 ' HB3' ' HZ2' ' A' ' 47' ' ' LYS . 9.9 mtpm? -61.66 -26.58 68.1 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.657 174.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -65.8 -17.62 64.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.932 177.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -99.95 11.0 40.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.211 176.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.4 t70 68.83 15.54 8.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.115 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -120.24 99.75 6.77 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.408 179.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -76.49 124.6 27.82 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 175.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.539 ' HE3' ' HB3' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -63.56 -58.66 6.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.269 -171.433 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.539 ' HB3' ' HE3' ' A' ' 53' ' ' TRP . 35.7 p90 -154.57 161.21 41.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.019 0.438 . . . . 0.0 110.914 -174.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.0 mtt180 -134.0 121.78 22.09 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.527 HD21 ' HB3' ' A' ' 65' ' ' TRP . 5.7 tt -157.3 137.73 12.92 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -167.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.425 ' N ' HD22 ' A' ' 56' ' ' LEU . 17.6 mm-40 -126.16 168.99 13.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.853 0.359 . . . . 0.0 110.391 -175.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.0 t -143.67 172.46 12.79 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.197 -178.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -68.04 173.71 4.38 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.468 174.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -72.91 -27.01 61.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.114 0.483 . . . . 0.0 109.732 177.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -79.64 -14.02 59.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.396 172.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.74 32.59 84.69 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.739 -179.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.4 p -89.28 -29.15 19.4 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -176.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 -130.46 123.49 29.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.527 ' HB3' HD21 ' A' ' 56' ' ' LEU . 47.3 m95 -109.61 132.91 53.7 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.129 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -143.39 139.12 29.84 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.445 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.414 ' HA3' ' HA ' ' A' ' 56' ' ' LEU . . . 172.17 -166.98 39.89 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.118 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.432 ' NZ ' ' HB2' ' A' ' 81' ' ' ASP . 23.0 mtpp -133.65 156.28 48.17 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -178.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.646 ' SG ' ' HB2' ' A' ' 80' ' ' PHE . 5.1 p -118.65 149.64 41.06 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.214 175.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 11.8 m-90 -120.97 138.59 54.07 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -176.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -146.23 120.09 9.31 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.008 0.432 . . . . 0.0 110.332 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 3.6 mp -95.62 127.84 47.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 175.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -130.07 108.35 10.01 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -179.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 64.53 -85.95 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.639 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -123.57 -11.63 7.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.192 -176.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.8 mt -103.27 145.84 29.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.17 0.51 . . . . 0.0 111.64 -174.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.426 ' HE3' ' HB3' ' A' ' 77' ' ' LYS . 1.1 tmmt? -128.52 120.99 27.82 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -132.42 153.12 51.14 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.958 0.409 . . . . 0.0 111.152 -176.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -116.79 139.21 50.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.698 -176.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.646 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . 46.7 m-85 -121.51 117.37 26.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.855 0.36 . . . . 0.0 110.477 175.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.432 ' HB2' ' NZ ' ' A' ' 68' ' ' LYS . 9.6 t70 -83.18 130.86 35.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.082 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.474 HG23 HG23 ' A' ' 99' ' ' VAL . 23.2 pt -133.92 147.47 30.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.946 -177.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -154.75 151.84 29.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.61 176.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.414 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 50.3 p90 -167.93 170.31 10.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.186 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -114.15 166.4 11.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.415 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 46.2 mm -107.12 90.23 5.31 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.696 178.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.33 164.47 17.54 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.86 2.374 . . . . 0.0 112.697 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.1 mm -63.74 -27.35 42.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.892 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.467 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 3.7 p -75.69 -14.02 60.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.998 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.531 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 73.3 t80 -78.11 143.58 65.78 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.531 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.4 Cg_endo -95.63 9.73 45.03 Favored 'Cis proline' 0 C--N 1.35 0.641 0 C-N-CA 124.488 -1.047 . . . . 0.0 113.509 1.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 21.5 m -61.03 -31.02 70.66 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.392 0.615 . . . . 0.0 110.201 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.467 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 22.9 m -126.33 144.3 50.86 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.195 173.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.83 143.95 82.09 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 120.54 0.21 . . . . 0.0 111.2 -178.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -86.73 171.88 6.91 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.993 2.462 . . . . 0.0 112.421 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.776 ' HB3' ' HD3' ' A' ' 114' ' ' LYS . 40.6 mt-10 -101.5 113.53 26.73 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.625 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.414 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 57.7 mt -92.79 141.42 14.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.726 -177.451 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -118.27 140.31 50.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.733 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.474 HG23 HG23 ' A' ' 82' ' ' ILE . 27.6 t -119.57 86.43 34.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.851 0.357 . . . . 0.0 110.288 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.65 -18.51 48.26 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 123.184 2.589 . . . . 0.0 113.138 -175.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.432 ' CB ' ' H ' ' A' ' 81' ' ' ASP . 4.7 tp10 -74.83 -19.0 60.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.036 0.446 . . . . 0.0 110.9 -177.064 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.8 mt -97.66 14.47 26.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.239 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -58.89 131.52 51.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.178 -176.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 61.5 23.73 63.03 Favored Glycine 0 C--N 1.334 0.435 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.51 176.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -133.85 -38.0 0.9 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.984 0.421 . . . . 0.0 110.436 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.534 HG23 ' HE1' ' A' ' 109' ' ' MET . 11.7 t -80.65 172.85 13.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.837 176.871 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -74.1 -154.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.025 0.44 . . . . 0.0 111.054 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.486 ' HZ1' ' HB2' ' A' ' 108' ' ' LYS . 0.6 OUTLIER -70.34 119.93 15.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.011 0.434 . . . . 0.0 110.994 -177.362 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.534 ' HE1' HG23 ' A' ' 106' ' ' THR . 6.9 mmt -87.5 178.14 6.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.975 178.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -92.21 179.71 5.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.363 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -51.85 109.47 0.37 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -175.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 92.32 22.57 29.16 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.974 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 76.48 28.34 59.81 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.366 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.776 ' HD3' ' HB3' ' A' ' 96' ' ' GLU . 53.8 mttp -93.56 156.5 16.7 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.502 HD13 HD22 ' A' ' 117' ' ' LEU . 30.3 pt -74.25 139.11 19.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.041 0.448 . . . . 0.0 111.401 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 18.6 t -94.11 109.06 20.86 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.502 HD22 HD13 ' A' ' 115' ' ' ILE . 96.0 mt -91.19 175.62 6.87 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.23 -177.252 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.514 HG22 ' HB2' ' A' ' 121' ' ' PHE . 4.7 t -71.98 146.2 47.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.904 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.421 ' HA ' ' HE3' ' A' ' 122' ' ' LYS . 13.4 t70 -65.49 -30.26 71.01 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.621 -176.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -80.03 -15.57 56.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.753 -172.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.514 ' HB2' HG22 ' A' ' 118' ' ' THR . 49.1 t80 -70.93 -34.15 71.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.006 -176.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.508 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 42.3 mttt -57.81 -58.67 16.87 Favored Pre-proline 0 CA--C 1.539 0.522 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.085 -176.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.508 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 29.0 Cg_endo -64.37 -34.87 53.04 Favored 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 121.83 1.687 . . . . 0.0 111.976 178.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 42.3 tp -61.62 -45.24 94.92 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.837 0.351 . . . . 0.0 110.349 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.464 ' O ' HG22 ' A' ' 129' ' ' VAL . 57.2 t-105 -59.23 -57.26 13.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.587 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.03 -32.17 71.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.884 -175.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -70.36 -36.56 74.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.903 0.382 . . . . 0.0 111.169 -178.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -89.36 -31.16 17.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.061 -173.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.504 HG11 ' HA ' ' A' ' 130' ' ' PRO . 51.2 t -53.64 138.95 51.05 Favored Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 176.128 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.504 ' HA ' HG11 ' A' ' 129' ' ' VAL . 6.9 Cg_endo -88.59 -151.64 0.52 Allowed 'Cis proline' 0 C--N 1.349 0.591 0 C-N-CA 124.727 -0.947 . . . . 0.0 114.453 6.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.639 ' HB2' ' HZ3' ' A' ' 131' ' ' LYS . 9.4 mtmp? 75.24 36.66 0.5 Allowed 'General case' 0 C--N 1.343 0.309 0 C-N-CA 123.759 0.823 . . . . 0.0 110.427 -172.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -128.01 152.9 47.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.828 -179.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.597 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -146.1 175.17 25.72 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 47.6 tp -58.45 -38.25 77.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 117.355 0.578 . . . . 0.0 111.497 -176.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.12 -43.85 70.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.732 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 29.5 m80 -70.33 -36.61 74.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.682 0.277 . . . . 0.0 110.73 -178.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.75 -50.57 62.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.283 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 21.8 ptm -71.69 -31.67 67.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.55 -175.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -73.22 -45.35 56.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.682 0.277 . . . . 0.0 111.418 -179.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.2 mt -85.72 -15.98 40.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.569 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -98.79 -69.44 0.93 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.433 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' LEU . . . . . 0.58 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 94.9 mt -65.97 -38.69 89.19 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -176.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.32 -62.28 6.15 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 121.086 -0.578 . . . . 0.0 113.352 -177.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -64.4 -31.17 62.38 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.55 2.167 . . . . 0.0 112.414 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 38.3 t90 -62.57 -39.51 93.9 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.009 0.433 . . . . 0.0 110.621 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.612 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 98.7 mt -60.1 -34.52 73.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.876 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.02 -4.89 41.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.759 -176.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 61.4 t -85.47 -56.12 5.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.702 -0.226 . . . . 0.0 111.511 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -107.07 -29.49 9.36 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -172.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.612 ' HB ' ' O ' ' A' ' 146' ' ' LEU . 1.7 mp -57.91 -48.7 96.67 Favored Pre-proline 0 CA--C 1.541 0.622 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -175.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' PRO . . . . . 0.441 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 54.3 Cg_exo -54.59 -37.87 90.65 Favored 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 121.79 1.66 . . . . 0.0 112.346 175.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.31 -44.4 87.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.401 179.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.84 -36.9 80.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.887 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 150' ' ' ILE . 64.9 mt -66.48 -41.18 88.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.816 178.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 151' ' ' PRO . 52.8 mt-30 -62.89 -39.06 93.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.023 0.439 . . . . 0.0 111.326 178.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -85.98 -5.58 59.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.633 -178.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 71.8 38.31 60.78 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.06 -0.591 . . . . 0.0 112.781 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 5.4 t -91.07 4.17 6.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.546 0.689 . . . . 0.0 110.105 -178.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.8 mm -71.48 130.13 35.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.174 179.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -64.04 -34.73 78.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.095 -178.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -78.54 123.4 27.04 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -88.44 -164.21 1.09 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.244 0.545 . . . . 0.0 111.574 -175.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -60.61 162.76 6.1 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.452 179.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -82.67 -13.54 56.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.363 -177.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 43.3 t -68.72 95.55 0.67 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.198 -0.456 . . . . 0.0 109.979 175.045 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.41 177.41 10.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.962 -178.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -85.13 160.84 19.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.208 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -65.9 116.87 7.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.1 178.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -86.36 122.23 30.03 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.826 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -82.14 109.35 16.37 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.73 -9.24 58.37 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.056 0.455 . . . . 0.0 111.176 -175.129 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 33.5 t-80 -147.36 134.15 20.08 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 51.8 m170 -93.94 154.2 17.81 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.023 0.439 . . . . 0.0 110.891 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -101.49 -174.87 2.7 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.566 178.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 79.0 m-70 . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.683 -0.675 . . . . 0.0 109.305 176.051 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.833 0.349 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.462 ' O ' HG23 ' A' ' 10' ' ' VAL . 11.0 m -59.57 -47.41 85.68 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.597 178.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 -67.08 -29.59 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.013 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -60.63 -50.79 72.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.95 0.405 . . . . 0.0 110.067 175.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.37 -42.5 95.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.88 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.5 HG21 HD21 ' A' ' 140' ' ' LEU . 64.7 t -62.52 -32.35 55.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.911 0.386 . . . . 0.0 110.589 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.4 t -69.54 -21.89 63.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.695 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.07 -3.31 54.4 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.06 0.457 . . . . 0.0 110.129 177.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.421 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 42.6 mt -108.35 88.46 4.97 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.57 175.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 10.3 Cg_endo -49.1 147.89 10.43 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 123.588 2.859 . . . . 0.0 113.318 -173.088 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.528 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 29.5 m -79.17 142.36 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.503 178.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.624 HD23 ' HG2' ' A' ' 31' ' ' ARG . 7.3 mp -81.33 134.16 35.53 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HD3' ' H ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -106.23 -4.43 20.19 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.748 -173.921 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.1 m -87.55 -53.98 4.51 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 173.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.8 t30 46.25 81.13 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.52 0 O-C-N 124.037 0.836 . . . . 0.0 112.276 175.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.71 165.43 23.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.946 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -100.67 177.97 28.41 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.938 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.45 5.76 2.21 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 123.399 2.733 . . . . 0.0 113.238 -176.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.526 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 3.4 mmp_? -84.14 -48.0 10.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.828 0.347 . . . . 0.0 110.86 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -91.66 92.59 8.52 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 176.029 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.55 ' O ' HG23 ' A' ' 29' ' ' VAL . 61.4 mtt85 -59.9 -31.26 69.65 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -175.192 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.26 -52.16 60.03 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.603 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 12.3 mt -72.82 -28.57 62.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.716 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.546 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 67.9 t-105 -60.87 -49.54 77.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.463 175.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 25' ' ' ARG . 86.4 t -61.55 -30.5 48.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.927 178.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.439 ' O ' ' HG3' ' A' ' 34' ' ' GLU . 47.7 mt-30 -68.85 -49.94 54.11 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.84 0.352 . . . . 0.0 110.568 175.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.624 ' HG2' HD23 ' A' ' 16' ' ' LEU . 16.3 ttp180 -63.36 -32.16 73.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.063 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -59.47 -48.47 81.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.683 -179.405 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.5 ptpp? -72.16 -34.89 68.83 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.248 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 30' ' ' GLN . 49.3 mt-10 -60.02 -46.92 87.92 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.718 0.77 . . . . 0.0 109.485 174.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -67.02 -42.45 84.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.614 -1.176 . . . . 0.0 111.028 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.24 -45.1 95.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.946 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -60.77 -39.2 87.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.955 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.4 m -62.89 -39.29 94.04 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.348 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.424 ' O ' HG23 ' A' ' 43' ' ' VAL . 96.1 mt -65.34 -47.78 75.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.584 177.546 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.63 -43.32 98.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.681 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.4 tpp180 -56.2 -47.19 78.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.737 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.413 ' HD2' ' HE1' ' A' ' 54' ' ' PHE . 43.1 t80 -65.06 -45.58 84.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.724 -178.589 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.71 HG21 HH21 ' A' ' 55' ' ' ARG . 98.2 t -63.01 -45.16 99.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.107 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -59.94 -50.4 73.92 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.555 0.693 . . . . 0.0 110.137 177.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -53.64 -40.94 66.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.54 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.652 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 91.8 m-20 -68.49 -44.53 74.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.175 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -62.99 -31.9 73.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.284 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -64.24 -36.1 82.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 0.0 110.199 176.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.17 0.43 40.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.859 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.9 t70 74.02 12.12 4.29 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.291 177.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.652 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 5.3 t30 -119.82 92.78 3.87 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.12 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.89 146.86 35.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.692 0.282 . . . . 0.0 110.703 -176.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.779 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -104.94 -68.69 0.84 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -171.556 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.779 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 26.5 p90 -160.65 165.91 29.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.733 0.777 . . . . 0.0 112.923 -165.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.71 HH21 HG21 ' A' ' 43' ' ' VAL . 2.4 mmp_? -131.44 121.84 25.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.641 -1.163 . . . . 0.0 108.898 166.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.514 HD21 HD11 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -134.11 125.32 27.73 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 -177.004 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -131.93 168.77 17.31 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.844 0.354 . . . . 0.0 110.321 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.465 ' OG ' ' HA2' ' A' ' 62' ' ' GLY . 6.3 t -130.48 178.2 6.79 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.31 -0.404 . . . . 0.0 109.948 -175.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -84.43 -177.98 6.78 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.4 ptpp? -60.66 -28.43 68.58 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -93.59 -10.9 33.12 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.592 0.234 . . . . 0.0 111.092 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.465 ' HA2' ' OG ' ' A' ' 58' ' ' SER . . . 71.48 13.31 74.1 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.913 -0.66 . . . . 0.0 113.047 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.8 p -80.64 -15.92 55.36 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -174.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.516 ' HA ' ' HA ' ' A' ' 85' ' ' ASP . 32.1 ttm180 -143.65 122.1 12.41 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 55.3 m95 -103.12 139.03 39.16 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.361 -178.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 p90 -146.0 146.43 30.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.93 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.54 -153.51 21.94 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.836 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.601 ' HG3' ' HZ3' ' A' ' 70' ' ' TRP . 5.5 ptpp? -151.23 143.81 24.31 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.098 0.475 . . . . 0.0 110.987 -178.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 15.9 p -122.79 141.23 52.05 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.561 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.659 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 2.9 p90 -122.7 137.06 55.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.462 0.649 . . . . 0.0 110.877 -178.766 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -117.89 123.27 45.44 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.708 -176.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 34.7 mm -87.59 126.71 41.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.117 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.422 ' HB3' ' HE1' ' A' ' 78' ' ' TYR . 11.8 t60 -140.59 124.76 17.51 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 176.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.443 ' C ' HD22 ' A' ' 75' ' ' LEU . 39.1 t70 68.3 -85.95 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.93 0.769 . . . . 0.0 110.422 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.443 HD22 ' C ' ' A' ' 74' ' ' ASP . 2.2 mm? -142.03 5.62 1.72 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 175.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 82.0 mt -111.47 153.67 25.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.898 0.38 . . . . 0.0 111.116 -172.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -116.68 129.01 55.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.958 176.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.422 ' HE1' ' HB3' ' A' ' 73' ' ' HIS . 43.0 m-85 -115.74 101.21 8.62 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.837 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.659 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 1.1 pm0 -96.2 135.76 37.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.092 0.473 . . . . 0.0 110.926 177.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.404 ' HD1' ' HG2' ' A' ' 101' ' ' GLU . 60.9 m-85 -124.75 138.76 54.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.919 -179.008 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -93.93 124.58 38.03 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.514 HD11 HD21 ' A' ' 56' ' ' LEU . 39.5 pt -130.8 160.32 42.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.927 0.394 . . . . 0.0 111.608 -173.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -154.14 153.39 31.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.398 177.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -172.55 162.31 5.16 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.516 ' HA ' ' HA ' ' A' ' 64' ' ' ARG . 5.6 p-10 -115.64 176.1 5.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.625 0.25 . . . . 0.0 110.504 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.405 HG21 ' CH2' ' A' ' 28' ' ' TRP . 50.6 mm -114.34 89.05 16.62 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.227 -175.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 20.6 Cg_endo -61.05 165.4 12.41 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.596 2.197 . . . . 0.0 112.122 177.203 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 55.6 mt -64.32 -21.84 29.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.256 0.551 . . . . 0.0 110.974 -178.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.16 -20.11 64.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.293 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.656 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 49.6 t80 -88.31 144.51 34.18 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.656 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.2 Cg_endo -95.5 17.67 36.31 Favored 'Cis proline' 0 N--CA 1.459 -0.531 0 C-N-CA 124.495 -1.044 . . . . 0.0 113.822 3.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 10.3 m -65.24 -38.45 90.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.51 0.671 . . . . 0.0 110.186 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -129.18 141.73 51.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.612 175.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.44 144.48 91.78 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.636 -0.257 . . . . 0.0 111.256 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.416 ' HD3' ' CD1' ' A' ' 90' ' ' TYR . 95.2 Cg_endo -92.98 -171.9 0.33 Allowed 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.159 2.572 . . . . 0.0 112.39 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -106.71 123.21 47.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.392 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.86 126.22 41.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.581 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -92.24 117.64 30.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.116 -178.083 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.459 HG22 HG22 ' A' ' 82' ' ' ILE . 25.6 t -119.96 87.24 38.19 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.439 178.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -68.74 -6.5 18.1 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.867 2.378 . . . . 0.0 113.008 -176.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.404 ' HG2' ' HD1' ' A' ' 80' ' ' PHE . 14.6 tp10 -78.87 -43.25 25.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.046 0.45 . . . . 0.0 110.53 178.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.8 HD22 ' HG ' ' A' ' 153' ' ' LEU . 86.7 mt -86.76 -35.11 19.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.977 -175.08 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.0 128.67 38.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.364 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 95.86 -29.36 10.0 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.147 -177.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -92.34 4.59 53.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.914 0.388 . . . . 0.0 111.392 -177.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.9 t . . . . . 0 C--N 1.321 -0.661 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 175.567 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLY . . . . . 0.581 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . . . . . . 0 N--CA 1.448 -0.562 0 CA-C-O 120.246 -0.197 . . . . 0.0 113.079 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -96.51 131.19 43.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.941 0.401 . . . . 0.0 111.652 -173.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 33.3 pt -75.86 170.75 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.688 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 35.1 m -111.14 93.7 4.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.13 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 93.5 mt -74.28 157.32 36.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.722 0.296 . . . . 0.0 110.859 179.07 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.457 HG23 ' HB2' ' A' ' 121' ' ' PHE . 2.6 t -72.37 151.97 42.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.029 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -67.06 -25.38 66.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.601 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -78.56 -20.03 51.51 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.428 -176.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.457 ' HB2' HG23 ' A' ' 118' ' ' THR . 56.3 t80 -71.44 -34.43 70.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.953 -177.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.58 -53.53 63.63 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.009 -176.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.43 ' O ' ' HG3' ' A' ' 127' ' ' ARG . 37.0 Cg_endo -67.47 -34.17 27.07 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.529 1.486 . . . . 0.0 112.227 175.753 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.3 tp -60.35 -45.56 93.06 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.859 0.362 . . . . 0.0 110.462 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.539 ' O ' HG23 ' A' ' 129' ' ' VAL . 41.6 t-105 -59.91 -54.88 40.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.143 177.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.95 -34.68 68.26 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.413 -175.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.43 ' HG3' ' O ' ' A' ' 123' ' ' PRO . 97.0 mtt180 -69.15 -30.12 68.29 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -178.149 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -95.62 -21.8 18.0 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -172.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 125' ' ' TRP . 89.3 t -46.22 129.96 7.58 Favored Pre-proline 0 N--CA 1.473 0.678 0 O-C-N 123.446 0.466 . . . . 0.0 111.542 -178.207 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 129' ' ' VAL . 72.0 Cg_endo -96.72 -120.08 0.0 OUTLIER 'Cis proline' 0 CA--C 1.536 0.59 0 C-N-CA 124.016 -1.243 . . . . 0.0 113.156 2.666 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.528 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 64.8 mttm 67.42 22.37 9.41 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.331 175.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -91.84 -178.95 5.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.587 0.708 . . . . 0.0 112.151 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -178.31 157.71 21.87 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.393 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.6 tp -54.19 -40.24 67.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.792 0.296 . . . . 0.0 111.618 -177.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.43 -38.26 74.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.061 0.458 . . . . 0.0 111.015 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -71.87 -45.85 59.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.161 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.3 tp -59.19 -46.81 87.43 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.343 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' MET . . . . . 0.41 ' HE1' ' CD2' ' A' ' 42' ' ' TYR . 7.8 tmm? -62.38 -47.69 83.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.215 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.75 -38.79 73.51 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -176.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.5 HD21 HG21 ' A' ' 10' ' ' VAL . 95.9 mt -86.87 -17.95 32.09 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -175.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -112.55 -66.63 0.5 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.296 -0.954 . . . . 0.0 113.041 -177.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.603 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 54.9 tp -66.45 -42.85 87.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.664 0.269 . . . . 0.0 111.031 -175.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -51.75 -61.94 6.0 Favored Glycine 0 CA--C 1.523 0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.63 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' PRO . . . . . 0.476 ' O ' HG23 ' A' ' 148' ' ' VAL . 33.9 Cg_endo -65.63 -31.86 49.05 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.314 2.009 . . . . 0.0 112.702 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 33.5 t90 -64.5 -33.74 76.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.694 0.283 . . . . 0.0 111.0 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 90.4 mt -58.55 -40.65 83.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.953 0.406 . . . . 0.0 110.167 177.512 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.0 -2.12 29.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.306 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 144' ' ' PRO . 90.8 t -104.85 -55.19 5.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.529 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -95.74 -32.48 12.71 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -173.09 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.607 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 40.2 mm -56.45 -41.19 89.88 Favored Pre-proline 0 CA--C 1.54 0.565 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -176.182 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.607 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 1.2 Cg_endo -46.18 -40.56 21.59 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 122.395 2.063 . . . . 0.0 112.792 171.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -61.93 -49.31 76.65 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.041 0.448 . . . . 0.0 110.097 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.8 ' HG ' HD22 ' A' ' 102' ' ' LEU . 3.7 mm? -60.52 -42.81 97.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.086 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.94 -53.3 31.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.038 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -65.31 -36.34 83.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.389 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' LYS . . . . . 0.431 ' HB3' ' HZ3' ' A' ' 156' ' ' LYS . 5.8 ttpm? -70.99 -16.53 62.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.986 0.422 . . . . 0.0 110.42 -178.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.71 17.69 63.19 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.333 172.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 29.1 m -87.54 -19.99 7.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.861 0.331 . . . . 0.0 110.969 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.519 HG13 ' HB3' ' A' ' 153' ' ' LEU . 44.5 mt . . . . . 0 C--N 1.328 -0.363 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.491 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 CA--C 1.525 0.009 0 CA-C-O 120.859 0.362 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.2 m -61.12 -42.63 98.88 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.517 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -64.41 -38.35 90.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.442 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -62.97 -40.37 97.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.06 178.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 5' ' ' ALA . 96.3 t -58.53 -47.36 88.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 120.93 0.395 . . . . 0.0 110.448 178.012 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.2 t -67.17 -25.72 34.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.868 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.6 m -81.71 -40.71 22.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.375 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.498 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 34.9 mt-10 -79.1 -12.21 60.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.655 0.264 . . . . 0.0 111.372 -179.188 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.7 mt -105.35 89.76 3.44 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 172.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.498 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 87.8 Cg_exo -45.52 151.2 1.15 Allowed 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 124.058 3.172 . . . . 0.0 114.25 -172.066 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.585 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 20.0 m -86.05 145.21 8.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.716 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.742 HD21 ' HG2' ' A' ' 35' ' ' GLU . 8.2 mp -85.11 134.58 34.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.893 -178.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -82.07 -32.87 30.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.721 0.772 . . . . 0.0 109.545 174.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.494 HG23 HD12 ' A' ' 27' ' ' LEU . 25.4 m -85.03 135.21 34.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.427 -175.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -135.24 93.23 2.96 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.388 178.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -162.42 161.38 27.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.516 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -103.77 -176.61 25.85 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.397 -179.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.51 -6.54 13.86 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 123.454 2.769 . . . . 0.0 113.051 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.438 ' HG3' HG23 ' A' ' 88' ' ' ILE . 45.7 mtp180 -71.31 -24.63 62.16 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.566 0.222 . . . . 0.0 111.239 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -113.83 96.42 5.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.526 ' O ' HG23 ' A' ' 29' ' ' VAL . 87.6 mtm180 -64.44 -32.95 74.78 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -173.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -68.41 -45.53 72.39 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.418 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.494 HD12 HG23 ' A' ' 18' ' ' THR . 4.5 mm? -71.7 -26.95 62.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.208 0.528 . . . . 0.0 110.203 174.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.531 ' HH2' HG21 ' A' ' 86' ' ' ILE . 63.7 t-105 -64.1 -41.84 97.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.297 178.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 25' ' ' ARG . 96.5 t -60.08 -37.84 74.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.158 0.504 . . . . 0.0 110.174 175.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 38.7 mt-30 -67.07 -43.49 82.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.14 178.088 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.469 HH11 ' HG3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -62.41 -30.51 71.27 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.35 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.494 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 2.1 mm? -65.29 -49.45 69.48 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.225 177.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.442 ' HG2' ' HA ' ' A' ' 30' ' ' GLN . 19.7 ptpt -66.37 -38.59 87.92 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 120.826 -0.349 . . . . 0.0 110.961 -178.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.534 ' HB3' ' HG ' ' A' ' 16' ' ' LEU . 26.4 mm-40 -61.88 -51.1 69.57 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.973 0.416 . . . . 0.0 110.392 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.742 ' HG2' HD21 ' A' ' 16' ' ' LEU . 6.0 mm-40 -63.36 -42.06 98.85 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.578 177.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.494 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -58.85 -45.02 91.06 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.281 -178.241 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 84.3 mm-40 -58.99 -43.09 91.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.027 0.442 . . . . 0.0 110.438 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.448 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 18.0 m -66.54 -40.58 89.16 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.763 177.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 35' ' ' GLU . 95.9 mt -62.95 -49.01 76.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.014 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 36' ' ' TYR . 85.8 mt -55.59 -47.44 78.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 O-C-N 123.163 0.289 . . . . 0.0 110.582 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -61.52 -41.07 96.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.375 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.484 ' HE2' ' HZ ' ' A' ' 54' ' ' PHE . 80.0 t80 -72.1 -46.21 57.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.22 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.44 ' O ' ' HG3' ' A' ' 47' ' ' LYS . 85.3 t -62.91 -37.34 78.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.068 0.461 . . . . 0.0 110.295 179.135 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.7 -50.56 70.65 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 175.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -53.72 -48.66 69.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.52 177.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -62.49 -39.36 93.21 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -178.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 32.2 mtmm -68.88 -37.28 78.93 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.312 177.268 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -66.5 -34.91 78.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.713 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -85.86 -1.61 57.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.256 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.9 t70 61.62 29.68 18.3 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.667 0.746 . . . . 0.0 110.48 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -122.9 55.1 1.2 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.575 -175.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -93.7 106.59 18.55 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 65.0 p-90 -125.5 5.16 7.6 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -174.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.484 ' HZ ' ' HE2' ' A' ' 42' ' ' TYR . 19.7 p90 -154.64 147.0 23.91 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.077 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.53 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 23.0 tpt180 -126.57 123.32 37.42 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.575 178.285 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.1 mt -121.52 124.6 44.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.002 0.43 . . . . 0.0 110.112 175.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -134.78 152.37 51.7 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.178 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.6 m -126.23 159.35 33.27 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 120.771 0.32 . . . . 0.0 111.553 -171.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -75.74 173.2 11.41 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -69.14 -12.73 61.94 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -170.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -85.35 -25.53 27.04 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.831 0.348 . . . . 0.0 110.373 175.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.39 17.74 77.85 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.984 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.9 p -83.73 -30.28 26.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.953 0.406 . . . . 0.0 111.757 -177.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 64' ' ' ARG . 50.3 mtp180 -128.72 128.32 43.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.239 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -110.91 126.43 54.71 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.436 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 83' ' ' GLU . 39.7 p90 -136.46 167.05 22.08 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.53 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 168.33 -138.77 5.31 Favored Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.011 -1.09 . . . . 0.0 112.544 178.232 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 81' ' ' ASP . 20.7 ttmm -153.03 134.73 14.53 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -172.561 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 64.5 m -119.67 122.66 42.0 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 174.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.585 ' HB3' ' HG2' ' A' ' 79' ' ' GLU . 41.5 p90 -124.43 129.98 51.65 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.284 0.564 . . . . 0.0 110.399 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -121.01 133.96 55.28 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 -179.244 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 43.3 mm -96.9 121.47 47.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.411 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -147.15 116.87 7.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.035 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 57.24 58.4 3.93 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.918 0.761 . . . . 0.0 111.224 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.1 mt 72.65 -38.64 0.42 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.385 0.674 . . . . 0.0 112.641 175.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.35 137.14 55.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.318 0.58 . . . . 0.0 112.068 -175.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -108.55 102.37 11.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.667 175.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 17.8 p90 -104.6 119.71 39.62 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.185 0.517 . . . . 0.0 110.6 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.585 ' HG2' ' HB3' ' A' ' 70' ' ' TRP . 57.4 mt-10 -105.77 136.44 45.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.328 -178.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -121.25 112.57 18.79 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.507 ' HA ' ' HA ' ' A' ' 68' ' ' LYS . 2.3 m-20 -83.34 112.97 20.39 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 38.2 pt -114.62 173.76 3.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.266 -173.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.456 ' HA ' ' HA ' ' A' ' 66' ' ' PHE . 10.0 pt-20 -162.44 157.71 22.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.785 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.583 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 36.0 p90 -160.91 148.15 15.43 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.084 0.469 . . . . 0.0 111.077 176.307 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -93.34 164.0 13.38 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.831 177.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.531 HG21 ' HH2' ' A' ' 28' ' ' TRP . 39.7 mm -107.45 91.98 7.75 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.631 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 1.3 Cg_endo -40.79 148.22 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 124.181 3.254 . . . . 0.0 113.807 -178.624 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.438 HG23 ' HG3' ' A' ' 23' ' ' ARG . 50.2 mm -58.52 -39.42 75.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.957 -174.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.3 p -83.19 40.5 0.71 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.213 0.53 . . . . 0.0 112.064 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.534 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 25.0 t80 -77.76 147.65 74.75 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.483 177.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.534 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 19.9 Cg_endo -94.76 13.35 44.72 Favored 'Cis proline' 0 N--CA 1.453 -0.856 0 C-N-CA 124.513 -1.036 . . . . 0.0 112.883 -2.234 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 22.5 m -62.28 -35.84 80.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.33 0.586 . . . . 0.0 110.191 178.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.6 m -105.77 119.66 39.71 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.641 173.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -81.41 152.05 69.79 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.528 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.563 ' HG2' HD13 ' A' ' 134' ' ' LEU . 50.9 Cg_exo -55.31 136.47 73.66 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.891 2.394 . . . . 0.0 112.163 174.262 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.486 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 19.9 mt-10 -79.74 -22.68 42.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.201 -173.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.583 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 62.8 mt 65.95 116.24 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-O 121.363 0.601 . . . . 0.0 111.665 -178.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.738 ' HB2' ' HG2' ' A' ' 114' ' ' LYS . . . -119.62 138.38 53.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.357 0.599 . . . . 0.0 111.84 -177.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 16.7 t -124.43 86.18 55.26 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.713 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.91 -21.71 65.6 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.333 2.689 . . . . 0.0 114.138 -172.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.65 -29.81 56.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.208 0.528 . . . . 0.0 110.375 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.482 HD23 ' HD2' ' A' ' 105' ' ' LYS . 75.2 mt -89.92 4.05 51.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.309 -176.41 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -62.26 110.57 1.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 87.02 -2.55 87.08 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.26 -178.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.482 ' HD2' HD23 ' A' ' 102' ' ' LEU . 4.2 ttmp? -101.9 -5.87 24.2 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 121.433 0.635 . . . . 0.0 110.045 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 t . . . . . 0 C--N 1.324 -0.521 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.648 177.941 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.197 0 N-CA-C 112.229 -0.348 . . . . 0.0 112.229 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.738 ' HG2' ' HB2' ' A' ' 98' ' ' ALA . 95.0 mttt -91.8 137.54 32.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 176.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.5 pt -82.13 167.55 2.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.376 0.607 . . . . 0.0 112.32 -168.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 17.6 p -114.27 116.71 29.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.054 176.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.8 mt -85.7 -175.14 5.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.183 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.454 HG22 ' H ' ' A' ' 120' ' ' HIS . 31.5 m -59.86 131.93 52.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.092 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -63.57 -32.33 73.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.82 -177.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.454 ' H ' HG22 ' A' ' 118' ' ' THR . 25.2 m80 -75.18 -22.11 58.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.09 -179.224 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -71.5 -33.57 69.36 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.35 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.434 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 28.1 ttpp -55.69 -56.75 26.46 Favored Pre-proline 0 CA--C 1.542 0.647 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.975 -178.44 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.434 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 36.3 Cg_endo -67.28 -31.28 35.75 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.589 1.526 . . . . 0.0 112.104 175.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 54.5 tp -61.33 -44.8 96.59 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.414 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.549 ' O ' HG23 ' A' ' 129' ' ' VAL . 49.9 t-105 -59.84 -54.61 44.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.309 178.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.12 -16.13 63.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.968 -176.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -86.35 -21.6 27.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.958 0.408 . . . . 0.0 110.591 178.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -110.11 25.61 11.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.972 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.549 HG23 ' O ' ' A' ' 125' ' ' TRP . 87.2 t -102.13 135.23 19.69 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.641 174.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.484 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 88.3 Cg_endo -89.05 -153.33 0.64 Allowed 'Cis proline' 0 N--CA 1.462 -0.344 0 C-N-CA 124.085 -1.215 . . . . 0.0 112.851 1.024 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.585 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 53.5 mtmt 76.28 7.1 3.54 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.836 0.855 . . . . 0.0 111.759 -176.566 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.2 171.25 7.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 173.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -169.94 176.02 43.85 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.43 -0.89 . . . . 0.0 112.244 -174.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.563 HD13 ' HG2' ' A' ' 95' ' ' PRO . 60.9 tp -61.97 -37.09 83.46 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 122.784 0.433 . . . . 0.0 111.49 -174.552 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.54 -39.58 76.93 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.403 0.62 . . . . 0.0 110.591 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -69.93 -36.1 75.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.065 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.501 HD22 ' HD2' ' A' ' 95' ' ' PRO . 57.3 tp -66.42 -53.49 35.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.414 -179.087 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.2 ptt? -62.18 -35.64 79.44 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.522 -175.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.34 -41.76 69.4 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.7 mt -95.61 -12.12 26.15 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -172.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -112.91 -53.9 0.47 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.155 -1.022 . . . . 0.0 113.739 -175.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.501 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 52.0 tp -64.36 -42.54 96.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.715 0.258 . . . . 0.0 111.479 -173.319 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.05 -61.69 7.22 Favored Glycine 0 CA--C 1.522 0.471 0 C-N-CA 121.244 -0.503 . . . . 0.0 113.068 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -58.38 -29.01 86.92 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.733 2.288 . . . . 0.0 113.081 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -66.87 -37.46 84.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.744 0.307 . . . . 0.0 110.818 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 91.8 mt -55.21 -38.13 68.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.316 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.57 -6.11 46.66 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 57.5 t -82.14 -40.1 17.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.734 0.302 . . . . 0.0 111.584 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -125.01 -39.78 2.22 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -173.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.469 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 48.2 mm -55.02 -52.56 70.0 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -169.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.6 Cg_endo -54.27 -33.86 77.38 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.102 1.868 . . . . 0.0 112.921 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.506 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 20.7 t70 -87.14 -29.67 21.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.9 0.381 . . . . 0.0 110.371 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.624 ' HA ' ' HE2' ' A' ' 156' ' ' LYS . 24.2 tp -56.96 -39.65 74.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.589 179.389 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 60.4 mt -64.18 -40.32 88.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.361 176.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -66.93 -34.62 78.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.223 -178.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' LYS . . . . . 0.624 ' HE2' ' HA ' ' A' ' 153' ' ' LEU . 54.4 mttm -55.6 -30.76 61.45 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.087 0.47 . . . . 0.0 110.962 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.88 13.64 71.69 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.688 -0.768 . . . . 0.0 111.756 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 28.7 m -79.7 -17.12 12.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.136 0.494 . . . . 0.0 110.78 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 61.8 mt . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.007 178.343 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.421 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 121.106 0.479 . . . . 0.0 109.856 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 25.0 m -66.94 -43.5 83.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.42 177.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.08 -49.19 78.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.696 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.445 ' HG3' ' N ' ' A' ' 9' ' ' VAL . 12.4 ptm180 -65.44 -45.3 84.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.437 -175.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.445 ' N ' ' HG3' ' A' ' 8' ' ' ARG . 88.4 t -61.73 -43.65 97.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 C-N-CA 121.124 -0.231 . . . . 0.0 111.047 -177.013 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.7 t -63.96 -31.35 52.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.915 0.388 . . . . 0.0 110.696 178.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.1 m -83.18 -17.33 43.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.257 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -93.08 -4.3 52.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.328 0.585 . . . . 0.0 110.095 175.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.1 mt -116.63 89.07 26.82 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.619 176.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -40.67 139.52 1.24 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.058 3.172 . . . . 0.0 113.687 -176.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.599 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.5 m -81.23 151.46 4.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.325 -177.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.6 mp -83.98 169.53 14.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.436 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.405 ' N ' ' HD2' ' A' ' 17' ' ' LYS . 2.6 mptp? -122.64 -48.39 2.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.959 0.409 . . . . 0.0 110.235 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.8 m -84.32 95.54 8.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.407 0.623 . . . . 0.0 110.957 -177.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -89.22 79.46 7.11 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.444 0.64 . . . . 0.0 110.089 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -122.68 168.23 12.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.075 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.53 ' HA3' ' O ' ' A' ' 90' ' ' TYR . . . -125.38 177.89 16.79 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.247 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.551 ' HB2' HG23 ' A' ' 88' ' ' ILE . 18.0 Cg_exo -66.45 -4.46 10.81 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 123.317 2.678 . . . . 0.0 112.959 -175.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.465 ' HD2' HG22 ' A' ' 88' ' ' ILE . 15.0 mmm180 -64.65 -35.44 81.02 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.946 0.403 . . . . 0.0 109.948 174.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -110.25 106.41 15.8 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.59 ' O ' HG23 ' A' ' 29' ' ' VAL . 74.6 mtm180 -61.6 -39.46 91.32 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.807 -173.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -70.02 -47.47 61.97 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.899 0.38 . . . . 0.0 110.958 -175.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 27' ' ' LEU . 4.4 mm? -67.96 -28.43 67.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.373 177.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 59.6 t-105 -64.59 -39.46 93.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.891 174.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.59 HG23 ' O ' ' A' ' 25' ' ' ARG . 72.4 t -55.8 -44.27 76.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.489 175.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -64.46 -50.74 66.31 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.369 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.417 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 22.8 ttt180 -62.47 -36.59 82.95 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.07 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.81 -40.86 69.95 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 178.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.547 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 66.9 mttm -65.86 -44.65 84.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.3 177.181 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -64.71 -41.46 95.97 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.531 -178.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -58.87 -43.33 90.82 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.2 0.524 . . . . 0.0 109.661 175.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -65.74 -31.35 72.3 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.451 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.547 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 28.9 mm-40 -61.01 -47.44 86.45 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.806 0.336 . . . . 0.0 110.419 178.499 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.0 m -63.04 -40.62 98.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.491 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.483 ' O ' HG23 ' A' ' 43' ' ' VAL . 95.7 mt -63.78 -55.43 23.13 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.229 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 97.9 mt -56.63 -43.08 78.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 O-C-N 123.29 0.368 . . . . 0.0 111.267 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.1 tpp85 -57.99 -47.19 83.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.605 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -69.82 -37.69 76.31 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.782 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 39' ' ' LEU . 75.3 t -60.56 -40.24 83.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.878 0.37 . . . . 0.0 110.675 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.591 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 40.7 mt-10 -70.32 -37.86 74.81 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.979 177.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -57.69 -42.61 83.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.426 0.631 . . . . 0.0 109.698 172.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.606 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 1.5 m120 -62.55 -57.56 10.68 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.708 -1.133 . . . . 0.0 112.008 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.591 ' HG2' ' HA ' ' A' ' 44' ' ' GLU . 21.7 ptmt -66.6 -25.64 66.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.483 -175.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -76.42 -21.02 56.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.951 0.405 . . . . 0.0 110.692 176.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -97.95 4.04 49.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.059 175.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.4 t70 60.06 26.38 15.71 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.956 0.884 . . . . 0.0 110.908 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -134.67 87.55 2.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.005 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.606 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 41.9 t0 -83.06 156.71 23.21 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.053 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.566 ' HB3' ' CD2' ' A' ' 54' ' ' PHE . 1.2 m95 -100.25 -56.9 2.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.863 -170.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.566 ' CD2' ' HB3' ' A' ' 53' ' ' TRP . 44.5 p90 -161.51 157.52 25.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.327 0.584 . . . . 0.0 111.87 -172.277 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.449 ' HD2' ' HA ' ' A' ' 55' ' ' ARG . 19.7 tpt180 -108.46 123.72 49.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 168.028 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.0 tp -130.92 124.12 30.41 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.061 0.458 . . . . 0.0 110.683 -173.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -101.9 158.51 16.08 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.465 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.2 m -141.84 149.92 40.93 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.753 0.311 . . . . 0.0 110.687 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.0 p-10 -79.27 169.97 17.33 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 172.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.662 ' HD3' ' H ' ' A' ' 60' ' ' LYS . 1.9 mppt? -63.31 -24.04 67.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.764 0.316 . . . . 0.0 111.534 -175.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -82.0 -22.41 36.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.911 -177.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.25 21.93 79.26 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.783 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.518 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . 15.4 p -99.42 -28.09 13.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.176 0.512 . . . . 0.0 111.182 -177.553 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.733 HH22 ' HB3' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -119.27 109.11 15.44 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.462 -178.399 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.99 ' HB2' ' HB2' ' A' ' 84' ' ' PHE . 27.1 m95 -107.51 140.18 40.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.138 177.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -152.35 142.42 22.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.789 0.328 . . . . 0.0 110.687 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 173.71 -149.82 11.33 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -142.02 138.61 31.95 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.894 0.347 . . . . 0.0 110.596 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.445 ' HA ' ' HB3' ' A' ' 54' ' ' PHE . 49.0 t -122.34 150.93 41.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.008 -178.366 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.722 ' HB3' ' HA ' ' A' ' 79' ' ' GLU . 47.5 p90 -159.9 159.98 33.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.817 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -149.2 139.64 22.44 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 172.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 26.1 mm -84.03 114.4 24.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.011 0.434 . . . . 0.0 110.938 -173.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 35.2 t-80 -127.11 122.19 33.55 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.476 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 62.3 34.07 16.09 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 123.667 0.604 . . . . 0.0 110.075 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.559 ' O ' HD13 ' A' ' 75' ' ' LEU . 1.8 tm? 75.36 -20.03 0.37 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.927 -178.15 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.4 mt -66.2 115.79 6.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.737 0.303 . . . . 0.0 110.86 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -94.34 106.97 18.95 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.478 ' HD1' ' HE1' ' A' ' 80' ' ' PHE . 6.7 p90 -121.8 117.69 27.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.129 0.49 . . . . 0.0 110.432 177.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.722 ' HA ' ' HB3' ' A' ' 70' ' ' TRP . 0.9 OUTLIER -110.72 138.98 46.42 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.867 -177.424 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.478 ' HE1' ' HD1' ' A' ' 78' ' ' TYR . 65.5 m-85 -127.83 129.79 47.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.63 -177.577 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -73.65 125.0 27.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.226 0.536 . . . . 0.0 110.206 174.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.509 HG22 HG13 ' A' ' 99' ' ' VAL . 38.3 pt -127.92 155.34 39.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.659 -175.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.733 ' HB3' HH22 ' A' ' 64' ' ' ARG . 44.7 mt-10 -127.37 163.0 24.98 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.771 175.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.99 ' HB2' ' HB2' ' A' ' 65' ' ' TRP . 93.2 m-85 -134.94 143.32 46.82 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.435 176.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -121.56 137.96 54.51 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.518 ' HB ' ' HA ' ' A' ' 63' ' ' THR . 51.0 mm -108.3 89.38 5.79 Favored Pre-proline 0 C--N 1.312 -1.057 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.463 -178.404 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -56.98 150.31 56.55 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.101 1.867 . . . . 0.0 110.531 175.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.551 HG23 ' HB2' ' A' ' 22' ' ' PRO . 2.1 mt -79.16 1.48 2.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.544 0.688 . . . . 0.0 109.996 -174.404 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.1 p -88.02 -4.94 58.74 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.737 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.717 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 33.5 t80 -65.39 145.51 99.06 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.528 175.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.717 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 98.1 Cg_endo -95.75 5.53 45.67 Favored 'Cis proline' 0 N--CA 1.455 -0.753 0 C-N-CA 124.453 -1.061 . . . . 0.0 113.029 0.161 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 10.2 m -62.13 -33.7 74.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.537 0.684 . . . . 0.0 109.653 178.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.0 m -111.59 135.47 52.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.065 171.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.56 146.16 98.99 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.051 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.534 ' HD3' ' CE1' ' A' ' 90' ' ' TYR . 57.3 Cg_endo -73.74 159.07 46.16 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.54 2.16 . . . . 0.0 111.697 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -104.5 129.8 52.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.187 0.518 . . . . 0.0 111.178 -175.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.499 HD12 HD13 ' A' ' 115' ' ' ILE . 54.4 mt -101.64 123.64 54.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.215 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -113.08 135.0 54.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.115 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.509 HG13 HG22 ' A' ' 82' ' ' ILE . 18.7 t -121.09 87.74 44.21 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-O 120.588 0.233 . . . . 0.0 111.407 -176.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.45 -20.63 71.08 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.993 2.462 . . . . 0.0 112.347 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.41 ' HG2' ' HA ' ' A' ' 80' ' ' PHE . 9.8 tp10 -71.75 -29.03 64.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.204 0.526 . . . . 0.0 110.602 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.0 mt -98.28 -31.43 12.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -50.86 109.64 0.34 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 123.724 0.64 . . . . 0.0 111.554 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 92.23 -36.75 3.57 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.747 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.407 ' HG2' HG11 ' A' ' 158' ' ' VAL . 37.2 ttpt -81.45 -26.55 35.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.081 0.467 . . . . 0.0 111.031 -175.191 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 5.8 t . . . . . 0 C--N 1.325 -0.475 0 CA-C-O 120.838 0.352 . . . . 0.0 110.596 178.745 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.193 0 N-CA-C 112.419 -0.272 . . . . 0.0 112.419 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 97' ' ' ILE . 17.1 ptpt -101.87 158.68 15.95 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.499 HD13 HD12 ' A' ' 97' ' ' ILE . 38.6 pt -72.28 147.98 9.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.958 0.409 . . . . 0.0 111.323 -176.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 2.0 p -97.97 116.98 31.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.523 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 96.7 mt -92.77 158.69 15.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.988 0.423 . . . . 0.0 111.28 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.2 t -87.62 157.39 19.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.207 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.28 -53.35 59.16 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 -172.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -71.59 -10.01 59.11 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -173.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -71.06 -33.96 70.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.928 0.394 . . . . 0.0 110.238 178.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -62.14 -55.39 41.04 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.632 -177.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -62.42 -34.84 75.27 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.584 1.523 . . . . 0.0 111.917 175.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 49.2 tp -59.35 -46.41 88.7 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.368 177.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 57.3 t-105 -59.33 -56.03 27.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.707 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.33 -36.51 82.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.159 -175.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -67.72 -31.89 72.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.301 -177.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -95.96 20.97 9.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.455 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 90.4 t -91.28 137.6 26.11 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 172.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.444 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 97.5 Cg_endo -93.36 -152.88 0.37 Allowed 'Cis proline' 0 N--CA 1.46 -0.493 0 C-N-CA 124.265 -1.139 . . . . 0.0 113.58 2.209 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.599 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 9.6 mtmp? 77.21 -5.96 2.08 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.955 0.902 . . . . 0.0 111.614 -176.138 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -80.74 152.22 28.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.291 174.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.417 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -156.72 179.17 32.74 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.797 -0.716 . . . . 0.0 111.977 -174.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' A' ' 138' ' ' MET . 53.9 tp -64.73 -40.76 95.87 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 122.57 0.348 . . . . 0.0 111.197 -174.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.42 -35.91 76.92 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.499 0.666 . . . . 0.0 110.751 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' HIS . . . . . 0.417 ' HE1' ' HA ' ' A' ' 15' ' ' VAL . 47.7 m80 -71.23 -33.02 69.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.166 178.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 62.0 tp -66.49 -33.81 76.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.321 176.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 134' ' ' LEU . 23.7 mmt -56.87 -55.65 31.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.098 0.475 . . . . 0.0 110.173 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.17 -40.77 82.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.674 -0.693 . . . . 0.0 112.657 -177.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.1 mt -86.36 -28.97 23.31 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -171.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -115.61 -57.13 0.34 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.285 -0.959 . . . . 0.0 113.165 -175.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.496 HD12 HD13 ' A' ' 97' ' ' ILE . 10.2 tt -62.48 -49.51 75.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.64 0.257 . . . . 0.0 111.208 -174.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.25 -61.45 7.38 Favored Glycine 0 CA--C 1.524 0.65 0 CA-C-N 116.178 -0.465 . . . . 0.0 113.49 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.83 -35.77 89.39 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.891 2.394 . . . . 0.0 113.059 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -65.22 -40.93 94.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.613 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 80.1 mt -59.95 -33.58 72.11 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.805 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.73 -13.87 62.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.663 -177.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 44.8 t -103.17 -35.85 3.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.091 0.472 . . . . 0.0 110.641 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -85.71 -51.89 6.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.027 -174.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.561 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 40.8 mm -60.67 -52.11 74.9 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -170.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.561 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 56.2 Cg_exo -53.74 -34.71 75.74 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 122.18 1.92 . . . . 0.0 112.707 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -67.14 -41.03 86.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.595 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 57.8 tp -68.81 -35.72 77.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.082 0.468 . . . . 0.0 110.371 176.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.516 HG12 HD12 ' A' ' 159' ' ' ILE . 77.2 mt -62.4 -48.3 88.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.363 177.324 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -66.01 -26.06 67.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.842 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' LYS . . . . . 0.565 ' HE3' HG21 ' A' ' 158' ' ' VAL . 34.8 ttpt -74.0 -16.03 61.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.987 0.422 . . . . 0.0 110.268 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 83.62 18.32 64.16 Favored Glycine 0 C--O 1.229 -0.164 0 C-N-CA 121.078 -0.582 . . . . 0.0 113.607 172.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' VAL . . . . . 0.565 HG21 ' HE3' ' A' ' 156' ' ' LYS . 41.1 t -88.4 -18.59 8.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.526 0.679 . . . . 0.0 110.751 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.516 HD12 HG12 ' A' ' 154' ' ' ILE . 66.0 mt . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.47 ' HA ' ' NE ' ' A' ' 8' ' ' ARG . . . . . . . . 0 CA--C 1.521 -0.144 0 CA-C-O 120.907 0.384 . . . . 0.0 110.745 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.452 ' O ' HG23 ' A' ' 10' ' ' VAL . 24.8 m -56.62 -49.53 74.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.186 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.6 ptt180 -67.79 -38.24 83.07 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -173.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.47 ' NE ' ' HA ' ' A' ' 5' ' ' ALA . 17.3 ptt180 -71.17 -32.23 68.65 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.535 -177.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 5' ' ' ALA . 79.1 t -68.64 -45.59 81.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 6' ' ' THR . 57.4 t -67.89 -26.5 34.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.891 0.377 . . . . 0.0 110.899 178.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.3 t -70.03 -50.79 37.83 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.741 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.424 ' O ' ' HD2' ' A' ' 41' ' ' ARG . 50.2 mt-10 -83.94 -8.96 59.04 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -176.097 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.416 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 54.0 mt -104.74 88.2 2.16 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 170.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.6 Cg_endo -49.42 146.09 14.83 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.919 3.079 . . . . 0.0 113.657 -170.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.0 m -77.55 160.8 4.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.255 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.505 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 6.1 mp -110.05 148.99 30.65 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.161 -176.314 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -110.24 -20.96 12.47 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 -174.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 32.7 m -88.44 115.86 26.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.771 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -112.49 104.34 12.45 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -151.07 157.94 43.44 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.266 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.17 -177.05 29.04 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.152 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.95 5.68 5.15 Favored 'Trans proline' 0 CA--C 1.531 0.348 0 C-N-CA 122.913 2.409 . . . . 0.0 113.103 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.811 ' HA ' ' HE ' ' A' ' 23' ' ' ARG . 0.4 OUTLIER -92.52 -46.61 7.55 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 177.598 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -80.16 75.9 6.93 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 174.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.591 ' HA ' ' HB3' ' A' ' 28' ' ' TRP . 93.8 mtt180 -71.22 -25.06 62.34 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -168.254 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.602 ' HG3' HD22 ' A' ' 27' ' ' LEU . 7.5 pt-20 -63.53 -35.78 81.61 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.371 171.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.602 HD22 ' HG3' ' A' ' 26' ' ' GLU . 3.8 mm? -81.29 -29.52 34.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.046 0.451 . . . . 0.0 109.954 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.591 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 64.5 t-105 -61.16 -39.18 89.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.445 177.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 25' ' ' ARG . 87.2 t -59.55 -40.96 83.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 121.107 0.479 . . . . 0.0 110.414 175.375 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -66.86 -41.76 86.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.226 0.536 . . . . 0.0 109.678 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.551 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 11.8 tpt180 -62.23 -36.54 82.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.805 176.438 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 61.9 mt -57.8 -54.9 41.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.215 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.47 ' HB2' ' HE3' ' A' ' 33' ' ' LYS . 19.1 ptmt -61.23 -37.02 81.57 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.572 -176.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -59.31 -50.87 72.32 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.133 0.492 . . . . 0.0 110.68 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.452 ' HA ' HD21 ' A' ' 16' ' ' LEU . 8.5 tp10 -65.44 -42.05 92.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.138 -178.677 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.474 ' O ' HG13 ' A' ' 40' ' ' ILE . 23.5 m-85 -60.53 -45.36 94.11 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.165 178.284 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -60.66 -40.63 92.77 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.655 0.264 . . . . 0.0 110.848 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.405 ' HA ' ' HG2' ' A' ' 14' ' ' PRO . 8.3 t -64.73 -46.89 80.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.97 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.497 ' O ' HG23 ' A' ' 43' ' ' VAL . 64.0 mt -56.07 -53.92 51.26 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.293 177.151 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.523 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 82.5 mt -55.98 -40.67 64.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.883 -175.27 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.483 ' HD3' ' O ' ' A' ' 41' ' ' ARG . 0.0 OUTLIER -61.33 -44.34 97.35 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.704 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -65.91 -36.99 84.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.11 178.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 39' ' ' LEU . 94.9 t -64.89 -42.46 94.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.62 177.012 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 42.1 mt-10 -53.51 -56.21 18.9 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 123.315 0.384 . . . . 0.0 111.289 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -52.22 -41.85 63.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.146 0.498 . . . . 0.0 111.075 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.599 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 83.3 m-20 -72.47 -51.07 21.73 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.602 -176.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 31.9 mmmt -59.08 -38.93 80.61 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.557 0.218 . . . . 0.0 111.14 176.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -63.57 -41.46 98.38 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.499 178.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.18 3.69 22.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.865 0.364 . . . . 0.0 110.495 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.1 t70 67.9 9.38 7.1 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.681 0.792 . . . . 0.0 111.23 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.599 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 5.9 t30 -98.78 77.3 2.24 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.77 102.5 0.59 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.386 0.613 . . . . 0.0 109.848 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.574 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -67.04 -57.16 7.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.66 -1.155 . . . . 0.0 112.437 -168.808 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.574 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 37.1 p90 -156.72 161.44 39.82 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.27 0.557 . . . . 0.0 111.152 -171.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.499 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 18.4 tpp85 -121.46 123.42 42.02 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 171.311 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 19.4 tp -124.03 122.68 38.54 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.031 0.443 . . . . 0.0 110.401 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -105.59 156.06 18.61 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.442 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.8 p -135.54 159.72 40.73 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.767 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.406 ' ND2' ' HB3' ' A' ' 64' ' ' ARG . 97.8 m-20 -73.1 176.32 5.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.104 173.374 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -57.56 -43.08 84.21 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.915 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -81.22 -20.47 40.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.718 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.82 25.97 65.93 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.646 -0.787 . . . . 0.0 111.314 -173.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.7 p -85.71 -4.89 59.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.972 0.415 . . . . 0.0 112.014 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.406 ' HB3' ' ND2' ' A' ' 59' ' ' ASN . 56.0 ttt180 -155.95 129.86 8.58 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 -179.232 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -121.22 142.09 50.24 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 -177.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -155.0 160.99 41.48 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 -177.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.499 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 163.68 -160.09 32.83 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.537 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -115.21 147.07 40.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.811 0.339 . . . . 0.0 110.91 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.588 ' SG ' ' HB2' ' A' ' 80' ' ' PHE . 5.3 p -117.49 134.26 55.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.134 172.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.457 ' CD1' ' HG2' ' A' ' 79' ' ' GLU . 13.6 m-90 -114.24 128.65 56.46 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.221 0.534 . . . . 0.0 111.559 -175.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -136.21 120.6 18.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.088 175.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.415 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.7 mp -105.61 123.73 60.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.981 0.419 . . . . 0.0 110.486 -176.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -128.46 108.31 10.44 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.717 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.27 57.69 4.33 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.674 0.609 . . . . 0.0 111.31 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.8 mt 70.11 -0.6 2.72 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.355 -0.839 . . . . 0.0 113.141 175.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 66.5 mt -91.91 113.69 26.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.999 0.428 . . . . 0.0 110.571 177.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.3 tttt -99.95 96.3 7.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.181 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -104.54 125.96 51.18 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.053 0.454 . . . . 0.0 110.182 176.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.457 ' HG2' ' CD1' ' A' ' 70' ' ' TRP . 28.4 mt-10 -106.88 135.41 48.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.186 -174.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.588 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . 84.7 m-85 -120.9 129.97 53.71 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.679 0.276 . . . . 0.0 110.871 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -88.09 121.09 30.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.859 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.403 HG22 HG22 ' A' ' 99' ' ' VAL . 40.1 pt -125.34 157.19 34.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.541 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -158.57 158.99 35.0 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.723 174.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.42 ' CE1' HD21 ' A' ' 134' ' ' LEU . 30.5 p90 -159.14 153.79 24.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.349 177.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.433 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 8.7 p-10 -99.41 166.6 11.1 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.89 -177.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.3 mm -111.95 89.68 12.0 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.201 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.433 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 11.0 Cg_exo -66.02 164.66 26.62 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.551 2.167 . . . . 0.0 112.12 -177.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 58.0 mt -66.49 -22.14 29.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.36 0.6 . . . . 0.0 110.052 177.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -82.23 3.38 27.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.041 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -77.94 142.72 65.17 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -96.23 10.51 41.76 Favored 'Cis proline' 0 N--CA 1.457 -0.645 0 C-N-CA 124.178 -1.176 . . . . 0.0 113.126 -1.25 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.523 ' HA ' HG11 ' A' ' 129' ' ' VAL . 15.9 m -56.51 -35.3 67.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.32 0.581 . . . . 0.0 110.99 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.4 m -130.66 127.62 39.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.886 175.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.4 ' HB2' ' CE2' ' A' ' 125' ' ' TRP . . . -73.38 143.44 82.81 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.824 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -83.63 134.0 6.31 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.69 2.26 . . . . 0.0 112.226 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.625 ' HB2' ' HD2' ' A' ' 114' ' ' LYS . 2.9 mp0 -62.24 132.64 53.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.149 176.079 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.501 ' O ' HG12 ' A' ' 115' ' ' ILE . 57.7 mt -75.64 143.47 13.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.391 -178.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.517 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -107.45 124.1 49.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.792 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.403 HG22 HG22 ' A' ' 82' ' ' ILE . 25.6 t -119.98 87.22 38.25 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.016 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -70.73 6.2 1.74 Allowed 'Trans proline' 0 N--CA 1.474 0.379 0 C-N-CA 123.5 2.8 . . . . 0.0 114.046 -173.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -103.95 -44.03 5.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.836 0.351 . . . . 0.0 110.84 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.826 ' HA ' ' HD3' ' A' ' 105' ' ' LYS . 91.4 mt -83.47 0.33 46.78 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -172.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -64.6 -15.1 60.6 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -171.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -114.8 2.71 23.03 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.56 -0.828 . . . . 0.0 113.633 -177.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.826 ' HD3' ' HA ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -127.96 -20.34 3.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.688 0.744 . . . . 0.0 112.37 -178.466 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.578 HG22 ' O ' ' A' ' 102' ' ' LEU . 7.7 t . . . . . 0 C--N 1.331 -0.238 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.382 173.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLY . . . . . 0.517 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . . . . . . 0 N--CA 1.449 -0.475 0 N-CA-C 112.292 -0.323 . . . . 0.0 112.292 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.625 ' HD2' ' HB2' ' A' ' 96' ' ' GLU . 64.1 mmtt -70.03 111.77 5.94 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 122.422 0.289 . . . . 0.0 110.978 -179.184 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 97' ' ' ILE . 34.9 pt -81.65 164.17 3.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.312 -178.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 53.0 t -99.85 119.89 38.9 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.058 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 96.1 mt -79.17 177.07 9.1 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.859 175.165 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.65 140.18 58.84 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.561 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.09 -46.56 61.83 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -171.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.6 m170 -92.91 -5.93 49.73 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.414 -174.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -71.38 -41.18 69.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.357 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.566 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 79.2 tttt -65.79 -49.89 57.11 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.68 -177.13 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.566 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 34.6 Cg_exo -60.99 -32.15 92.08 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.839 1.693 . . . . 0.0 111.83 175.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 52.3 tp -60.82 -46.98 88.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.984 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.492 ' O ' HG23 ' A' ' 129' ' ' VAL . 17.7 t-105 -54.23 -56.66 16.18 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.565 177.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -58.23 -35.21 71.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.648 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 127' ' ' ARG . 6.1 ttp180 -68.31 -36.31 79.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.066 0.46 . . . . 0.0 110.801 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -79.76 -31.4 40.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.513 -173.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.523 HG11 ' HA ' ' A' ' 92' ' ' THR . 94.8 t -53.5 137.24 51.75 Favored Pre-proline 0 N--CA 1.468 0.433 0 O-C-N 123.394 0.434 . . . . 0.0 110.545 176.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.493 ' HA ' HG13 ' A' ' 129' ' ' VAL . 86.5 Cg_endo -90.43 -147.55 0.28 Allowed 'Cis proline' 0 C--N 1.349 0.572 0 C-N-CA 124.28 -1.133 . . . . 0.0 113.204 5.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 33.1 ttpt 67.5 4.69 3.93 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.409 0.684 . . . . 0.0 111.439 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -101.56 159.96 14.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.789 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.551 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -136.78 158.25 24.07 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.947 -174.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.42 HD21 ' CE1' ' A' ' 84' ' ' PHE . 53.6 tp -63.84 -38.76 92.29 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.23 0.612 . . . . 0.0 111.198 -177.015 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.59 -31.03 56.24 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.407 0.622 . . . . 0.0 111.165 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -71.2 -31.46 67.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.514 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 63.1 tp -61.73 -48.34 81.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.943 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 5.4 mpp? -66.25 -41.03 90.52 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.738 0.304 . . . . 0.0 111.206 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.18 -49.99 44.83 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 87.8 mt -88.86 -21.71 23.54 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -172.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -106.77 -62.58 0.59 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.01 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.501 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 53.9 tp -64.75 -42.15 95.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 -175.026 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.03 -61.87 6.49 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 121.248 -0.501 . . . . 0.0 112.991 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' PRO . . . . . 0.478 ' O ' HG23 ' A' ' 148' ' ' VAL . 48.9 Cg_exo -58.66 -33.84 98.52 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.635 2.223 . . . . 0.0 112.699 176.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 39.9 t90 -59.72 -44.31 93.78 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.994 0.426 . . . . 0.0 110.258 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 76.8 mt -62.75 -37.75 87.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.719 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.9 -11.84 61.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.907 -176.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 144' ' ' PRO . 59.5 t -89.13 -46.66 15.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.787 0.327 . . . . 0.0 110.828 178.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 149' ' ' GLU . . . . . 0.444 ' O ' HD23 ' A' ' 153' ' ' LEU . 59.2 mm-40 -83.8 -43.14 15.72 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -173.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.504 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 1.6 mp -54.21 -50.97 81.63 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -170.273 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.504 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 11.6 Cg_endo -54.91 -34.0 84.31 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 122.108 1.872 . . . . 0.0 113.055 -178.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -87.5 -43.2 12.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.98 0.419 . . . . 0.0 110.75 -177.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 149' ' ' GLU . 4.2 mm? -60.44 -35.58 76.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.639 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.534 ' HA ' ' HB ' ' A' ' 159' ' ' ILE . 67.9 mt -65.25 -40.32 88.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.066 0.46 . . . . 0.0 110.187 175.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -66.14 -34.75 78.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.564 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' LYS . . . . . 0.413 ' HD3' HD13 ' A' ' 153' ' ' LEU . 58.8 mtpt -65.29 -17.93 64.9 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.28 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 81.19 22.03 61.61 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.7 178.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 28.5 m -103.2 -21.16 5.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.855 0.359 . . . . 0.0 110.797 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.534 ' HB ' ' HA ' ' A' ' 154' ' ' ILE . 45.0 mm . . . . . 0 C--N 1.326 -0.417 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 176.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.465 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 120.903 0.383 . . . . 0.0 110.856 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.1 m -58.88 -51.14 71.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.609 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -65.26 -38.07 89.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.702 -174.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.1 ppt_? -75.16 -23.5 57.78 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.247 -177.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 5' ' ' ALA . 76.1 t -75.56 -50.68 22.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.826 0.346 . . . . 0.0 110.217 175.655 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.8 t -62.29 -30.4 48.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.876 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.8 t -64.31 -21.89 66.76 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.386 -178.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -95.98 2.37 53.41 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.975 0.416 . . . . 0.0 110.812 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.462 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 32.1 mt -118.93 88.0 35.1 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.462 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 6.4 Cg_endo -46.76 148.64 3.63 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 124.398 3.399 . . . . 0.0 114.382 -170.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.4 m -83.36 152.88 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.237 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.761 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 6.1 mp -103.21 136.15 43.53 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.382 -175.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.47 ' N ' ' HD2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -94.76 -45.62 7.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.188 0.518 . . . . 0.0 110.779 -173.434 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.44 HG21 ' HB3' ' A' ' 30' ' ' GLN . 0.6 OUTLIER -88.86 83.35 6.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.224 -174.681 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.455 ' OD1' ' HD2' ' A' ' 31' ' ' ARG . 84.9 m-20 -124.62 127.37 47.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.413 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.457 ' HB3' ' HB3' ' A' ' 27' ' ' LEU . . . -140.45 -65.5 0.45 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.866 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 158.85 166.71 18.43 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.873 -0.679 . . . . 0.0 111.694 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.9 -10.87 29.47 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.061 2.508 . . . . 0.0 111.89 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.507 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 4.8 mmp_? -63.63 -44.47 93.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.417 176.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.539 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 10.3 t0 -91.74 111.28 22.73 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 -178.485 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.459 ' O ' HG23 ' A' ' 29' ' ' VAL . 18.1 mtp180 -55.14 -51.28 66.95 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.026 -178.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.77 -44.02 94.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.901 0.381 . . . . 0.0 111.345 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.539 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 4.4 mm? -70.55 -29.39 65.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.204 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.546 ' CH2' HG21 ' A' ' 86' ' ' ILE . 75.6 t-105 -73.99 -42.0 61.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 177.056 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 25' ' ' ARG . 72.1 t -60.97 -42.51 93.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.982 0.42 . . . . 0.0 110.082 176.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.454 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 8.6 mm-40 -62.15 -52.43 63.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.604 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.534 HH12 HD22 ' A' ' 16' ' ' LEU . 1.8 ttt85 -56.62 -39.37 73.49 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.144 0.278 . . . . 0.0 111.338 178.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.523 ' HG ' ' CE2' ' A' ' 36' ' ' TYR . 18.1 tp -57.34 -47.57 81.26 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.773 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -67.5 -38.97 85.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.863 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 6.7 mm-40 -55.76 -50.67 69.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.232 0.539 . . . . 0.0 110.312 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.539 ' HA ' HD21 ' A' ' 16' ' ' LEU . 12.6 tp10 -65.53 -37.85 87.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.424 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.523 ' CE2' ' HG ' ' A' ' 32' ' ' LEU . 10.7 m-85 -59.78 -38.28 81.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.145 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -60.59 -45.12 95.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.993 0.425 . . . . 0.0 110.252 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.7 t -63.77 -47.04 82.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.552 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.436 ' O ' HG23 ' A' ' 43' ' ' VAL . 94.7 mt -58.78 -48.08 82.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.093 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 36' ' ' TYR . 80.0 mt -57.86 -47.14 86.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.778 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -63.43 -40.25 96.67 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.704 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -59.76 -48.87 79.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.524 HG12 ' HE2' ' A' ' 47' ' ' LYS . 94.3 t -59.19 -38.41 74.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.781 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.63 -50.31 74.31 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 173.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.2 -40.47 81.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.918 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.431 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 16.2 m120 -55.72 -55.28 34.14 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.916 176.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.524 ' HE2' HG12 ' A' ' 43' ' ' VAL . 53.8 mttm -66.21 -34.81 78.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.973 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -68.41 -28.32 66.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.704 0.287 . . . . 0.0 111.384 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -93.81 2.16 56.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.754 0.312 . . . . 0.0 110.788 177.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.1 t0 64.24 20.14 12.06 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.827 0.822 . . . . 0.0 110.677 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -118.39 72.96 0.89 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.627 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.431 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 14.8 t70 -91.85 88.81 6.78 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.172 -179.307 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.444 ' HB2' ' O ' ' A' ' 70' ' ' TRP . 24.1 p-90 -117.28 2.95 12.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.986 -173.625 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -119.23 129.88 55.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.498 0.666 . . . . 0.0 112.195 -167.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -140.45 124.23 17.24 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.906 -1.043 . . . . 0.0 108.376 174.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.7 tp -134.49 127.99 32.52 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.764 0.316 . . . . 0.0 110.259 -178.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -128.39 160.42 32.28 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.5 p -142.23 172.72 12.31 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.997 0.427 . . . . 0.0 111.019 -176.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 33.1 p30 -89.66 163.55 15.09 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 168.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.472 ' HB2' ' HE2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -66.27 -21.39 66.28 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -172.825 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -74.38 -25.94 59.8 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.572 175.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.03 22.36 78.0 Favored Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.162 -177.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 26.8 p -89.97 -26.94 20.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.864 0.364 . . . . 0.0 111.336 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.3 mtt180 -127.58 132.99 49.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.034 0.445 . . . . 0.0 110.553 175.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -115.82 128.21 55.65 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.244 175.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.7 p90 -130.4 129.32 42.91 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -131.24 166.84 22.67 Favored Glycine 0 N--CA 1.435 -1.401 0 C-N-CA 119.838 -1.173 . . . . 0.0 113.28 -172.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -124.24 131.23 53.51 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.0 p -128.64 131.6 48.07 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.418 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.444 ' O ' ' HB2' ' A' ' 53' ' ' TRP . 6.7 p90 -133.26 121.47 22.5 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.261 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.435 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 14.5 t80 -117.82 129.44 55.66 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.896 -172.354 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.449 ' N ' HD12 ' A' ' 72' ' ' ILE . 4.0 mp -93.83 113.79 29.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -138.21 118.68 13.83 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.653 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 56.79 45.21 22.09 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.58 0.55 . . . . 0.0 110.84 -176.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.407 HD13 ' HA ' ' A' ' 75' ' ' LEU . 4.4 mm? 67.26 4.74 3.83 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.479 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 99.2 mt -96.96 113.14 24.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.106 0.479 . . . . 0.0 110.126 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -96.44 93.47 6.84 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.32 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.435 ' CE1' ' HB3' ' A' ' 71' ' ' TYR . 14.2 p90 -99.66 150.13 22.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.597 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -124.37 136.27 53.95 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.499 -174.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.412 ' HD1' ' HG2' ' A' ' 101' ' ' GLU . 96.4 m-85 -133.5 137.96 45.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.948 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -102.75 137.1 41.41 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.011 0.434 . . . . 0.0 110.051 176.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 99' ' ' VAL . 40.8 pt -136.41 158.16 37.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.396 -176.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -155.79 156.4 34.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.245 0.545 . . . . 0.0 110.829 175.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.589 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 42.4 p90 -155.46 149.81 25.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.23 177.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -102.36 163.52 12.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.503 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.546 HG21 ' CH2' ' A' ' 28' ' ' TRP . 50.8 mm -105.66 91.49 5.12 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.189 -178.278 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.04 164.01 10.86 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.677 2.251 . . . . 0.0 112.798 -179.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 73.4 mt -66.33 -33.39 63.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.196 -177.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.9 p -85.19 17.57 2.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.25 0.548 . . . . 0.0 111.64 -176.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.502 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 69.0 t80 -79.15 143.4 60.86 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 176.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.502 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.4 Cg_endo -96.7 14.74 36.42 Favored 'Cis proline' 0 N--CA 1.459 -0.509 0 C-N-CA 124.497 -1.043 . . . . 0.0 113.689 2.126 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.5 m -65.57 -26.93 68.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.543 0.687 . . . . 0.0 109.972 178.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.3 m -114.01 131.57 56.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.543 172.12 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -70.73 144.92 91.6 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.804 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 5.7 Cg_exo -72.8 143.41 37.14 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.8 2.334 . . . . 0.0 112.307 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.499 ' HB3' ' HD3' ' A' ' 114' ' ' LYS . 48.0 mt-10 -86.63 101.17 13.0 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.993 0.425 . . . . 0.0 110.046 179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.589 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 61.6 mt -74.35 125.42 33.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.781 -178.127 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -105.58 134.14 49.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.54 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.525 HG22 HG22 ' A' ' 82' ' ' ILE . 42.5 t -127.78 86.84 57.33 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.54 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.04 -24.53 73.93 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.861 2.374 . . . . 0.0 112.664 -175.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.412 ' HG2' ' HD1' ' A' ' 80' ' ' PHE . 10.4 tp10 -63.58 -38.9 92.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.574 176.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 98.7 mt -108.99 34.16 3.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.312 -177.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -63.01 -16.98 61.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.03 -175.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -171.74 30.17 0.12 Allowed Glycine 0 C--N 1.314 -0.65 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.145 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -100.08 8.2 44.11 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -175.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.2 t . . . . . 0 C--N 1.324 -0.507 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 174.994 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.208 0 N-CA-C 112.302 -0.319 . . . . 0.0 112.302 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.499 ' HD3' ' HB3' ' A' ' 96' ' ' GLU . 59.4 mttp -109.36 139.18 44.64 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 35.4 pt -68.02 146.69 12.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.149 0.499 . . . . 0.0 112.314 -173.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.2 t -104.53 100.07 9.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.885 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 97.3 mt -88.16 171.84 9.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.334 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 10.2 t -64.83 142.07 58.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.795 0.331 . . . . 0.0 110.161 178.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -65.42 -25.09 67.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.521 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -79.93 -6.67 57.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.734 0.302 . . . . 0.0 111.61 -177.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -71.71 -36.44 70.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.707 0.289 . . . . 0.0 110.529 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.453 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 99.8 mttt -68.21 -50.51 29.46 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.987 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 10.3 Cg_endo -55.29 -37.81 94.2 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 121.932 1.755 . . . . 0.0 111.88 172.382 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.77 -46.05 87.01 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.721 0.296 . . . . 0.0 110.27 176.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.58 ' O ' HG23 ' A' ' 129' ' ' VAL . 17.9 t-105 -53.16 -57.6 9.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.624 176.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.43 -27.35 68.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.647 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 -74.44 -25.29 59.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.958 0.409 . . . . 0.0 110.945 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -104.01 15.12 29.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.858 -175.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 125' ' ' TRP . 95.9 t -98.57 137.26 20.63 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.434 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 82.0 Cg_endo -89.98 -158.25 1.02 Allowed 'Cis proline' 0 N--CA 1.46 -0.473 0 C-N-CA 123.871 -1.304 . . . . 0.0 113.243 -0.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.761 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 57.8 mttp 75.51 0.79 3.5 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.898 0.879 . . . . 0.0 111.73 -174.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -79.08 169.77 17.68 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -149.32 160.48 28.45 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.652 -176.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' A' ' 137' ' ' LEU . 49.3 tp -69.85 -38.45 76.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 122.678 0.391 . . . . 0.0 110.368 -177.626 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.9 -30.82 64.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.246 0.546 . . . . 0.0 110.809 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -70.38 -31.9 69.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.45 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.424 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 49.5 tp -60.52 -51.96 67.22 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.137 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 5.4 mpp? -67.19 -33.61 75.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.732 0.301 . . . . 0.0 111.141 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.7 -48.39 47.68 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.976 -178.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 84.5 mt -97.97 -2.94 39.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -173.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -119.13 -64.82 0.29 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.316 -0.945 . . . . 0.0 112.586 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.473 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 52.6 tp -62.3 -51.86 66.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.47 0.176 . . . . 0.0 111.37 -176.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -50.7 -61.07 6.32 Favored Glycine 0 CA--C 1.523 0.581 0 CA-C-N 116.181 -0.463 . . . . 0.0 113.298 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' PRO . . . . . 0.569 ' O ' HG23 ' A' ' 148' ' ' VAL . 72.6 Cg_exo -53.49 -40.42 78.79 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.724 2.283 . . . . 0.0 112.73 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -63.47 -41.82 98.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.709 0.29 . . . . 0.0 110.616 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.494 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 89.7 mt -59.99 -39.28 85.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.091 0.472 . . . . 0.0 110.092 176.625 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.63 -18.66 64.34 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.736 -179.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 144' ' ' PRO . 86.4 t -71.61 -56.68 9.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -175.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -134.5 0.53 3.04 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -172.447 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.582 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 33.4 mm -68.2 -52.18 23.22 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.157 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.582 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 38.2 Cg_exo -61.42 -29.36 85.24 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.734 1.623 . . . . 0.0 111.516 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -69.84 -40.98 75.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.008 178.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.537 HD23 HD11 ' A' ' 159' ' ' ILE . 24.7 tp -68.11 -30.93 70.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.499 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 150' ' ' ILE . 74.3 mt -62.14 -44.86 99.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.073 0.463 . . . . 0.0 110.077 175.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 54.3 tp60 -69.16 -14.66 63.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.081 -178.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' LYS . . . . . 0.559 ' HE2' ' HA ' ' A' ' 156' ' ' LYS . 11.2 mmpt? -68.3 -20.94 64.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.95 0.405 . . . . 0.0 110.228 174.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 88.96 13.15 62.75 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.722 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 27.5 m -100.11 -16.31 7.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.844 0.354 . . . . 0.0 111.645 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.537 HD11 HD23 ' A' ' 153' ' ' LEU . 55.6 mt . . . . . 0 C--N 1.327 -0.38 0 CA-C-O 121.12 0.486 . . . . 0.0 110.391 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.485 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 120.608 0.242 . . . . 0.0 110.625 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.513 ' O ' HG23 ' A' ' 10' ' ' VAL . 17.4 m -57.43 -48.63 78.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.59 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.417 ' HA ' ' HD3' ' A' ' 7' ' ' ARG . 24.0 mmt180 -64.11 -38.98 93.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.79 0.328 . . . . 0.0 110.658 -178.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 8' ' ' ARG . 44.5 ttp180 -65.2 -40.02 93.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.286 177.171 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 5' ' ' ALA . 52.3 t -63.96 -44.14 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.04 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 6' ' ' THR . 46.7 t -68.38 -20.15 25.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 121.103 0.478 . . . . 0.0 110.613 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.1 m -81.54 -47.61 12.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.786 176.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -69.85 -27.88 65.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.896 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.608 HG23 ' HB2' ' A' ' 38' ' ' SER . 39.6 mt -106.56 88.67 3.54 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.827 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -65.69 179.32 1.77 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.981 2.454 . . . . 0.0 113.109 -174.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.592 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.8 m -88.85 162.98 2.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.102 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.812 HD21 ' HB3' ' A' ' 35' ' ' GLU . 9.1 mp -92.07 156.09 17.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.448 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -71.45 -33.06 69.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.151 0.5 . . . . 0.0 110.267 178.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.567 HG23 ' HB3' ' A' ' 31' ' ' ARG . 3.0 t -146.74 152.36 38.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.629 -176.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -132.1 36.32 3.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.084 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.63 149.48 48.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.439 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.38 176.78 54.58 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.327 -179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.8 -3.44 6.88 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.364 2.709 . . . . 0.0 112.587 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.546 ' HD2' HG22 ' A' ' 88' ' ' ILE . 0.3 OUTLIER -64.11 -29.5 70.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.7 176.944 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -109.33 110.55 21.74 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 57.9 mtp85 -56.61 -51.59 68.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.647 -174.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -65.6 -52.82 49.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.68 0.276 . . . . 0.0 111.197 -174.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.502 HD12 HG21 ' A' ' 18' ' ' THR . 4.4 mm? -63.67 -33.42 75.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.002 -177.431 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.467 ' CZ2' HG21 ' A' ' 86' ' ' ILE . 63.7 t-105 -63.19 -52.05 63.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.633 176.595 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.6 t -64.7 -34.34 69.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.975 0.417 . . . . 0.0 110.662 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -71.58 -44.48 64.42 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.053 -178.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.567 ' HB3' HG23 ' A' ' 18' ' ' THR . 6.8 ptm180 -68.37 -28.54 67.2 Favored 'General case' 0 CA--C 1.523 -0.095 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -43.72 76.08 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.046 174.608 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -67.51 -40.48 85.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.536 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -61.12 -45.05 96.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.233 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.812 ' HB3' HD21 ' A' ' 16' ' ' LEU . 22.0 pt-20 -77.41 -29.29 52.99 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.953 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.491 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.0 OUTLIER -57.35 -47.1 82.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.92 0.39 . . . . 0.0 110.404 171.747 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -63.98 -37.92 89.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.732 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.608 ' HB2' HG23 ' A' ' 13' ' ' ILE . 0.6 OUTLIER -72.18 -31.38 65.86 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.732 177.068 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 56.9 mt -62.28 -49.28 76.3 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 170.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.3 mt -58.32 -40.66 78.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.837 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.432 ' HA ' ' NE ' ' A' ' 41' ' ' ARG . 4.5 mmp_? -53.42 -52.54 59.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.75 0.31 . . . . 0.0 111.192 176.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -63.16 -47.2 83.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.697 -177.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.8 t -62.67 -41.38 92.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.546 ' OE2' ' HD3' ' A' ' 47' ' ' LYS . 6.7 tp10 -61.72 -51.34 68.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.354 0.597 . . . . 0.0 110.318 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -59.31 -39.45 83.1 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.89 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -66.9 -47.42 71.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.573 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.546 ' HD3' ' OE2' ' A' ' 44' ' ' GLU . 22.8 ptmt -66.59 -28.75 68.75 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.207 -0.197 . . . . 0.0 110.887 -178.053 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -71.98 -24.72 61.63 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.245 0.545 . . . . 0.0 110.302 176.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -88.17 7.06 33.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.266 176.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.7 t70 72.81 3.87 4.81 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.469 176.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 -117.81 86.11 2.46 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.129 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.27 136.07 51.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.088 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -88.79 -78.78 0.33 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.906 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -150.95 171.25 17.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.124 0.488 . . . . 0.0 111.453 -170.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 -132.48 124.05 27.81 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.043 172.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.0 mt -126.69 127.12 44.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.94 0.4 . . . . 0.0 111.378 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -133.22 163.32 29.55 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.354 173.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -129.54 166.72 19.11 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.737 0.303 . . . . 0.0 110.738 -173.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.494 ' HB3' ' OE1' ' A' ' 61' ' ' GLU . 4.3 m-20 -58.71 159.71 6.42 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 167.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -67.19 -17.94 65.04 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 -177.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.494 ' OE1' ' HB3' ' A' ' 59' ' ' ASN . 1.4 mp0 -85.78 -17.66 35.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.021 0.438 . . . . 0.0 110.519 174.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.03 11.55 83.89 Favored Glycine 0 C--O 1.227 -0.311 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.542 -177.329 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.4 p -77.37 -36.7 53.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.884 0.373 . . . . 0.0 111.808 -177.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.7 mtt180 -123.07 144.22 49.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.095 0.474 . . . . 0.0 110.857 175.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.97 ' HB2' ' HB2' ' A' ' 84' ' ' PHE . 22.8 m95 -118.89 150.33 40.05 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.196 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -154.12 150.61 28.34 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 174.27 -165.1 36.5 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.297 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -138.29 142.3 39.8 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.461 ' SG ' HD13 ' A' ' 82' ' ' ILE . 78.1 m -115.9 129.63 56.49 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.065 177.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.64 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 28.9 m-90 -100.5 125.85 46.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.949 0.404 . . . . 0.0 109.963 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 38.5 t80 -117.37 120.32 37.81 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.131 0.491 . . . . 0.0 110.367 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 50.8 mm -94.9 118.44 41.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.7 178.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 10.2 t60 -141.56 121.43 13.57 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.69 41.49 15.01 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.465 0.65 . . . . 0.0 110.156 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.8 mt 71.92 -4.89 1.83 Allowed 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.214 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.7 mt -91.95 144.6 25.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.666 0.27 . . . . 0.0 110.762 -177.031 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -109.34 117.42 34.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.508 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -130.28 128.68 42.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.782 0.325 . . . . 0.0 110.14 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.64 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 9.6 pt-20 -102.29 145.24 29.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.158 -177.614 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -123.48 135.78 54.24 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.874 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -92.14 129.82 38.0 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.803 -178.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.523 HG22 HG22 ' A' ' 99' ' ' VAL . 42.5 pt -126.78 149.58 31.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.734 -174.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -131.15 163.44 27.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.981 174.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.97 ' HB2' ' HB2' ' A' ' 65' ' ' TRP . 44.9 m-85 -150.11 148.66 29.25 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.854 -179.382 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -129.85 148.13 51.69 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 169.309 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.467 HG21 ' CZ2' ' A' ' 28' ' ' TRP . 47.9 mm -109.68 91.7 10.94 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -172.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 15.0 Cg_endo -56.19 159.02 13.48 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.533 2.155 . . . . 0.0 111.715 174.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.546 HG22 ' HD2' ' A' ' 23' ' ' ARG . 23.3 mm -71.99 -14.58 17.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.373 0.606 . . . . 0.0 110.702 -175.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.2 p -89.69 1.98 55.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.634 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.6 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 65.6 t80 -80.62 146.87 61.73 Favored Pre-proline 0 C--N 1.328 -0.336 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 176.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.6 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 85.1 Cg_endo -95.18 16.41 39.24 Favored 'Cis proline' 0 C--N 1.351 0.671 0 C-N-CA 124.519 -1.034 . . . . 0.0 113.608 1.12 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -64.04 -37.06 86.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.591 0.71 . . . . 0.0 109.586 176.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.4 m -111.16 124.73 52.78 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.799 176.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -71.58 144.43 88.73 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.811 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -89.48 -164.44 0.16 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.907 2.405 . . . . 0.0 112.04 177.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -123.89 127.15 47.59 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.064 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.6 HG12 ' CZ ' ' A' ' 84' ' ' PHE . 47.6 mt -66.05 115.76 4.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -89.54 112.38 23.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.026 -176.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.523 HG22 HG22 ' A' ' 82' ' ' ILE . 34.0 t -125.28 85.34 58.45 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.804 176.799 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -73.58 -9.62 22.91 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.795 2.33 . . . . 0.0 112.59 -175.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -73.68 -43.13 60.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.398 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.409 ' O ' HG22 ' A' ' 106' ' ' THR . 90.3 mt -82.36 -30.19 30.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.836 -178.474 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.502 ' HB2' ' HA2' ' A' ' 113' ' ' GLY . 16.6 t70 -53.66 124.91 16.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.949 178.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 106.37 -27.25 17.55 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.214 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.796 ' HG2' HG11 ' A' ' 158' ' ' VAL . 10.5 mptt -101.25 -42.4 6.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.016 0.436 . . . . 0.0 110.424 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.572 ' HB ' HD21 ' A' ' 153' ' ' LEU . 5.7 t . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.386 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLY . . . . . 0.502 ' HA2' ' HB2' ' A' ' 103' ' ' ASP . . . . . . . . 0 N--CA 1.448 -0.52 0 CA-C-O 120.408 -0.106 . . . . 0.0 113.014 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.16 136.91 43.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.901 0.381 . . . . 0.0 111.056 -178.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 43.4 pt -69.19 162.18 3.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.878 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 53.1 t -113.63 105.32 13.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.847 0.356 . . . . 0.0 110.345 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.1 mt -93.74 -178.33 4.65 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.842 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.8 t -85.14 158.81 20.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.002 -176.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -75.32 -12.88 60.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.069 0.462 . . . . 0.0 110.741 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -80.79 -12.26 59.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.264 0.554 . . . . 0.0 110.201 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -70.75 -45.18 65.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.346 -172.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.45 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 14.7 mmmm -60.53 -52.23 74.26 Favored Pre-proline 0 C--O 1.236 0.392 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -175.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 26.5 Cg_endo -63.85 -31.87 67.31 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 121.769 1.646 . . . . 0.0 112.205 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 47.4 tp -66.1 -45.09 82.42 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.9 0.381 . . . . 0.0 110.171 177.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 41.8 t-105 -56.88 -49.3 75.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.482 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.14 -21.85 65.81 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.727 -176.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -84.64 -35.16 22.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.125 0.488 . . . . 0.0 110.3 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -73.85 -42.43 60.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.076 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.571 HG13 ' HA ' ' A' ' 130' ' ' PRO . 98.7 t -60.28 141.07 91.25 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.571 ' HA ' HG13 ' A' ' 129' ' ' VAL . 65.6 Cg_endo -84.29 -159.47 1.82 Allowed 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 124.909 -0.871 . . . . 0.0 114.061 6.49 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.592 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 73.7 mmtt 71.36 11.25 6.7 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.631 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -94.65 163.27 13.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.208 0.528 . . . . 0.0 111.742 -171.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -159.43 162.63 32.98 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.064 -0.814 . . . . 0.0 111.064 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.7 tp -60.39 -29.14 68.75 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -173.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.13 -39.12 66.19 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.187 0.518 . . . . 0.0 111.781 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.0 m80 -71.47 -32.48 68.34 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.95 -178.031 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 49.3 tp -63.28 -44.05 96.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 110.746 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 14.4 mmt -64.11 -52.69 57.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.512 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.08 -34.16 77.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.548 -175.106 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.1 mt -98.39 -17.9 18.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -174.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -111.72 -64.04 0.49 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.981 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 38.5 tp -63.16 -41.31 99.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 -171.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.95 -61.79 6.98 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.084 -179.085 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -58.74 -28.69 87.46 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.766 2.311 . . . . 0.0 112.908 177.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 64.7 t90 -72.05 -45.64 60.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.052 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 96.7 mt -60.16 -34.99 74.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.079 0.466 . . . . 0.0 111.16 -178.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.23 -2.81 20.29 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.989 -176.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 60.5 t -92.82 -55.28 6.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -109.82 -12.49 14.59 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -170.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.586 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 1.4 mp -55.58 -45.52 99.86 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.689 178.307 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 11.0 Cg_endo -55.77 -32.36 84.07 Favored 'Trans proline' 0 C--N 1.357 1.02 0 C-N-CA 122.026 1.817 . . . . 0.0 112.73 174.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.604 ' HA ' ' HG2' ' A' ' 155' ' ' GLN . 31.6 t70 -71.29 -36.48 71.68 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 120.589 0.233 . . . . 0.0 110.645 -179.139 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.572 HD21 ' HB ' ' A' ' 106' ' ' THR . 4.3 mm? -65.7 -31.63 72.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.9 0.381 . . . . 0.0 110.362 176.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 66.0 mt -72.51 -47.11 53.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.616 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.604 ' HG2' ' HA ' ' A' ' 152' ' ' ASP . 13.3 pt20 -71.16 -20.84 62.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.805 0.336 . . . . 0.0 110.723 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -72.68 -32.39 65.77 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.105 0.479 . . . . 0.0 109.762 175.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 99.58 10.08 48.29 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.176 177.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' VAL . . . . . 0.796 HG11 ' HG2' ' A' ' 105' ' ' LYS . 42.1 t -91.62 -14.06 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.356 0.598 . . . . 0.0 110.485 -178.198 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.401 HG12 ' HB3' ' A' ' 153' ' ' LEU . 37.4 mm . . . . . 0 C--N 1.323 -0.548 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.139 176.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.478 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 120.813 0.34 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.426 ' O ' HG23 ' A' ' 10' ' ' VAL . 7.4 m -58.53 -50.38 73.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.979 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -72.92 -25.28 60.99 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.042 -0.263 . . . . 0.0 111.136 -177.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -69.98 -43.74 70.83 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 5' ' ' ALA . 73.8 t -58.37 -44.99 89.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.613 177.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 6' ' ' THR . 50.5 t -67.04 -24.21 31.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.183 0.516 . . . . 0.0 110.815 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t -80.01 -43.1 22.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.657 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.595 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 42.5 mt-10 -75.45 -27.27 58.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.844 0.354 . . . . 0.0 110.94 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 47.9 mt -104.92 89.19 2.73 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.235 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.595 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 33.1 Cg_exo -59.23 165.06 9.55 Favored 'Trans proline' 0 N--CA 1.475 0.385 0 C-N-CA 123.538 2.826 . . . . 0.0 113.811 -173.102 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.474 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 30.3 m -83.59 162.42 3.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.166 178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.569 HD21 ' HB2' ' A' ' 35' ' ' GLU . 7.0 mp -93.44 134.55 35.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.407 177.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -36.61 74.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.702 0.287 . . . . 0.0 111.293 -176.24 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.46 ' O ' ' HG3' ' A' ' 31' ' ' ARG . 6.2 p -107.61 139.67 41.8 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.725 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -132.56 77.11 1.73 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.409 0.623 . . . . 0.0 109.547 176.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -115.86 174.68 5.9 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.276 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.29 -179.69 23.15 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.331 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -69.29 2.39 3.31 Favored 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 123.015 2.477 . . . . 0.0 112.847 -178.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.403 ' HD2' HG23 ' A' ' 88' ' ' ILE . 26.3 mtp-105 -74.76 -44.68 48.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.617 0.722 . . . . 0.0 109.775 176.272 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.54 ' HB3' HD23 ' A' ' 27' ' ' LEU . 11.8 m-20 -94.62 101.54 13.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.653 -1.158 . . . . 0.0 109.925 -174.461 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.565 ' O ' HG23 ' A' ' 29' ' ' VAL . 60.2 mtm180 -57.63 -52.84 63.76 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -170.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.6 -41.6 92.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.049 0.452 . . . . 0.0 110.902 -175.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.54 HD23 ' HB3' ' A' ' 24' ' ' ASP . 3.3 mm? -67.63 -34.46 77.02 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.976 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.588 ' CH2' HG21 ' A' ' 86' ' ' ILE . 76.4 t-105 -67.66 -43.35 80.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.406 177.049 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 25' ' ' ARG . 84.1 t -61.09 -47.21 94.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 O-C-N 123.186 0.304 . . . . 0.0 111.501 -178.308 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.491 ' HA ' ' HG2' ' A' ' 33' ' ' LYS . 3.8 pt20 -72.03 -32.49 67.17 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.72 -178.584 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 18' ' ' THR . 18.8 ttp85 -66.22 -39.8 89.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.55 0.691 . . . . 0.0 109.301 174.637 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -63.69 -47.69 80.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.192 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.491 ' HG2' ' HA ' ' A' ' 30' ' ' GLN . 19.4 ptpt -64.38 -38.42 90.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.672 0.272 . . . . 0.0 111.204 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 12.7 mm-40 -69.54 -32.52 71.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.018 0.437 . . . . 0.0 110.366 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.569 ' HB2' HD21 ' A' ' 16' ' ' LEU . 37.6 tt0 -70.59 -35.98 73.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.435 176.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.42 ' O ' HG13 ' A' ' 40' ' ' ILE . 4.5 m-30 -59.71 -49.14 78.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.74 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -59.4 -41.46 89.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.943 0.401 . . . . 0.0 110.602 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.5 t -58.33 -44.8 88.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.346 177.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.453 ' O ' HG23 ' A' ' 43' ' ' VAL . 88.1 mt -64.16 -52.64 58.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.274 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 36' ' ' TYR . 86.3 mt -54.58 -41.45 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.473 -176.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -56.8 -45.98 81.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.938 0.399 . . . . 0.0 110.85 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -73.56 -35.71 65.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.672 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 39' ' ' LEU . 80.9 t -62.68 -45.95 97.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.993 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -34.27 75.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.193 -179.276 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -60.88 -44.43 97.09 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 174.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.527 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 62.0 m-20 -63.55 -36.97 85.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.837 177.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -60.97 -49.68 76.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.727 0.299 . . . . 0.0 110.712 177.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -60.97 -41.06 95.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.264 -178.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -86.09 5.9 31.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.757 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 56.03 33.2 21.38 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 122.127 0.965 . . . . 0.0 109.816 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -117.66 24.85 10.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.068 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.527 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 29.9 t70 -67.5 100.14 0.83 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.973 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 58.5 p-90 -114.33 2.93 14.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.282 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -162.29 169.6 20.37 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.554 -178.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -160.99 124.33 3.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.3 168.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.536 HD13 ' HA3' ' A' ' 67' ' ' GLY . 3.4 mm? -90.24 123.99 34.5 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.304 -178.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -110.22 147.17 34.3 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 176.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.7 p -128.94 157.1 42.58 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 120.981 0.419 . . . . 0.0 111.31 -171.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -79.31 168.56 19.36 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 172.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -57.1 -49.33 76.23 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -174.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -68.76 -19.54 64.33 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.849 0.357 . . . . 0.0 111.551 178.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.43 16.49 80.32 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.774 -174.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.5 p -88.46 -39.55 14.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.171 0.51 . . . . 0.0 111.078 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -101.57 128.46 47.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.075 174.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 54.9 m95 -116.04 145.15 43.23 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.011 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -152.36 86.06 1.28 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.688 0.756 . . . . 0.0 109.674 -177.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.536 ' HA3' HD13 ' A' ' 56' ' ' LEU . . . -104.8 146.55 16.14 Favored Glycine 0 N--CA 1.439 -1.104 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.074 -176.007 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 81' ' ' ASP . 1.5 ptpp? -100.18 130.93 46.37 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 54.8 m -131.48 127.99 38.47 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.089 -177.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.726 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 8.2 p90 -119.32 138.51 52.99 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.07 0.462 . . . . 0.0 110.948 -177.373 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -117.54 120.45 38.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.786 -178.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.446 ' N ' HD12 ' A' ' 72' ' ' ILE . 4.1 mp -91.39 121.03 41.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.996 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -147.97 124.6 11.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.011 175.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.1 t70 59.95 50.13 7.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.034 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.4 mt 74.46 -33.43 0.25 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 114.767 -1.106 . . . . 0.0 112.642 178.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 51.1 mt -76.0 139.61 41.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.038 0.447 . . . . 0.0 111.548 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -121.38 106.86 11.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.966 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.419 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 79.9 m-85 -96.26 121.53 38.15 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.255 178.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.726 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 0.0 OUTLIER -108.38 135.83 49.03 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.418 0.628 . . . . 0.0 111.208 -179.903 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -128.41 120.25 26.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.158 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.42 ' HA ' ' HA ' ' A' ' 68' ' ' LYS . 2.4 m-20 -78.24 119.12 21.17 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 171.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.4 pt -114.46 130.31 69.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.337 0.589 . . . . 0.0 110.416 -179.278 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -120.06 149.4 42.24 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.538 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.608 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 45.7 p90 -158.14 162.8 37.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.338 0.589 . . . . 0.0 110.934 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -106.64 154.78 20.43 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.176 -177.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.588 HG21 ' CH2' ' A' ' 28' ' ' TRP . 43.7 mm -104.19 90.46 3.13 Favored Pre-proline 0 C--N 1.324 -0.517 0 C-N-CA 122.734 0.413 . . . . 0.0 110.676 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -70.99 175.9 8.46 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.797 2.332 . . . . 0.0 112.182 -177.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.403 HG23 ' HD2' ' A' ' 23' ' ' ARG . 51.6 mm -68.47 -22.66 27.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.147 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.63 -13.74 61.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.219 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.497 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 63.5 t80 -87.47 143.75 34.61 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.497 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 23.0 Cg_endo -96.34 26.17 20.36 Favored 'Cis proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.825 -0.906 . . . . 0.0 112.883 0.586 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.1 m -69.57 -34.99 74.95 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.528 0.68 . . . . 0.0 110.129 178.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -131.32 145.64 51.95 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.16 175.169 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.12 144.3 99.02 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.437 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -80.61 161.08 22.03 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.79 2.327 . . . . 0.0 112.342 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -93.17 101.56 13.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.24 0.543 . . . . 0.0 110.537 -177.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.608 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 63.2 mt -72.38 136.72 25.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.783 -177.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -102.28 116.66 33.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.788 0.328 . . . . 0.0 110.864 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.442 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 5.8 p -124.04 87.74 53.05 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-O 121.889 0.852 . . . . 0.0 110.659 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 99' ' ' VAL . 18.8 Cg_endo -59.97 -36.35 90.3 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 123.287 2.658 . . . . 0.0 114.056 -172.488 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -82.65 17.87 1.7 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -171.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.464 ' O ' HG22 ' A' ' 106' ' ' THR . 42.3 mt -106.09 -15.69 14.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.274 0.559 . . . . 0.0 109.751 169.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.68 144.01 54.57 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.101 -176.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 77.74 -8.64 34.5 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.601 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.9 mtmm -117.22 -48.92 2.61 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.71 -0.288 . . . . 0.0 111.473 -176.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 102' ' ' LEU . 14.1 t . . . . . 0 C--N 1.326 -0.455 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.219 0 N-CA-C 112.767 -0.133 . . . . 0.0 112.767 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -141.44 -171.9 3.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.473 HD13 ' HB ' ' A' ' 97' ' ' ILE . 46.3 pt -123.7 152.36 28.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.891 0.377 . . . . 0.0 111.115 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.8 t -112.09 111.06 21.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.473 173.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.35 165.32 20.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.604 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.402 ' HB ' ' CB ' ' A' ' 121' ' ' PHE . 2.7 m -55.1 133.67 48.96 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.856 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -56.91 -49.42 75.62 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -172.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -79.03 -15.43 58.25 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.991 -0.284 . . . . 0.0 111.703 -177.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.402 ' CB ' ' HB ' ' A' ' 118' ' ' THR . 85.9 t80 -71.37 -33.69 69.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.134 0.493 . . . . 0.0 110.145 179.047 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.614 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 54.0 mtpt -59.88 -51.22 82.28 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.427 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.614 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 25.9 Cg_exo -64.63 -35.62 46.33 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.761 1.641 . . . . 0.0 111.862 171.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.5 tp -59.6 -37.34 78.3 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.881 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.508 ' O ' HG23 ' A' ' 129' ' ' VAL . 48.0 t-105 -54.83 -50.44 68.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.417 176.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.21 -18.31 65.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.708 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -83.78 -20.4 33.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.005 0.431 . . . . 0.0 110.894 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -104.07 10.1 36.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.797 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 125' ' ' TRP . 94.9 t -93.79 139.69 22.79 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 174.044 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.414 ' HA ' HG13 ' A' ' 129' ' ' VAL . 69.5 Cg_endo -95.98 -154.7 0.35 Allowed 'Cis proline' 0 N--CA 1.456 -0.677 0 C-N-CA 124.165 -1.181 . . . . 0.0 113.49 1.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.474 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 54.8 mtmt 71.99 12.06 6.07 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.834 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -90.51 177.44 6.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.073 176.028 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -169.35 172.56 43.52 Favored Glycine 0 C--O 1.236 0.236 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.243 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 45.1 tp -60.41 -36.15 77.46 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.815 0.446 . . . . 0.0 111.66 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.52 -41.78 73.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.29 0.567 . . . . 0.0 111.124 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -71.84 -34.86 69.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.536 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 69.3 tp -67.3 -41.14 85.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.19 -178.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 24.7 mmt -69.05 -40.68 78.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.82 0.343 . . . . 0.0 111.017 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.07 -47.37 62.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.766 -177.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 86.9 mt -84.34 -29.1 26.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.005 0.431 . . . . 0.0 111.419 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.432 ' O ' ' HB2' ' A' ' 145' ' ' TRP . . . -96.41 -77.93 1.38 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.852 -0.689 . . . . 0.0 113.092 -176.212 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.8 tp -55.07 -47.92 74.22 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -170.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.6 -63.15 5.48 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.995 -0.621 . . . . 0.0 113.522 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.6 -27.31 53.4 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.42 2.08 . . . . 0.0 112.085 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' TRP . . . . . 0.432 ' HB2' ' O ' ' A' ' 141' ' ' GLY . 56.6 t90 -62.2 -45.05 95.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.74 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 96.4 mt -67.37 -34.18 76.75 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.132 0.492 . . . . 0.0 110.549 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.97 -5.05 36.08 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.954 -176.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 84.7 t -70.26 -55.13 15.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' GLU . . . . . 0.489 ' O ' HD23 ' A' ' 153' ' ' LEU . 0.0 OUTLIER -135.08 -12.82 2.16 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.709 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.552 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 32.1 mm -55.76 -50.66 85.83 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-N 118.059 0.39 . . . . 0.0 111.836 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.3 Cg_endo -53.58 -34.75 74.36 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 122.203 1.935 . . . . 0.0 112.533 177.088 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -78.22 -39.31 40.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.771 -177.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.489 HD23 ' O ' ' A' ' 149' ' ' GLU . 4.0 mm? -58.35 -37.78 75.87 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.705 177.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 71.7 mt -63.02 -47.19 93.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.685 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.45 ' HG3' ' O ' ' A' ' 151' ' ' PRO . 68.9 mt-30 -68.46 -27.92 66.58 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.774 -178.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -63.85 -27.43 69.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.432 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 87.13 6.24 79.06 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.846 176.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.9 p -78.45 -26.61 14.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.294 0.569 . . . . 0.0 110.386 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 54.7 mt . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.0 177.199 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.446 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 CA--C 1.528 0.102 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.2 m -59.78 -55.44 34.21 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.095 0.474 . . . . 0.0 111.297 -175.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.99 -22.04 64.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.292 -177.354 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' A' ' 8' ' ' ARG . 21.6 ttt180 -71.16 -39.23 72.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.377 178.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 5' ' ' ALA . 99.4 t -63.73 -43.37 97.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.196 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.9 t -60.32 -39.13 79.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.398 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.3 m -61.86 -37.78 85.78 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -177.026 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -88.11 8.58 26.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.836 0.351 . . . . 0.0 111.475 -177.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 54.1 mt -121.87 86.93 46.35 Favored Pre-proline 0 C--O 1.237 0.404 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 172.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -48.85 146.29 11.88 Favored 'Trans proline' 0 C--O 1.238 0.484 0 C-N-CA 123.674 2.916 . . . . 0.0 114.047 -173.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.431 ' HB ' ' O ' ' A' ' 131' ' ' LYS . 33.0 m -81.04 162.79 3.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.611 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' A' ' 35' ' ' GLU . 10.0 mp -96.19 146.15 24.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.814 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -75.03 -39.54 60.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.41 -176.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.606 HG21 HD12 ' A' ' 27' ' ' LEU . 62.8 m -124.02 128.48 49.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.735 -173.196 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -91.71 118.36 30.59 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 173.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -161.2 156.75 24.67 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.578 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.29 -164.55 15.85 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.65 177.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.91 5.69 2.86 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.78 2.32 . . . . 0.0 113.232 -176.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 51.6 mtm180 -70.74 -62.67 1.3 Allowed 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -84.33 97.87 9.7 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.666 HH22 ' HG2' ' A' ' 61' ' ' GLU . 15.1 mtp180 -63.26 -33.2 74.99 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.213 -173.393 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -70.93 -50.73 31.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.558 0.218 . . . . 0.0 111.034 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.606 HD12 HG21 ' A' ' 18' ' ' THR . 4.3 mm? -66.91 -28.74 68.55 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.218 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.575 ' CH2' HG21 ' A' ' 86' ' ' ILE . 72.0 t-105 -60.53 -45.48 93.7 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.889 172.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 25' ' ' ARG . 70.2 t -61.07 -42.9 94.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.231 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.423 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 52.5 mt-30 -58.19 -53.92 52.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.388 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -67.34 -28.75 68.23 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.737 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.4 tp -62.59 -46.56 87.76 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 8.4 mtpm? -56.46 -58.81 6.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.056 176.441 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 18.3 mm-40 -62.13 -39.31 92.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.523 -174.272 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.775 ' HB2' HD21 ' A' ' 16' ' ' LEU . 39.6 tt0 -67.36 -38.29 84.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.389 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.548 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.1 m-85 -64.17 -30.45 71.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.527 176.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 90.2 mm-40 -68.3 -42.59 79.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.141 176.549 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.3 m -61.23 -39.72 91.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.984 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.511 HD12 ' HA ' ' A' ' 36' ' ' TYR . 76.6 mt -60.66 -49.35 77.85 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.884 177.019 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 36' ' ' TYR . 84.3 mt -51.98 -44.7 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 120.79 0.329 . . . . 0.0 110.603 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.516 ' O ' ' HB2' ' A' ' 45' ' ' ASN . 18.6 tpt180 -58.71 -51.18 71.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.222 177.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -66.62 -42.93 86.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.648 0.261 . . . . 0.0 111.066 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 39' ' ' LEU . 94.8 t -61.83 -47.85 91.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.548 179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -63.57 -42.86 98.29 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.528 0.68 . . . . 0.0 109.705 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' A' ' 41' ' ' ARG . 1.0 OUTLIER -53.77 -49.29 68.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.398 178.202 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -69.7 -43.25 72.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.439 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -66.49 -43.84 84.28 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -177.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.401 ' ND2' ' HA ' ' A' ' 45' ' ' ASN . 2.9 p30 -70.98 -23.85 62.29 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.987 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.52 8.41 7.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.732 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.4 t0 62.77 41.39 9.03 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.597 0.713 . . . . 0.0 110.515 177.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -141.52 87.44 2.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.508 174.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -101.46 101.81 12.48 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.55 ' HA ' ' CD1' ' A' ' 70' ' ' TRP . 52.6 p-90 -123.72 -1.37 8.46 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -173.623 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -154.21 158.16 39.88 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.96 -172.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.89 130.34 2.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.977 168.151 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.3 tp -124.53 131.47 53.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.427 -173.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -126.26 175.95 7.44 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.949 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.0 m -154.46 166.96 31.62 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.729 0.299 . . . . 0.0 110.826 -178.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.431 HD21 ' HB2' ' A' ' 64' ' ' ARG . 6.9 p30 -79.54 172.37 13.88 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 169.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -64.31 -26.04 68.31 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -174.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.666 ' HG2' HH22 ' A' ' 25' ' ' ARG . 37.4 mt-10 -80.25 -23.53 40.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.87 0.367 . . . . 0.0 110.834 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.69 17.91 73.48 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.962 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -86.11 -6.54 58.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.227 0.536 . . . . 0.0 110.969 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.431 ' HB2' HD21 ' A' ' 59' ' ' ASN . 50.5 mtm180 -142.0 120.77 12.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.469 176.019 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 24.9 m95 -106.11 130.06 54.08 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -146.45 137.76 24.45 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.274 0.559 . . . . 0.0 110.527 -175.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.93 -152.63 6.77 Favored Glycine 0 N--CA 1.442 -0.933 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.158 -178.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.691 ' HD3' ' CZ3' ' A' ' 70' ' ' TRP . 34.9 tttp -143.02 143.16 31.78 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -177.206 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.6 p -144.84 148.42 33.96 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.691 ' CZ3' ' HD3' ' A' ' 68' ' ' LYS . 0.7 OUTLIER -138.29 151.38 47.54 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.939 0.4 . . . . 0.0 110.902 179.119 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -117.71 138.09 52.25 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.383 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.2 mm -107.22 123.99 62.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.186 -176.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -159.5 123.17 3.73 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.393 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 57.26 55.55 5.79 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.809 0.693 . . . . 0.0 112.057 177.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 69.46 1.64 3.4 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.789 175.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 76.8 mt -107.18 138.14 43.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.085 0.469 . . . . 0.0 111.509 -174.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.1 ttmm -119.57 109.0 15.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.246 175.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -107.04 116.0 31.16 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.608 ' HB2' ' HE3' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -105.29 144.97 31.33 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.253 0.549 . . . . 0.0 111.519 -177.215 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -135.04 151.09 50.46 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.335 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.71 118.66 37.12 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.0 pt -113.31 147.04 17.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.63 0 CA-C-O 121.109 0.481 . . . . 0.0 111.187 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -150.69 153.06 34.9 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.242 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.601 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 39.1 p90 -158.27 155.46 28.92 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.406 176.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.474 ' O ' ' HB3' ' A' ' 95' ' ' PRO . 7.8 p-10 -95.06 156.86 16.14 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.015 -176.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.575 HG21 ' CH2' ' A' ' 28' ' ' TRP . 46.8 mm -109.76 90.43 9.07 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.988 175.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 11.7 Cg_endo -53.62 155.31 13.8 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.932 2.421 . . . . 0.0 112.751 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 39.6 mm -67.75 -21.12 26.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.515 0.674 . . . . 0.0 110.031 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.1 p -85.71 10.55 13.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.89 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.533 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 51.6 t80 -72.64 145.54 87.37 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.533 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 95.3 Cg_endo -94.75 11.99 46.46 Favored 'Cis proline' 0 C--N 1.35 0.608 0 C-N-CA 124.318 -1.117 . . . . 0.0 113.328 -0.134 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 23.7 m -62.75 -31.22 72.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.488 0.661 . . . . 0.0 110.304 178.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 32.0 m -114.01 134.18 55.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.016 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.407 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -75.49 145.05 78.65 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.454 -178.541 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.474 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 19.3 Cg_exo -66.7 151.79 81.92 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.156 2.57 . . . . 0.0 112.395 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -93.34 100.48 12.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.353 -178.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.601 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.4 mt -71.97 121.67 22.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.815 -178.574 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -118.71 125.47 49.74 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.106 0.479 . . . . 0.0 111.114 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 24.3 t -118.32 87.2 29.44 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.428 175.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.74 -25.21 74.9 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 123.288 2.659 . . . . 0.0 113.761 -172.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.03 -17.86 60.92 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.88 -43.59 95.61 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 38.6 t70 55.06 26.35 8.04 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.825 0.703 . . . . 0.0 112.127 170.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 68.56 16.1 69.28 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.961 -0.637 . . . . 0.0 113.045 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.503 ' NZ ' ' HB2' ' A' ' 105' ' ' LYS . 4.6 ttmp? -76.16 -18.03 59.29 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.001 0.429 . . . . 0.0 110.783 -178.059 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.426 ' OG1' HD11 ' A' ' 153' ' ' LEU . 2.9 t . . . . . 0 CA--C 1.542 0.635 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.982 -177.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.613 0 N-CA-C 112.215 -0.354 . . . . 0.0 112.215 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.1 mtpp -76.73 120.81 22.42 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.6 pt -75.64 155.15 6.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.959 0.409 . . . . 0.0 110.811 -178.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 7.9 p -97.54 114.85 26.83 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.009 -178.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.8 mt -100.12 142.56 31.43 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 174.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.5 t -71.1 156.31 39.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.075 0.464 . . . . 0.0 111.261 -176.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -66.48 -42.93 86.76 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -172.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.445 ' C ' ' HD2' ' A' ' 123' ' ' PRO . 12.6 m-70 -62.25 -14.68 40.92 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -178.224 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -66.87 -33.92 76.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.952 0.406 . . . . 0.0 110.141 176.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.641 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 37.9 mtpt -62.7 -52.39 65.04 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.073 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.641 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 31.2 Cg_exo -59.74 -35.56 94.17 Favored 'Trans proline' 0 C--N 1.359 1.096 0 C-N-CA 121.697 1.598 . . . . 0.0 112.028 173.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 59.1 tp -63.55 -44.54 93.89 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.551 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.406 ' O ' HG23 ' A' ' 129' ' ' VAL . 47.3 t-105 -57.94 -57.46 12.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.894 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.72 -29.96 71.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.719 -176.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 13.3 ttm180 -64.53 -30.94 71.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.221 -178.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -102.14 16.48 25.98 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.336 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 125' ' ' TRP . 93.9 t -106.49 134.46 19.79 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 172.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -83.27 -162.77 2.93 Favored 'Cis proline' 0 C--N 1.347 0.45 0 C-N-CA 124.208 -1.164 . . . . 0.0 114.001 3.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.431 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 68.1 mttm 74.67 7.73 4.39 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.441 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -89.99 175.47 7.17 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 177.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -164.9 155.37 26.73 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.107 -177.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.42 HD21 ' CE2' ' A' ' 84' ' ' PHE . 43.3 tp -65.4 -30.98 71.85 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 122.78 0.432 . . . . 0.0 111.068 -175.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.45 ' O ' ' HG2' ' A' ' 138' ' ' MET . . . -56.81 -33.02 66.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.411 0.624 . . . . 0.0 110.936 176.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -71.46 -32.25 68.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.367 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.6 tp -67.44 -40.13 85.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.258 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' A' ' 135' ' ' ALA . 23.5 ptp -72.09 -36.54 69.52 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.866 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -75.07 -45.69 39.71 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 88.6 mt -93.97 -23.72 17.94 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -174.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -101.17 -65.83 0.79 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.851 -177.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.6 tp -59.26 -57.14 14.33 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -173.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.82 -61.98 6.32 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-N 116.156 -0.475 . . . . 0.0 113.819 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' PRO . . . . . 0.43 ' O ' HG23 ' A' ' 148' ' ' VAL . 53.2 Cg_exo -57.29 -35.07 98.85 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.717 2.278 . . . . 0.0 113.137 -179.011 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 45.9 t90 -64.31 -49.58 71.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.058 0.456 . . . . 0.0 109.917 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.39 -32.31 73.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.8 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.22 -12.57 60.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.993 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 144' ' ' PRO . 67.2 t -88.57 -56.14 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.672 0.272 . . . . 0.0 110.916 178.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 149' ' ' GLU . . . . . 0.529 ' O ' ' HG ' ' A' ' 153' ' ' LEU . 7.7 mm-40 -80.49 -52.79 7.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -173.24 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.614 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 48.9 mm -55.21 -54.46 50.34 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -170.534 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.614 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 31.6 Cg_exo -60.4 -33.76 93.89 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.99 1.793 . . . . 0.0 112.314 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -75.03 -43.49 53.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.331 -177.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 149' ' ' GLU . 23.3 mt -56.98 -34.58 68.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.247 178.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 150' ' ' ILE . 73.0 mt -62.59 -49.59 83.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.552 177.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -68.96 -34.43 75.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.489 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -73.83 -16.95 61.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.879 0.371 . . . . 0.0 111.054 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.14 24.62 47.45 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.215 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 51.4 t -83.17 -33.29 10.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.557 0.694 . . . . 0.0 109.294 178.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 72.8 mt . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.241 174.021 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.326 0 CA-C-O 121.059 0.457 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.438 ' O ' HG23 ' A' ' 10' ' ' VAL . 22.6 m -62.76 -46.25 88.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.182 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -66.77 -29.68 69.69 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.117 -176.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.5 ttm180 -62.6 -47.98 81.41 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.42 ' O ' HG13 ' A' ' 13' ' ' ILE . 58.5 t -57.34 -46.36 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.721 178.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 6' ' ' THR . 67.5 t -60.16 -36.9 70.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.183 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.4 m -76.08 -37.99 57.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.73 -176.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -82.37 8.58 11.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.201 0.524 . . . . 0.0 110.593 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.457 HG12 ' HB2' ' A' ' 42' ' ' TYR . 71.1 mt -114.2 89.56 17.66 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.387 171.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -40.04 143.04 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.268 3.312 . . . . 0.0 114.202 -175.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 m -83.23 162.85 3.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.732 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.827 HD21 ' HB3' ' A' ' 35' ' ' GLU . 6.8 mp -95.96 134.77 38.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.68 -177.602 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -86.32 -30.84 21.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.275 0.559 . . . . 0.0 109.868 174.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 27.5 m -96.83 125.89 41.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.29 -176.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -132.04 104.2 6.69 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.129 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -149.76 173.65 13.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.019 -178.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.94 166.16 17.75 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.112 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -66.86 -1.87 6.77 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 123.322 2.682 . . . . 0.0 113.327 -177.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -72.48 -18.23 61.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.583 0.23 . . . . 0.0 111.471 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -116.6 112.19 20.94 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 175.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 29' ' ' VAL . 48.8 mtt180 -58.57 -51.48 69.71 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -173.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -72.62 -35.89 67.94 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.379 -0.528 . . . . 0.0 111.667 -173.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.05 -34.32 75.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.991 0.424 . . . . 0.0 110.207 174.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.415 ' O ' HD23 ' A' ' 32' ' ' LEU . 44.9 t-105 -66.01 -48.08 72.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.878 176.246 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 25' ' ' ARG . 80.0 t -63.2 -35.95 74.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 178.063 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.528 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 40.7 tt0 -66.94 -39.05 87.21 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.925 178.028 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.508 HH12 ' HG3' ' A' ' 91' ' ' PRO . 25.2 ttt85 -68.61 -38.28 80.45 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.17 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.585 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 1.7 mm? -52.68 -51.97 57.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.476 176.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 18.7 ptpt -67.52 -25.53 65.88 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.621 0.248 . . . . 0.0 111.132 -179.123 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.528 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 28.3 mm-40 -64.47 -62.53 1.54 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.766 175.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.827 ' HB3' HD21 ' A' ' 16' ' ' LEU . 12.1 pt-20 -73.1 -26.02 61.09 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.332 -177.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.585 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -52.42 -45.81 66.1 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 169.092 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.3 mm-40 -61.01 -42.4 98.37 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.524 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.8 m -59.03 -45.04 91.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.445 176.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.428 ' O ' HG23 ' A' ' 43' ' ' VAL . 77.7 mt -60.47 -55.45 33.36 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.798 178.269 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 79.9 mt -60.26 -39.24 80.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.049 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' A' ' 41' ' ' ARG . 6.9 tpp85 -66.69 -41.22 88.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.647 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.457 ' HB2' HG12 ' A' ' 13' ' ' ILE . 86.5 t80 -66.27 -44.77 82.66 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.091 177.425 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 39' ' ' LEU . 92.3 t -59.76 -38.62 76.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.329 176.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -57.13 -59.87 4.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.263 0.554 . . . . 0.0 110.061 176.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -58.8 -35.49 72.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.356 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -68.45 -46.1 70.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.461 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -67.29 -28.52 68.08 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.148 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -67.64 -14.28 62.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.89 0.376 . . . . 0.0 110.89 177.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -101.34 14.88 30.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.216 174.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.6 t70 70.54 5.83 5.55 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.504 0.721 . . . . 0.0 111.487 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.507 ' OD1' ' HD1' ' A' ' 53' ' ' TRP . 23.7 t-20 -102.28 142.37 33.62 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.862 -0.524 . . . . 0.0 110.984 -176.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -158.09 111.43 2.44 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.507 ' HD1' ' OD1' ' A' ' 51' ' ' ASN . 56.1 p-90 -130.04 -3.03 4.55 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -172.044 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.4 ' HZ ' ' HD2' ' A' ' 42' ' ' TYR . 10.8 p90 -152.42 156.52 39.67 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.072 -0.651 . . . . 0.0 111.67 -174.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -161.92 126.79 3.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.565 171.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.543 HD13 ' HA3' ' A' ' 67' ' ' GLY . 3.8 mm? -100.54 130.38 46.6 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.242 -174.5 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -120.83 160.41 23.47 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 172.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 p -154.34 174.9 14.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 120.964 0.411 . . . . 0.0 111.163 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -83.04 170.73 14.54 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 172.318 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -65.65 -24.89 67.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.681 0.276 . . . . 0.0 111.544 -176.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -71.4 -24.72 62.11 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.805 0.336 . . . . 0.0 110.686 176.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.67 23.53 77.91 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.539 -0.625 . . . . 0.0 111.539 -176.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.2 p -95.2 -39.23 10.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.139 0.495 . . . . 0.0 111.397 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.1 mmt-85 -110.12 116.82 32.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.25 177.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 39.1 m95 -110.34 133.93 52.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.346 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -129.84 128.56 42.53 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.072 176.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.543 ' HA3' HD13 ' A' ' 56' ' ' LEU . . . -126.62 138.4 10.62 Favored Glycine 0 N--CA 1.441 -0.978 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.255 -175.585 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -101.25 131.98 47.0 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 177.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 38.0 m -120.14 136.45 54.61 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.733 -176.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 24.8 m-90 -126.35 122.74 36.27 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.331 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.432 ' HD2' ' HH ' ' A' ' 78' ' ' TYR . 3.8 t80 -128.24 119.11 24.52 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.24 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.498 HD13 ' HA ' ' A' ' 77' ' ' LYS . 31.7 mm -101.76 113.92 39.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.96 175.343 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 23.4 t60 -154.18 140.58 18.71 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -176.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.3 t70 62.73 27.26 16.03 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.34 0.591 . . . . 0.0 109.898 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 66.42 12.4 8.64 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.837 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.8 mt -105.93 135.73 46.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.122 0.487 . . . . 0.0 110.956 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.498 ' HA ' HD13 ' A' ' 72' ' ' ILE . 63.4 tttp -97.98 119.25 36.28 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.742 177.595 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.432 ' HH ' ' HD2' ' A' ' 71' ' ' TYR . 15.0 p90 -141.1 143.45 34.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.098 0.475 . . . . 0.0 110.53 174.353 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -135.69 148.7 49.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.994 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -138.63 144.16 39.6 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -108.57 128.38 54.77 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 121.106 0.479 . . . . 0.0 109.73 174.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 29.2 pt -117.7 151.04 19.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.583 -175.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -139.21 153.82 47.94 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 174.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.585 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 31.2 p90 -156.38 151.35 26.22 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.481 177.508 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.562 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 29.5 t70 -98.73 145.29 27.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.998 -177.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.0 mm -107.7 89.97 5.74 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.627 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.562 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 22.4 Cg_exo -64.49 164.04 24.89 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.554 2.169 . . . . 0.0 111.982 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 57.2 mt -69.2 -18.5 22.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.38 0.61 . . . . 0.0 110.322 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -79.95 9.02 5.85 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.392 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.558 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 78.2 t80 -77.94 139.46 61.65 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.558 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 44.2 Cg_endo -95.82 13.09 41.28 Favored 'Cis proline' 0 C--N 1.349 0.573 0 C-N-CA 124.314 -1.119 . . . . 0.0 113.856 1.532 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 38.1 m -58.5 -31.91 68.31 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.356 0.598 . . . . 0.0 110.496 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 35.6 m -123.63 124.4 42.7 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.785 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.498 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -69.0 143.93 95.04 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.518 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 17.2 Cg_exo -68.22 155.53 69.05 Favored 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 123.31 2.673 . . . . 0.0 112.687 179.451 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -102.3 116.87 33.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.926 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.585 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 4.2 mp -88.46 117.95 33.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.23 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -90.24 -44.0 10.02 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.816 -175.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.421 ' CG1' ' HG ' ' A' ' 102' ' ' LEU . 17.9 t 63.52 86.58 0.14 Allowed Pre-proline 0 CA--C 1.535 0.399 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.889 -176.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -61.15 -28.14 85.02 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.957 2.438 . . . . 0.0 112.969 -175.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.92 -37.08 83.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.855 0.36 . . . . 0.0 110.876 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.472 ' HA ' ' HB3' ' A' ' 105' ' ' LYS . 60.8 mt -82.33 -10.78 58.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.741 -173.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -61.84 112.45 2.3 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 81.02 -12.29 37.71 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.34 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.472 ' HB3' ' HA ' ' A' ' 102' ' ' LEU . 3.6 tppp? -86.33 -60.7 1.93 Allowed 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.508 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.638 HG23 HD11 ' A' ' 153' ' ' LEU . 66.4 m . . . . . 0 C--N 1.322 -0.602 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.707 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.422 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 98' ' ' ALA . 16.5 ptpt -164.61 164.47 21.54 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -175.395 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.5 pt -73.46 135.24 28.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 120.966 0.412 . . . . 0.0 110.419 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.6 t -96.83 117.92 32.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.34 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.7 mt -98.21 164.19 12.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.337 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 3.5 t -72.14 152.09 42.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.078 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -68.41 -26.93 65.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.101 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -70.43 -18.51 63.01 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.64 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -67.12 -33.62 75.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.054 0.454 . . . . 0.0 110.035 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.411 ' HB2' ' CD ' ' A' ' 123' ' ' PRO . 41.8 mtpt -58.6 -58.94 15.47 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.842 -178.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.411 ' CD ' ' HB2' ' A' ' 122' ' ' LYS . 27.9 Cg_endo -63.94 -26.76 66.6 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 121.874 1.716 . . . . 0.0 112.451 178.296 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 64.5 tp -66.31 -47.24 74.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.968 0.414 . . . . 0.0 110.24 175.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -67.19 -51.42 53.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.624 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.05 -15.37 59.35 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.19 -176.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -78.55 -40.91 33.59 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.95 0.405 . . . . 0.0 110.786 177.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -105.16 70.53 0.9 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.105 0.479 . . . . 0.0 110.949 -173.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 68.2 t -130.9 128.69 22.43 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.267 176.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.454 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 78.0 Cg_endo -87.92 -139.83 0.15 OUTLIER 'Cis proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.728 -1.363 . . . . 0.0 112.91 1.034 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 50.6 mtmt 75.54 -7.62 1.75 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.496 0.718 . . . . 0.0 111.533 -178.423 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.7 m-30 -95.65 141.17 29.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.29 171.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -145.98 -174.06 17.79 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 42.7 tp -57.14 -38.31 73.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.78 0.29 . . . . 0.0 111.415 -176.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.56 -43.63 89.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.005 0.431 . . . . 0.0 111.173 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 20.2 m80 -70.99 -36.66 72.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.313 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.8 tp -60.31 -47.89 84.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.249 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' MET . . . . . 0.429 ' CE ' ' HA ' ' A' ' 138' ' ' MET . 18.2 mmt -63.96 -43.17 96.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.034 -178.035 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.14 75.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.951 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.8 mt -86.86 -33.31 19.84 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -176.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -98.6 -64.89 0.86 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.4 -0.905 . . . . 0.0 113.109 -176.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.7 tp -66.21 -44.26 84.34 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -173.024 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -51.8 -61.59 6.32 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.371 -0.442 . . . . 0.0 113.566 -178.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -62.42 -31.46 80.98 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.571 2.18 . . . . 0.0 112.37 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 52.3 t90 -62.66 -46.17 89.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.022 0.439 . . . . 0.0 110.097 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 86.8 mt -63.94 -33.11 74.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.784 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.6 -18.1 64.86 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.476 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 64.7 t -104.36 -54.5 6.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.493 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -77.21 -35.18 55.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -171.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.572 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 31.9 mm -59.62 -51.84 78.25 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 111.79 0.292 . . . . 0.0 111.79 -178.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.572 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 50.6 Cg_exo -55.12 -34.53 87.87 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.974 1.783 . . . . 0.0 112.129 175.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.87 -45.04 87.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.725 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.638 HD11 HG23 ' A' ' 106' ' ' THR . 4.2 mm? -67.94 -30.25 69.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.231 178.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 150' ' ' ILE . 65.5 mt -70.93 -42.1 77.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.139 0.495 . . . . 0.0 110.172 175.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -63.42 -42.61 98.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.904 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 43.0 tttp -67.98 -31.83 71.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.125 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 79.99 33.67 32.5 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.904 174.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.2 t -97.37 -14.76 7.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.021 0.439 . . . . 0.0 110.934 -177.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.7 mt . . . . . 0 C--N 1.328 -0.365 0 CA-C-O 121.389 0.614 . . . . 0.0 109.658 177.338 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.417 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.227 0 CA-C-O 121.279 0.562 . . . . 0.0 109.965 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.2 m -64.68 -45.7 85.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.488 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.52 -30.0 70.71 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.282 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -66.64 -41.65 87.93 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.011 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 5' ' ' ALA . 71.9 t -58.74 -46.1 90.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.319 177.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.1 t -66.42 -28.85 44.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.752 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.8 t -76.87 -36.27 56.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.946 -178.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -86.13 -4.31 59.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.429 . . . . 0.0 110.879 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 61.6 mt -119.06 86.36 31.69 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 173.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.15 149.51 27.67 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.665 2.91 . . . . 0.0 113.768 -172.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.8 m -76.23 175.1 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.037 178.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.422 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 6.3 mp -100.27 163.59 12.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.485 -179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.63 -39.7 5.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 172.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.624 ' HB ' ' HG3' ' A' ' 34' ' ' GLU . 23.0 m -88.92 135.86 33.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.148 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -150.02 121.44 7.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.51 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.669 ' H ' ' HD2' ' A' ' 31' ' ' ARG . . . -156.28 -178.99 7.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.277 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.5 168.56 19.76 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.058 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.74 -7.48 18.37 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 123.2 2.6 . . . . 0.0 113.2 -177.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.407 ' HE ' ' HB2' ' A' ' 23' ' ' ARG . 11.0 mtm180 -70.28 -51.26 31.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.638 0.732 . . . . 0.0 109.723 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.6 93.77 3.65 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.133 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.415 ' O ' HG23 ' A' ' 29' ' ' VAL . 97.9 mtt180 -55.75 -52.17 64.85 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -168.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.553 ' HG3' HD22 ' A' ' 27' ' ' LEU . 10.0 pt-20 -71.37 -33.93 69.99 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -174.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.553 HD22 ' HG3' ' A' ' 26' ' ' GLU . 4.2 mm? -75.48 -33.31 60.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.967 0.413 . . . . 0.0 110.341 178.155 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.51 ' CH2' HG21 ' A' ' 86' ' ' ILE . 64.1 t-105 -65.32 -50.67 64.76 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.126 177.293 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 25' ' ' ARG . 84.3 t -60.17 -32.68 51.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 121.123 0.487 . . . . 0.0 110.49 177.15 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.517 ' HB3' HG21 ' A' ' 18' ' ' THR . 24.2 tt0 -67.32 -49.21 65.06 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.249 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.669 ' HD2' ' H ' ' A' ' 20' ' ' ALA . 2.9 ptm180 -70.31 -27.58 64.5 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.374 -0.53 . . . . 0.0 110.066 178.44 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.437 ' HA ' HD22 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -62.84 -44.77 95.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.231 -0.441 . . . . 0.0 109.866 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.499 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 18.5 ptpt -73.38 -31.09 63.71 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.349 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.624 ' HG3' ' HB ' ' A' ' 18' ' ' THR . 6.1 mm-40 -57.35 -51.51 69.11 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.381 0.61 . . . . 0.0 109.69 172.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.552 ' OE1' ' HA3' ' A' ' 133' ' ' GLY . 5.3 tp10 -64.66 -39.64 94.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.075 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.426 ' O ' HG13 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -61.85 -42.18 98.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.798 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 15.4 mm100 -64.43 -39.2 93.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.899 0.38 . . . . 0.0 110.314 177.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.7 t -61.74 -43.14 99.43 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.884 175.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.418 ' O ' HG23 ' A' ' 43' ' ' VAL . 61.9 mt -59.86 -52.29 66.09 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.84 175.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 36' ' ' TYR . 77.7 mt -59.06 -33.28 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.87 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 41' ' ' ARG . 6.8 tpp180 -61.1 -44.6 97.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.275 177.226 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -68.6 -43.17 77.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.422 177.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.497 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 86.6 t -59.42 -42.02 86.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.655 178.012 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.44 -47.26 86.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.756 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -54.57 -41.51 69.94 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.371 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.479 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 89.3 m-20 -67.5 -41.28 84.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.141 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 74.0 mmtt -68.09 -27.57 66.59 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.244 -0.182 . . . . 0.0 110.808 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.18 -41.65 79.7 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.946 178.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -107.83 3.88 24.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.81 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.6 t70 59.14 31.46 21.29 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.5 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -97.17 16.04 20.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.469 -177.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.479 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 20.7 t0 -57.75 138.93 55.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.202 -178.081 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 59.7 p-90 -143.33 -0.25 1.11 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.167 -0.47 . . . . 0.0 112.104 -172.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -140.44 135.26 31.84 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 119.893 -0.723 . . . . 0.0 112.019 -170.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -130.33 125.04 33.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.056 174.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.1 126.91 49.43 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.873 0.368 . . . . 0.0 110.274 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -118.08 160.35 21.67 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.633 177.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.4 p -158.67 168.74 26.07 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.766 0.317 . . . . 0.0 110.834 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -75.72 172.88 11.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.025 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -71.93 -14.85 62.04 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -175.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.25 -18.22 29.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.853 0.358 . . . . 0.0 110.239 176.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.22 23.94 70.2 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 116.042 -0.527 . . . . 0.0 112.244 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.8 p -90.97 -4.35 56.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.025 0.441 . . . . 0.0 111.436 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -152.47 128.42 10.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -120.59 136.97 54.65 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.865 0.364 . . . . 0.0 110.69 -176.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.4 p90 -141.01 139.25 34.14 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.326 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -165.1 -177.73 37.81 Favored Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 119.427 -1.368 . . . . 0.0 113.128 -177.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.51 ' HD2' ' CZ2' ' A' ' 70' ' ' TRP . 22.7 ttmm -130.65 133.05 45.8 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 -177.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.426 ' O ' ' HA ' ' A' ' 79' ' ' GLU . 6.9 p -112.6 130.13 56.13 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.321 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.683 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 16.6 m-90 -103.64 131.11 51.09 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.57 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -118.22 119.51 34.89 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 175.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 15.7 mm -101.89 119.78 50.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.221 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -140.36 107.32 5.42 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.254 177.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.5 t70 55.07 64.75 1.69 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.548 173.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 75' ' ' LEU . 3.6 mm? 67.12 2.08 2.62 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.658 175.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -107.4 137.45 45.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.762 0.315 . . . . 0.0 110.401 177.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 21.4 ttpt -118.0 113.87 22.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.263 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -112.4 122.19 47.0 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.683 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 8.2 pt-20 -115.26 140.13 49.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.988 0.423 . . . . 0.0 110.904 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -127.8 126.18 41.22 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.153 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -87.23 126.06 34.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.862 177.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.475 HG22 HG22 ' A' ' 99' ' ' VAL . 41.1 pt -125.25 153.42 32.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.92 -175.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -147.82 155.12 41.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.798 0.333 . . . . 0.0 110.502 176.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.434 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 44.2 p90 -165.21 159.28 17.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.288 177.093 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -104.28 170.15 8.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.259 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.51 HG21 ' CH2' ' A' ' 28' ' ' TRP . 47.7 mm -114.91 90.89 24.27 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.936 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 11.0 Cg_endo -53.52 159.74 6.02 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.249 2.633 . . . . 0.0 112.89 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.1 mm -71.66 -18.5 19.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.509 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 m -88.52 9.31 24.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.05 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.473 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 47.7 t80 -81.37 146.05 56.9 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.31 -0.404 . . . . 0.0 109.914 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.473 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 10.9 Cg_endo -92.99 12.81 51.03 Favored 'Cis proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.48 -1.05 . . . . 0.0 112.696 -2.681 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.4 m -59.38 -28.83 67.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.389 0.614 . . . . 0.0 110.61 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 74.0 m -128.51 132.52 48.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.557 173.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.62 144.67 69.87 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.214 -178.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -85.82 173.98 6.81 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.826 2.351 . . . . 0.0 112.332 178.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.646 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 45.1 mt-10 -109.09 116.99 33.01 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.296 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.434 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.8 mt -76.24 132.43 33.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.457 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.739 ' HA ' ' HA3' ' A' ' 113' ' ' GLY . . . -107.15 128.88 54.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.926 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.475 HG22 HG22 ' A' ' 82' ' ' ILE . 10.6 t -122.83 86.06 50.12 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -63.13 -17.94 62.61 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.855 2.37 . . . . 0.0 112.829 -175.103 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -81.09 -27.54 35.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.96 0.41 . . . . 0.0 111.006 -178.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 72.9 mt -88.42 -17.82 29.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.978 0.418 . . . . 0.0 110.13 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -57.54 112.59 1.48 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.031 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 82.93 -11.84 52.05 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.092 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.416 ' NZ ' ' HB2' ' A' ' 105' ' ' LYS . 4.9 ttmp? -93.47 -44.51 8.21 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 120.802 0.334 . . . . 0.0 110.789 -177.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.0 m . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.194 178.919 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLY . . . . . 0.739 ' HA3' ' HA ' ' A' ' 98' ' ' ALA . . . . . . . . 0 N--CA 1.437 -1.257 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.646 ' HA ' ' HB3' ' A' ' 96' ' ' GLU . 7.4 mtpm? 49.03 39.55 15.1 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 122.782 0.433 . . . . 0.0 111.389 178.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.6 pt -72.15 135.51 27.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.295 0.569 . . . . 0.0 110.957 -177.129 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 2.8 p -108.58 153.2 23.71 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.004 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.428 ' HB2' ' CD1' ' A' ' 121' ' ' PHE . 64.7 mt -91.37 -171.39 2.93 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.008 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.7 t -61.1 145.68 50.07 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -58.41 -30.69 67.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.492 -173.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -54.77 -30.98 58.1 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.169 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.428 ' CD1' ' HB2' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -69.19 -33.04 72.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.469 -175.561 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.464 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 10.0 tmtt? -58.77 -57.08 29.49 Favored Pre-proline 0 CA--C 1.541 0.618 0 CA-C-O 119.714 -0.184 . . . . 0.0 111.393 -173.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.464 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 35.6 Cg_endo -66.95 -34.95 27.91 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 121.672 1.581 . . . . 0.0 111.982 175.393 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 43.9 tp -60.98 -37.91 84.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.927 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.482 ' CZ3' HD13 ' A' ' 137' ' ' LEU . 63.7 t-105 -61.21 -54.71 40.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.484 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.48 -33.27 74.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.303 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 31.6 mtt180 -63.7 -37.12 86.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.465 177.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -83.47 -61.24 1.89 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -175.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.47 HG13 ' HA ' ' A' ' 130' ' ' PRO . 94.6 t -47.49 132.93 10.35 Favored Pre-proline 0 N--CA 1.471 0.602 0 O-C-N 123.627 0.579 . . . . 0.0 111.407 -175.567 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.481 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 91.7 Cg_endo -77.61 -164.65 4.04 Favored 'Cis proline' 0 C--N 1.35 0.643 0 C-N-CA 124.259 -1.142 . . . . 0.0 114.298 7.169 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 30.8 mttm 73.66 -9.87 1.15 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.867 -178.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' PHE . . . . . 0.506 ' HZ ' HD12 ' A' ' 140' ' ' LEU . 6.0 t80 -106.68 151.36 25.21 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.552 ' HA3' ' OE1' ' A' ' 35' ' ' GLU . . . -166.96 -158.18 11.13 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 119.629 -1.272 . . . . 0.0 113.759 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 48.6 tp -63.22 -44.93 93.89 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.746 0.646 . . . . 0.0 112.746 -169.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.04 87.51 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.944 0.878 . . . . 0.0 110.002 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -72.7 -32.48 65.79 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.533 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.482 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 65.8 tp -66.66 -48.74 68.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.308 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 20.3 ptm -65.34 -34.83 79.24 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 121.071 -0.252 . . . . 0.0 111.073 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.18 -45.66 72.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.708 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.506 HD12 ' HZ ' ' A' ' 132' ' ' PHE . 76.2 mt -91.0 -16.06 28.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.825 -174.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -110.43 -67.34 0.56 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.259 -176.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.5 tp -60.97 -46.11 92.03 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 -174.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.5 -62.18 6.47 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.061 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.61 -33.84 96.71 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.705 2.27 . . . . 0.0 112.962 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 18.7 t90 -57.66 -52.67 64.48 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.241 0.543 . . . . 0.0 109.772 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.405 ' HA ' HG12 ' A' ' 150' ' ' ILE . 88.9 mt -67.47 -36.13 80.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.892 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.21 -24.15 67.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.362 -174.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 57.7 t -104.23 -54.72 6.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.78 -0.368 . . . . 0.0 111.905 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -73.99 -34.08 64.07 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -170.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.493 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.0 mm -66.52 -49.77 50.21 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -176.327 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.493 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 79.1 Cg_exo -50.21 -39.52 52.09 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 122.225 1.95 . . . . 0.0 112.95 177.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -70.6 -42.27 71.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.71 0.291 . . . . 0.0 110.491 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 23.2 tp -59.51 -35.71 74.67 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.071 0.462 . . . . 0.0 110.438 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 150' ' ' ILE . 69.2 mt -70.34 -53.69 21.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.692 177.298 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -64.47 -26.65 68.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.854 -175.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -70.77 -14.32 62.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.721 -178.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 90.92 16.66 54.01 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.764 176.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 59.9 t -80.95 -62.74 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.944 0.402 . . . . 0.0 110.284 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 13.2 pt . . . . . 0 C--N 1.324 -0.54 0 CA-C-O 121.356 0.598 . . . . 0.0 111.261 179.905 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.453 -0.288 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.5 m -57.98 -44.17 86.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.424 177.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 51.3 mmm-85 -59.4 -48.17 82.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.952 -178.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.3 -46.16 77.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.065 -177.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 5' ' ' ALA . 79.5 t -59.45 -48.07 88.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.304 -178.395 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 92.5 t -66.74 -26.99 38.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.966 0.412 . . . . 0.0 110.803 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -77.26 -54.22 6.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.424 -177.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -80.56 0.49 33.68 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.976 0.417 . . . . 0.0 111.708 -173.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.642 HG12 ' HB2' ' A' ' 42' ' ' TYR . 60.9 mt -108.97 87.96 5.1 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 169.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.533 ' HG2' ' HG3' ' A' ' 41' ' ' ARG . 80.7 Cg_exo -48.48 140.46 21.31 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 123.978 3.119 . . . . 0.0 114.006 -170.535 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.513 ' HB ' ' HG2' ' A' ' 131' ' ' LYS . 35.6 m -73.43 163.4 4.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.942 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mp -106.94 154.8 20.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.092 -175.058 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.412 ' NZ ' ' HB2' ' A' ' 17' ' ' LYS . 9.0 mtmp? -99.91 -47.27 5.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.905 177.132 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.561 HG23 HD12 ' A' ' 27' ' ' LEU . 72.7 m -82.97 116.59 22.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.424 -177.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.479 ' OD1' ' HG3' ' A' ' 91' ' ' PRO . 38.4 t-20 -148.16 99.06 3.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.182 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.08 -58.08 0.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.508 -174.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 151.68 170.16 18.11 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.961 176.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.73 -13.36 17.96 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 123.042 2.494 . . . . 0.0 112.294 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.44 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 1.7 mmp_? -65.76 -33.85 76.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.758 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -93.43 107.34 19.2 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 mmp_? -58.22 -43.41 87.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.876 -176.085 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.43 -45.2 66.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.846 0.355 . . . . 0.0 110.681 -174.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.561 HD12 HG23 ' A' ' 18' ' ' THR . 4.5 mm? -73.18 -23.56 60.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.774 178.747 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 51.7 t-105 -70.66 -45.66 64.7 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 25' ' ' ARG . 99.5 t -60.78 -38.66 79.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.094 0.473 . . . . 0.0 110.029 175.244 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.583 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 0.7 OUTLIER -61.33 -37.27 82.67 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.459 174.813 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.573 HH22 ' HA2' ' A' ' 133' ' ' GLY . 2.4 mtp180 -64.5 -37.4 87.41 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.119 177.055 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 32' ' ' LEU . 4.1 mm? -56.7 -42.69 79.57 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 175.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -60.12 -47.84 84.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.468 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 11.0 mm-40 -59.57 -49.77 76.46 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.836 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -62.07 -44.73 96.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.802 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.42 ' O ' HG13 ' A' ' 40' ' ' ILE . 8.4 m-30 -57.67 -46.66 83.97 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.452 0.168 . . . . 0.0 111.308 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -58.56 -46.78 86.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 0.0 110.684 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.8 t -66.84 -44.42 81.08 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.468 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.427 ' O ' HG23 ' A' ' 43' ' ' VAL . 58.5 mt -60.52 -53.88 52.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.216 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 36' ' ' TYR . 79.9 mt -57.71 -39.8 72.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.48 0.181 . . . . 0.0 110.702 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.533 ' HG3' ' HG2' ' A' ' 14' ' ' PRO . 5.9 mmp_? -59.63 -56.88 16.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.911 176.262 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.642 ' HB2' HG12 ' A' ' 13' ' ' ILE . 36.4 t80 -57.44 -50.07 74.2 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.355 -179.539 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.513 HG12 ' HE2' ' A' ' 47' ' ' LYS . 91.1 t -63.56 -37.52 79.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.162 -176.401 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 40' ' ' ILE . 2.7 tp10 -63.22 -49.82 72.66 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.342 0.591 . . . . 0.0 109.99 179.193 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -59.29 -36.59 75.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.568 177.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.449 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 65.6 t30 -73.2 -40.06 65.05 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.411 -177.651 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.513 ' HE2' HG12 ' A' ' 43' ' ' VAL . 66.5 mttm -63.04 -46.38 87.83 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.802 -178.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -71.8 -14.71 62.06 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.853 -175.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -89.81 -2.82 58.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.825 0.345 . . . . 0.0 110.452 175.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.2 t0 60.78 40.25 16.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.277 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -122.99 17.83 10.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.923 0.868 . . . . 0.0 109.505 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.449 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 22.4 t70 -62.3 101.47 0.23 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.827 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.442 ' HB2' ' O ' ' A' ' 70' ' ' TRP . 15.9 p-90 -111.13 -40.98 4.3 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -167.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.586 ' H ' ' HD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -124.1 162.34 23.75 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 121.776 -0.577 . . . . 0.0 111.762 -174.235 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -156.28 129.03 7.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.848 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -112.61 144.14 42.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.252 0.549 . . . . 0.0 111.759 -173.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -109.25 162.99 13.77 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 173.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.1 m -153.19 155.4 36.59 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.808 0.337 . . . . 0.0 110.904 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -81.49 168.73 17.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 169.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -73.87 -6.5 47.56 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.805 -174.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -84.8 -25.58 28.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.98 0.419 . . . . 0.0 110.258 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.04 18.23 74.43 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.2 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.0 p -90.38 -4.35 57.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -176.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 64' ' ' ARG . 12.8 ttp180 -151.99 128.37 10.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.788 0.328 . . . . 0.0 110.17 172.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -111.54 126.56 55.11 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.36 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -137.25 138.04 39.68 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.212 -175.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -172.66 -155.94 12.0 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.676 -0.774 . . . . 0.0 112.051 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -138.66 153.61 48.58 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.771 0.319 . . . . 0.0 110.406 -178.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.8 p -128.19 123.97 35.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.841 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.6 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 17.0 m-90 -102.11 121.56 42.43 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 175.619 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.427 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 11.1 t80 -118.99 124.5 47.14 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.175 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 41.6 mm -97.9 114.8 36.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -177.473 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -146.57 118.42 8.15 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.403 177.448 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.6 t0 62.1 41.95 10.32 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.333 0.587 . . . . 0.0 110.828 175.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mm? 70.44 5.04 5.19 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.693 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.2 mt -88.48 106.12 18.06 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.998 0.427 . . . . 0.0 110.199 176.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -94.28 93.61 7.84 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.427 ' CE1' ' HB3' ' A' ' 71' ' ' TYR . 30.1 p90 -118.22 138.85 52.05 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.067 0.46 . . . . 0.0 111.087 -177.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.6 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 0.7 OUTLIER -115.21 141.87 47.43 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.74 179.734 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -123.85 136.95 54.69 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.174 174.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -85.48 110.91 19.52 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.403 ' HA ' HG22 ' A' ' 99' ' ' VAL . 32.0 pt -115.16 155.62 16.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.016 -172.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -166.08 159.64 15.61 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.631 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 52.3 p90 -159.39 147.73 17.71 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.55 178.242 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -98.98 159.45 14.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.307 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.7 mm -106.6 90.32 4.91 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.328 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.18 148.5 18.09 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 123.102 2.535 . . . . 0.0 112.591 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 38.8 mm -71.66 -14.31 17.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.559 0.695 . . . . 0.0 110.091 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 2.9 p -84.21 7.65 18.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.423 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.698 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 63.5 t80 -69.63 144.65 94.2 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.698 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 37.8 Cg_endo -92.7 3.01 60.17 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 124.186 -1.173 . . . . 0.0 114.133 1.058 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.9 m -58.02 -41.71 83.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.459 0.647 . . . . 0.0 110.09 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.5 m -103.93 120.92 42.04 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.206 172.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.61 145.07 95.61 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.479 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.441 ' HD2' HD22 ' A' ' 137' ' ' LEU . 25.7 Cg_exo -62.63 115.38 2.87 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.64 2.227 . . . . 0.0 111.221 175.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.575 ' CB ' ' HD2' ' A' ' 114' ' ' LYS . 30.6 mt-10 -74.44 117.33 16.13 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.83 -175.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.631 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.5 mt -66.6 127.76 28.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 175.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.98 -78.0 0.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.142 -170.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.403 HG22 ' HA ' ' A' ' 82' ' ' ILE . 8.1 t 51.69 75.79 0.61 Allowed Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.598 -175.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.88 -21.16 56.14 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 123.096 2.531 . . . . 0.0 112.798 -175.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 10.6 tp10 -63.61 -28.49 69.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.368 -178.688 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 97.8 mt -77.62 -22.53 50.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.288 -177.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -68.67 -16.38 63.81 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.557 0.694 . . . . 0.0 110.726 -178.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -108.5 10.37 35.74 Favored Glycine 0 C--N 1.316 -0.535 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.891 176.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 48.5 mmtm -115.49 -68.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.679 0.276 . . . . 0.0 111.497 -177.421 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.486 -173.814 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 112.018 -0.433 . . . . 0.0 112.018 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.575 ' HD2' ' CB ' ' A' ' 96' ' ' GLU . 38.6 mmtt -138.89 143.49 38.75 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -178.208 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.407 ' CD1' ' HB ' ' A' ' 97' ' ' ILE . 39.4 pt -76.34 152.9 5.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.825 179.204 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 39.0 t -88.71 106.54 18.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.461 -179.188 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.9 mt -92.68 -175.49 3.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.7 t -84.36 155.52 22.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.716 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -73.53 -24.58 60.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.701 -178.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -82.64 -2.73 54.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.088 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -69.83 -40.94 75.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.023 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.432 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 31.6 mmtp -63.77 -53.7 48.0 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.792 -177.414 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.432 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 16.1 Cg_endo -59.46 -32.08 95.79 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 121.738 1.626 . . . . 0.0 112.419 176.519 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.6 tp -69.43 -47.97 62.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.993 0.425 . . . . 0.0 110.312 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -61.12 -51.88 67.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.878 -177.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.24 -28.97 70.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.459 -177.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -68.88 -38.73 79.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.089 0.471 . . . . 0.0 110.241 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -66.78 -54.97 17.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.71 -176.202 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 59.3 t -42.22 125.29 2.76 Favored Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 124.188 0.93 . . . . 0.0 111.983 -173.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.453 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 85.4 Cg_endo -81.92 -132.45 0.09 OUTLIER 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.079 -1.217 . . . . 0.0 113.027 4.143 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.513 ' HG2' ' HB ' ' A' ' 15' ' ' VAL . 7.1 ttmm 70.34 -45.0 0.58 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 176.048 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -74.12 155.82 38.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.949 0.405 . . . . 0.0 110.837 -177.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.573 ' HA2' HH22 ' A' ' 31' ' ' ARG . . . -144.97 174.17 25.15 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.435 -175.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.445 HD11 ' CE2' ' A' ' 84' ' ' PHE . 47.8 tp -69.59 -37.17 76.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.781 0.324 . . . . 0.0 110.913 -175.47 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.09 -37.88 64.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.429 0.633 . . . . 0.0 110.695 174.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -71.23 -32.73 69.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.419 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.441 HD22 ' HD2' ' A' ' 95' ' ' PRO . 61.7 tp -65.6 -48.91 70.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.197 -178.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 22.9 ptp -67.25 -34.78 78.17 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.992 -177.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -75.47 -53.47 8.61 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.91 -17.31 44.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.821 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -95.49 -71.59 1.11 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.434 -0.889 . . . . 0.0 112.897 -177.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.488 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 44.5 tp -67.6 -36.51 81.0 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -172.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.88 -62.22 6.31 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.093 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -65.53 -26.63 54.38 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.601 2.201 . . . . 0.0 112.6 177.045 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -65.47 -39.37 91.89 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.921 0.391 . . . . 0.0 110.651 -178.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 96.3 mt -59.03 -32.88 70.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.828 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.78 1.68 14.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.785 -177.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 61.4 t -101.18 -55.86 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.854 0.359 . . . . 0.0 111.187 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -84.57 -46.63 11.37 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -174.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.478 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 48.0 mm -58.69 -54.46 56.01 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -169.729 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 12.2 Cg_endo -54.93 -38.98 92.66 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 122.299 1.999 . . . . 0.0 113.202 -175.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.5 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 38.6 t70 -81.68 -34.29 30.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.725 0.298 . . . . 0.0 110.275 -178.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.429 ' HG ' ' HB ' ' A' ' 158' ' ' VAL . 20.2 tp -59.95 -39.15 84.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.032 0.444 . . . . 0.0 110.481 178.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 150' ' ' ILE . 60.5 mt -64.37 -44.02 97.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.223 0.535 . . . . 0.0 110.06 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -68.32 -28.82 67.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.127 -177.318 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 156' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 30.7 mtpp -71.86 -9.51 58.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.729 0.299 . . . . 0.0 110.959 176.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.45 26.2 40.28 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.379 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 158' ' ' VAL . . . . . 0.429 ' HB ' ' HG ' ' A' ' 153' ' ' LEU . 40.8 t -94.69 -28.91 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 0.0 110.23 179.016 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.42 HD11 HD23 ' A' ' 153' ' ' LEU . 58.8 mt . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.707 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.787 0.327 . . . . 0.0 110.495 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.451 ' O ' HG23 ' A' ' 10' ' ' VAL . 89.7 m -55.82 -52.94 62.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.261 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -61.74 -32.53 72.77 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.864 0.364 . . . . 0.0 110.873 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -63.89 -41.23 97.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.649 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.2 t -78.61 -42.48 25.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.128 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 6' ' ' THR . 82.5 t -59.62 -36.96 68.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.592 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.1 m -64.42 -25.15 67.89 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.029 0.442 . . . . 0.0 111.022 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.564 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 37.7 mt-10 -91.99 -13.99 30.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.429 -177.632 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 52.4 mt -107.69 89.91 5.68 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.616 0.246 . . . . 0.0 110.752 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.564 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 38.9 Cg_exo -55.73 158.34 13.8 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.545 2.83 . . . . 0.0 113.373 -174.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.555 ' HB ' ' O ' ' A' ' 131' ' ' LYS . 28.4 m -100.24 170.98 1.42 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.181 -178.128 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.562 ' HG ' ' HB3' ' A' ' 34' ' ' GLU . 9.4 mp -91.58 -177.71 4.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.538 -178.194 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -137.04 6.75 2.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.705 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.566 HG21 HD12 ' A' ' 27' ' ' LEU . 27.0 m -154.21 96.33 1.93 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.869 0.366 . . . . 0.0 110.834 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -111.24 110.08 20.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.942 0.401 . . . . 0.0 110.901 -177.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.467 ' O ' ' HD3' ' A' ' 91' ' ' PRO . . . -143.91 -178.37 5.89 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.345 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.15 165.5 54.05 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.988 -175.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 88' ' ' ILE . 16.2 Cg_exo -69.3 -15.94 39.14 Favored 'Trans proline' 0 CA--C 1.529 0.259 0 C-N-CA 123.368 2.712 . . . . 0.0 112.526 178.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 23' ' ' ARG . 36.0 mtp-105 -83.32 -14.01 53.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.185 0.517 . . . . 0.0 110.072 178.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -80.48 64.35 5.25 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 170.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.402 ' O ' HG23 ' A' ' 29' ' ' VAL . 12.4 mtm-85 -54.23 -43.35 70.79 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.876 -167.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.413 ' HG3' HD22 ' A' ' 27' ' ' LEU . 7.4 pt-20 -60.13 -45.27 93.59 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.651 0.263 . . . . 0.0 111.614 -178.632 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.566 HD12 HG21 ' A' ' 18' ' ' THR . 4.1 mm? -81.94 -19.92 39.73 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.949 0.404 . . . . 0.0 110.978 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.449 ' HE3' HH21 ' A' ' 31' ' ' ARG . 62.3 t-105 -65.76 -39.81 91.43 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.772 177.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 25' ' ' ARG . 88.0 t -61.3 -42.37 93.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.091 176.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.515 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 34.4 tt0 -67.09 -42.56 84.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.367 0.603 . . . . 0.0 110.187 176.053 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.456 ' HD3' ' O ' ' A' ' 18' ' ' THR . 15.9 ttp-105 -63.56 -32.69 74.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.07 -179.392 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -59.7 -47.33 86.07 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.344 178.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 10.3 ptmm? -65.52 -33.63 76.37 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.462 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.562 ' HB3' ' HG ' ' A' ' 16' ' ' LEU . 29.8 mm-40 -64.56 -48.98 73.0 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.837 0.351 . . . . 0.0 110.23 177.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -59.88 -44.47 94.18 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.458 ' O ' HG13 ' A' ' 40' ' ' ILE . 11.0 m-85 -59.38 -46.54 88.37 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.213 178.651 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -65.25 -37.79 88.32 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.468 0.173 . . . . 0.0 111.468 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.7 t -61.58 -43.39 98.95 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.746 -0.465 . . . . 0.0 109.746 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.488 ' O ' HG23 ' A' ' 43' ' ' VAL . 92.4 mt -64.84 -52.53 56.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.998 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.5 mt -55.84 -37.63 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.177 -177.47 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -57.27 -47.71 80.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.857 0.361 . . . . 0.0 110.96 177.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -68.62 -38.57 80.66 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.5 t -60.31 -43.27 93.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.865 178.686 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -57.42 -53.41 58.43 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 120.737 0.303 . . . . 0.0 110.437 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -54.22 -45.7 72.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.34 0.59 . . . . 0.0 111.07 176.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.558 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 26.3 t30 -71.62 -45.95 60.56 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.012 -0.994 . . . . 0.0 112.045 -170.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -72.9 -31.19 64.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.481 0.182 . . . . 0.0 111.297 -175.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -71.67 -26.99 62.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.904 0.383 . . . . 0.0 110.497 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -89.18 -5.23 57.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.882 0.372 . . . . 0.0 110.494 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 t70 67.44 16.26 9.97 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.438 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -91.96 8.79 35.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.718 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.558 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 24.5 t70 -51.44 110.87 0.5 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.006 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 67.7 p-90 -123.97 8.22 8.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.22 -170.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -158.02 143.55 16.94 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.063 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.43 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -125.44 124.37 41.28 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 173.889 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.493 HD23 ' HA3' ' A' ' 67' ' ' GLY . 65.5 mt -135.69 133.65 38.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.0 111.621 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -138.31 157.18 46.75 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 171.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.536 ' HB3' ' CE2' ' A' ' 65' ' ' TRP . 30.9 p -103.67 164.78 11.45 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 120.661 0.267 . . . . 0.0 110.41 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -79.88 -179.14 6.8 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 171.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -68.83 -21.05 64.32 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.818 -171.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -88.25 -21.81 24.29 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.795 0.331 . . . . 0.0 110.818 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.63 2.09 84.5 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.127 -0.558 . . . . 0.0 112.407 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.49 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . 20.8 p -90.45 -7.25 53.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.756 0.312 . . . . 0.0 111.493 -177.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -136.41 129.63 31.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.039 0.447 . . . . 0.0 110.891 173.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.536 ' CE2' ' HB3' ' A' ' 58' ' ' SER . 38.3 m95 -112.87 138.03 50.33 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.747 176.564 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -137.87 145.06 41.74 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.01 -178.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.493 ' HA3' HD23 ' A' ' 56' ' ' LEU . . . -177.8 -150.69 8.72 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.183 -1.008 . . . . 0.0 112.651 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -147.1 139.21 24.5 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -174.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 23.2 p -125.84 138.31 53.81 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 175.564 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 13.9 p90 -157.4 135.74 11.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.812 0.339 . . . . 0.0 110.378 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -145.76 151.42 37.94 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.1 mm -88.24 121.4 38.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.019 0.438 . . . . 0.0 110.759 -175.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -129.69 112.52 13.74 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.031 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 0.8 OUTLIER 59.11 38.36 23.84 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.546 0.528 . . . . 0.0 111.229 179.508 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.4 mm? 75.4 -6.95 1.87 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.238 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.8 mt -79.98 107.49 12.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.914 0.388 . . . . 0.0 110.018 177.078 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -89.73 108.34 19.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.823 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -130.99 151.22 51.64 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.686 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -134.58 150.61 50.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.335 -178.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -131.99 119.84 21.62 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.032 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -72.16 119.06 15.81 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 172.099 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.488 HG22 HG22 ' A' ' 99' ' ' VAL . 30.7 pt -118.06 143.52 28.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 121.12 0.486 . . . . 0.0 111.819 -172.381 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -135.14 166.39 23.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.442 172.315 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.574 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 49.1 p90 -166.18 145.24 5.88 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.023 173.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -103.18 152.66 21.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.159 0.504 . . . . 0.0 110.664 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.49 ' HB ' ' HA ' ' A' ' 63' ' ' THR . 49.1 mm -104.37 90.82 3.47 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.855 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -62.54 166.63 13.0 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.671 2.247 . . . . 0.0 112.319 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.417 ' HA ' ' HD2' ' A' ' 22' ' ' PRO . 34.1 mt -70.1 -9.94 13.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.66 0.743 . . . . 0.0 110.582 -178.306 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.8 p -86.43 -13.62 45.68 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.332 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.533 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 72.2 t80 -73.51 143.5 82.48 Favored Pre-proline 0 C--N 1.326 -0.42 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.533 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 10.9 Cg_endo -94.1 14.96 44.12 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 124.703 -0.957 . . . . 0.0 113.172 0.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.5 m -65.81 -30.34 70.95 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.583 0.706 . . . . 0.0 109.738 177.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.3 m -122.06 150.64 41.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.521 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.24 144.68 92.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.427 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -77.61 156.23 31.82 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.66 2.24 . . . . 0.0 111.872 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -93.06 109.82 21.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.097 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.574 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 52.9 mt -76.01 128.82 37.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 177.032 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.38 -62.72 1.25 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.991 -173.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.488 HG22 HG22 ' A' ' 82' ' ' ILE . 21.2 t 60.39 83.15 0.21 Allowed Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.151 -173.107 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.17 -20.93 71.56 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.015 2.477 . . . . 0.0 113.462 -173.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -71.79 -25.32 61.96 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.858 0.361 . . . . 0.0 111.19 -178.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 86.8 mt -97.3 16.41 20.07 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.246 -0.284 . . . . 0.0 110.895 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -59.89 92.62 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.476 -177.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 68.44 21.86 74.57 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.939 -0.573 . . . . 0.0 113.346 174.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -98.56 -45.69 6.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.94 0.37 . . . . 0.0 110.821 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.438 HG23 HD11 ' A' ' 153' ' ' LEU . 33.6 m . . . . . 0 C--N 1.326 -0.418 0 CA-C-O 121.502 0.668 . . . . 0.0 110.524 178.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.63 0 N-CA-C 112.363 -0.295 . . . . 0.0 112.363 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -124.24 142.49 51.2 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.2 pt -80.48 159.15 4.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.917 0.389 . . . . 0.0 111.221 -177.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 20.8 p -99.94 118.81 37.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.501 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.4 mt -86.74 176.35 7.78 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.552 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.448 HG23 ' HB2' ' A' ' 121' ' ' PHE . 8.7 t -71.59 149.67 45.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.398 179.082 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -64.5 -38.33 90.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.362 -175.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -71.75 -9.35 58.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.457 -177.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.448 ' HB2' HG23 ' A' ' 118' ' ' THR . 70.6 t80 -69.72 -34.69 74.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.736 0.303 . . . . 0.0 111.036 -178.696 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.41 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 14.5 mmmm -61.94 -53.58 58.59 Favored Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -177.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.53 ' O ' ' HG3' ' A' ' 127' ' ' ARG . 19.7 Cg_endo -61.61 -37.09 71.95 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 121.701 1.601 . . . . 0.0 111.8 174.568 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 63.9 tp -57.2 -47.03 82.32 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.921 0.391 . . . . 0.0 110.589 178.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.549 ' O ' HG23 ' A' ' 129' ' ' VAL . 29.5 t-105 -60.29 -53.06 62.17 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.001 177.438 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -58.06 -38.87 77.12 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.319 -175.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.53 ' HG3' ' O ' ' A' ' 123' ' ' PRO . 98.1 mtt180 -63.24 -26.69 68.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.685 0.278 . . . . 0.0 111.581 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -108.85 21.71 16.87 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.121 0.486 . . . . 0.0 111.053 -174.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.549 HG23 ' O ' ' A' ' 125' ' ' TRP . 68.8 t -107.77 136.43 19.69 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.959 175.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.432 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 1.4 Cg_endo -86.35 -158.3 1.36 Allowed 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 124.193 -1.169 . . . . 0.0 112.948 0.188 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.555 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 55.5 mttp 75.77 -0.55 3.17 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.168 0.987 . . . . 0.0 111.956 -177.264 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' PHE . . . . . 0.441 ' HZ ' HD12 ' A' ' 140' ' ' LEU . 4.3 t80 -72.53 163.95 27.2 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.158 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -151.67 165.38 30.54 Favored Glycine 0 C--O 1.236 0.265 0 C-N-CA 120.209 -0.996 . . . . 0.0 112.801 -174.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.44 HD23 HD11 ' A' ' 39' ' ' LEU . 48.2 tp -58.01 -46.74 84.76 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.52 0.728 . . . . 0.0 112.595 -172.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.46 -30.02 51.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.323 0.583 . . . . 0.0 111.8 -177.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -71.13 -31.23 67.47 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.566 -178.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 35.7 tp -58.79 -47.48 84.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.026 0.441 . . . . 0.0 110.815 178.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' MET . . . . . 0.471 ' HA ' ' HB3' ' A' ' 142' ' ' LEU . 1.3 mpt? -67.01 -39.35 87.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.903 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -69.86 -42.08 73.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.176 -177.466 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.441 HD12 ' HZ ' ' A' ' 132' ' ' PHE . 84.0 mt -95.01 -24.29 16.99 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -173.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -119.66 -63.69 0.27 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.098 -1.048 . . . . 0.0 113.755 -174.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.471 ' HB3' ' HA ' ' A' ' 138' ' ' MET . 1.4 tm? -57.99 -51.94 67.57 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -172.22 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.84 -61.17 7.75 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 121.312 -0.471 . . . . 0.0 113.134 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' PRO . . . . . 0.501 ' O ' HG23 ' A' ' 148' ' ' VAL . 77.3 Cg_exo -52.36 -36.58 69.31 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.884 2.389 . . . . 0.0 113.14 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -62.99 -49.0 76.42 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.788 0.328 . . . . 0.0 110.344 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 91.6 mt -60.1 -41.79 93.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.537 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.04 -8.61 46.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.316 -176.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 144' ' ' PRO . 94.7 t -106.44 -55.59 5.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.651 0.263 . . . . 0.0 111.362 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -79.84 -42.83 23.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.907 -170.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.564 ' O ' HG13 ' A' ' 154' ' ' ILE . 49.0 mm -59.66 -52.67 72.34 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -172.129 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.535 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 70.3 Cg_exo -53.45 -34.56 72.23 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.349 2.033 . . . . 0.0 113.488 -178.068 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.6 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 9.2 m-20 -86.26 -27.07 24.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.947 0.403 . . . . 0.0 110.875 178.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.652 ' HG ' ' HB ' ' A' ' 158' ' ' VAL . 15.7 tp -70.5 -26.79 63.76 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.146 0.498 . . . . 0.0 110.193 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 150' ' ' ILE . 69.1 mt -66.05 -49.56 75.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.736 175.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 1.4 pp0? -69.92 -20.17 63.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.188 -176.324 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 156' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 67.6 mttm -77.11 -16.64 59.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.077 0.465 . . . . 0.0 110.269 174.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 90.45 17.15 53.72 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.851 177.405 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 158' ' ' VAL . . . . . 0.652 ' HB ' ' HG ' ' A' ' 153' ' ' LEU . 58.7 t -88.71 -40.46 13.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.797 0.332 . . . . 0.0 110.705 -178.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.549 HD11 HD23 ' A' ' 153' ' ' LEU . 48.1 mm . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.325 178.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.56 0.219 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.437 ' O ' HG23 ' A' ' 10' ' ' VAL . 25.7 m -64.13 -35.63 81.41 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.576 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -62.42 -39.88 94.74 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 120.855 0.359 . . . . 0.0 110.285 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.427 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 44.0 ttt85 -65.7 -38.17 88.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.686 178.284 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 5' ' ' ALA . 97.5 t -60.48 -41.03 86.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.937 0.399 . . . . 0.0 110.546 177.138 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 6' ' ' THR . 59.7 t -69.16 -27.17 33.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 121.099 0.476 . . . . 0.0 110.354 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.3 t -73.55 -32.47 64.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.231 177.32 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 8' ' ' ARG . 44.3 mt-10 -81.49 -28.26 34.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.877 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.401 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 51.0 mt -104.73 87.56 1.86 Allowed Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 174.242 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.8 Cg_endo -50.18 141.71 30.22 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.884 3.056 . . . . 0.0 113.636 -169.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.4 m -69.33 149.53 10.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.369 177.002 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.556 HD21 ' HA ' ' A' ' 35' ' ' GLU . 6.4 mp -99.98 153.95 18.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.196 0.522 . . . . 0.0 111.571 -175.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.2 mttt -98.22 -49.67 4.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.619 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.4 m -75.17 108.05 7.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.606 -170.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -105.7 90.41 3.39 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.404 ' O ' ' HD3' ' A' ' 91' ' ' PRO . . . -145.04 145.63 31.55 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.492 -177.199 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.1 167.49 41.75 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.149 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.28 -13.47 38.33 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 123.217 2.611 . . . . 0.0 113.088 -176.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -74.14 -24.6 59.44 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.801 0.334 . . . . 0.0 110.869 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -89.4 94.27 9.83 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 25' ' ' ARG . 43.3 mtm105 -60.11 -51.58 69.02 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -164.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -73.75 -29.94 62.51 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.496 -175.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -76.6 -26.52 55.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.904 0.383 . . . . 0.0 110.199 175.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.531 ' CH2' HG21 ' A' ' 86' ' ' ILE . 55.3 t-105 -64.2 -44.73 91.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.982 175.648 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.52 -41.35 81.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.353 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.698 ' HG3' ' HE3' ' A' ' 33' ' ' LYS . 53.5 tt0 -64.63 -44.0 91.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.308 177.681 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.537 HH22 HD22 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -54.52 -45.08 73.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.721 177.16 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.6 mp -62.88 -46.24 88.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.592 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.698 ' HE3' ' HG3' ' A' ' 30' ' ' GLN . 20.7 pttp -68.26 -38.88 82.23 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.904 -176.12 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 6.6 mm-40 -68.26 -45.13 74.0 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.712 0.292 . . . . 0.0 110.634 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.556 ' HA ' HD21 ' A' ' 16' ' ' LEU . 10.0 tp10 -61.91 -42.51 99.17 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.084 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -63.84 -30.55 71.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.49 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.684 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 81.8 mm-40 -62.32 -49.51 75.33 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 m -63.72 -38.15 90.04 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.897 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.462 ' O ' HG23 ' A' ' 43' ' ' VAL . 92.8 mt -61.22 -55.92 26.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 177.828 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 87.2 mt -62.27 -36.22 73.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.78 -178.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -55.24 -47.17 75.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.991 175.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -72.45 -41.03 66.56 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.354 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.6 t -59.54 -39.05 78.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 120.736 0.303 . . . . 0.0 110.804 178.269 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -55.14 -54.83 38.31 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.4 -46.6 83.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.31 178.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -56.07 -51.41 67.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.623 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -63.16 -32.57 73.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.627 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -65.34 -36.73 84.9 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.006 0.431 . . . . 0.0 110.59 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -85.68 2.42 45.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.802 178.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.1 t70 64.51 23.02 12.83 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.844 0.831 . . . . 0.0 110.866 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -114.08 76.62 1.0 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.502 177.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -72.91 104.7 4.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.277 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.494 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -75.53 -61.22 1.99 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.458 -168.645 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.494 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 3.3 p90 -162.48 172.34 15.65 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.794 -173.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.506 ' NH2' ' HH2' ' A' ' 70' ' ' TRP . 4.5 ptp180 -141.79 133.32 26.82 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.689 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.5 tp -121.23 123.48 42.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.164 0.507 . . . . 0.0 110.545 -173.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -109.23 164.42 12.47 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.658 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.9 m -141.93 156.2 45.49 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 179.031 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -74.57 162.93 28.3 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 168.148 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -70.63 -4.8 25.16 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -171.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -98.57 -16.13 19.24 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.142 0.496 . . . . 0.0 110.471 173.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.69 15.61 75.75 Favored Glycine 0 CA--C 1.52 0.392 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.597 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.3 p -86.33 -3.37 58.97 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -158.76 120.31 3.44 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -105.22 145.59 30.43 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -178.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 83' ' ' GLU . 45.8 p90 -153.34 158.92 42.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.457 -176.188 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 166.83 -150.53 17.61 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.564 -0.826 . . . . 0.0 112.078 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.579 ' HD3' ' HB2' ' A' ' 79' ' ' GLU . 38.9 ttmt -133.21 140.95 47.82 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 -178.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.5 t -134.56 138.12 44.34 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.118 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.782 ' HB3' ' HA ' ' A' ' 79' ' ' GLU . 22.5 p90 -148.12 159.4 43.97 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.225 -0.59 . . . . 0.0 111.06 178.282 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 64.3 t80 -124.34 129.47 50.77 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.877 -176.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 49.9 mm -100.01 118.56 46.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 179.072 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 82.4 t60 -146.5 119.1 8.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.07 -0.513 . . . . 0.0 109.646 -178.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.465 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 0.9 OUTLIER 63.84 31.93 13.72 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.418 0.449 . . . . 0.0 110.151 -175.687 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.2 mm? 71.84 -3.75 2.11 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.43 -176.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 73' ' ' HIS . 93.1 mt -65.12 123.75 20.34 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.726 0.298 . . . . 0.0 110.417 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -114.01 108.38 16.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.296 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.495 ' CE1' HG21 ' A' ' 150' ' ' ILE . 0.5 OUTLIER -129.94 109.83 11.19 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.22 177.368 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.782 ' HA ' ' HB3' ' A' ' 70' ' ' TRP . 11.4 pt-20 -96.64 143.71 27.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.091 -176.653 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -132.96 136.68 46.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.041 177.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -82.19 127.61 33.33 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 176.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 48.0 pt -126.52 158.38 36.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.121 0.486 . . . . 0.0 111.284 -175.015 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 66' ' ' PHE . 7.3 pt-20 -159.26 170.16 22.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.793 174.535 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.553 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 39.4 p90 -167.93 146.59 4.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.118 0.485 . . . . 0.0 110.411 173.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -89.76 167.11 13.13 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.342 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.531 HG21 ' CH2' ' A' ' 28' ' ' TRP . 47.2 mm -114.36 89.46 17.87 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.572 -177.091 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -63.2 163.46 22.97 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.802 2.335 . . . . 0.0 111.925 175.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.402 ' N ' HD12 ' A' ' 88' ' ' ILE . 2.0 mp -62.31 -23.79 33.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-O 121.145 0.498 . . . . 0.0 110.938 -178.269 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.534 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 1.3 p -72.79 -12.75 61.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -178.019 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -73.02 141.0 81.02 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.404 ' HD3' ' O ' ' A' ' 20' ' ' ALA . 63.6 Cg_endo -97.55 8.63 36.05 Favored 'Cis proline' 0 N--CA 1.458 -0.564 0 C-N-CA 124.437 -1.068 . . . . 0.0 112.895 -0.102 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 25.2 m -60.6 -32.92 72.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.409 0.623 . . . . 0.0 110.429 -178.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.534 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 29.6 m -126.3 132.58 51.61 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 172.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.3 144.74 97.43 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.693 0.282 . . . . 0.0 111.509 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -82.51 158.35 16.81 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.693 2.262 . . . . 0.0 112.24 177.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -83.31 115.83 22.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.223 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.553 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 5.0 mp -73.9 131.38 35.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.294 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.445 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -100.72 123.0 44.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.933 0.396 . . . . 0.0 110.904 -179.022 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.0 t -129.33 87.09 54.56 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.37 178.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.75 -19.37 45.94 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 123.273 2.648 . . . . 0.0 113.917 -173.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.457 ' O ' ' HD3' ' A' ' 105' ' ' LYS . 7.8 tp10 -84.53 3.86 34.6 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.971 0.415 . . . . 0.0 110.985 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.7 mt -123.38 22.01 9.37 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 122.161 -0.337 . . . . 0.0 111.005 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -69.29 89.32 0.47 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.113 0.483 . . . . 0.0 111.146 -177.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 60.49 25.44 63.05 Favored Glycine 0 CA--C 1.52 0.358 0 CA-C-N 115.395 -0.821 . . . . 0.0 113.915 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' ' 101' ' ' GLU . 19.8 ptmt -116.08 13.41 15.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.178 0.489 . . . . 0.0 111.835 -177.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.2 t . . . . . 0 C--N 1.325 -0.488 0 CA-C-O 121.095 0.474 . . . . 0.0 110.118 172.57 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.407 0 N-CA-C 111.859 -0.496 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 98' ' ' ALA . 17.5 ptpt -105.06 140.32 38.41 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 178.11 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.42 HD11 ' HB ' ' A' ' 97' ' ' ILE . 2.8 pp -101.03 161.58 3.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.516 -179.078 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 73.3 m -138.47 161.93 35.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.019 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.4 mt -103.75 167.74 9.59 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.795 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.0 t -57.81 156.52 8.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.143 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -50.8 -36.33 36.6 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.282 -178.012 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.427 ' O ' ' HD2' ' A' ' 123' ' ' PRO . 19.4 m170 -67.06 -21.58 65.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.591 -172.046 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -68.65 -36.55 78.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.217 -178.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.58 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 26.8 ttpp -60.97 -49.52 88.74 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -174.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.58 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 20.7 Cg_exo -66.82 -39.41 14.86 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 121.662 1.575 . . . . 0.0 112.19 174.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 51.4 tp -59.69 -49.28 78.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.129 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.42 ' O ' HG23 ' A' ' 129' ' ' VAL . 58.9 t-105 -57.62 -52.21 66.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.908 -176.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.09 -13.29 62.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.597 -176.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -91.82 -26.73 18.38 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.944 0.402 . . . . 0.0 110.376 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -85.35 -44.46 12.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.209 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.552 HG13 ' HA ' ' A' ' 130' ' ' PRO . 91.9 t -51.97 138.9 34.07 Favored Pre-proline 0 N--CA 1.471 0.577 0 O-C-N 123.704 0.627 . . . . 0.0 111.093 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.552 ' HA ' HG13 ' A' ' 129' ' ' VAL . 4.7 Cg_exo -81.48 -152.38 0.78 Allowed 'Cis proline' 0 C--N 1.353 0.814 0 C-N-CA 124.574 -1.011 . . . . 0.0 113.118 3.109 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm 76.02 -20.67 0.35 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.657 0.783 . . . . 0.0 111.322 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.8 -179.28 7.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.74 0.305 . . . . 0.0 110.546 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -179.86 -179.57 48.79 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.14 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.457 HD21 ' HZ ' ' A' ' 84' ' ' PHE . 55.5 tp -66.75 -37.21 84.19 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 122.625 0.37 . . . . 0.0 111.204 -176.449 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.31 -38.8 77.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.406 0.622 . . . . 0.0 110.404 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -71.67 -32.45 67.89 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.009 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 57.5 tp -66.55 -45.57 78.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.454 -179.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -35.94 74.77 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.119 -177.397 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -76.63 -50.47 13.69 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 86.9 mt -89.58 -14.06 35.89 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -173.133 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -108.16 -63.42 0.56 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.632 -179.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.505 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 60.9 tp -67.59 -40.83 84.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.471 0.177 . . . . 0.0 111.462 -175.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.08 -61.48 6.52 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.24 -0.505 . . . . 0.0 113.259 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' PRO . . . . . 0.439 ' O ' HG23 ' A' ' 148' ' ' VAL . 45.0 Cg_exo -59.17 -33.76 98.3 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.58 2.186 . . . . 0.0 112.568 177.105 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -62.7 -41.74 99.29 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.036 0.446 . . . . 0.0 110.424 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 97.9 mt -59.72 -36.14 75.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.628 177.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.79 -9.7 58.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.556 -178.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 144' ' ' PRO . 60.4 t -91.82 -56.04 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.668 0.271 . . . . 0.0 111.135 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -89.63 -41.59 11.88 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -172.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.563 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.9 mm -56.2 -52.86 69.53 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -172.481 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.563 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 51.0 Cg_exo -55.44 -40.87 83.13 Favored 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.04 1.827 . . . . 0.0 112.356 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -68.79 -39.99 79.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.234 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.561 HD12 ' HD2' ' A' ' 156' ' ' LYS . 21.7 tp -64.41 -28.93 70.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.983 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 150' ' ' ILE . 78.8 mt -63.92 -53.28 46.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.571 177.291 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -69.64 -14.43 62.81 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.175 0.512 . . . . 0.0 110.22 -178.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' LYS . . . . . 0.561 ' HD2' HD12 ' A' ' 153' ' ' LEU . 28.1 ttmt -69.03 -13.55 62.51 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.769 -178.259 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 91.6 -16.7 58.54 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.275 173.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.9 p -73.45 -31.58 33.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.701 0.286 . . . . 0.0 110.932 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.556 HD11 HD23 ' A' ' 153' ' ' LEU . 57.4 mt . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.496 178.569 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.434 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 120.726 0.298 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.482 ' O ' HG23 ' A' ' 10' ' ' VAL . 22.2 m -57.78 -54.74 43.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.355 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -62.53 -36.41 82.5 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.496 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.2 tpm_? -61.34 -44.5 97.08 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.794 0.331 . . . . 0.0 110.435 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.464 ' O ' HG13 ' A' ' 13' ' ' ILE . 92.0 t -67.5 -46.58 82.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.818 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 6' ' ' THR . 88.7 t -58.01 -45.28 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.885 -177.315 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.2 m -65.7 -19.37 65.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -103.59 13.22 33.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.655 0.264 . . . . 0.0 111.266 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 9' ' ' VAL . 52.1 mt -122.4 89.53 49.3 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.04 161.06 5.34 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.549 2.833 . . . . 0.0 113.723 -175.157 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.433 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 35.6 m -97.56 179.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.983 -179.14 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.999 HD21 ' HB3' ' A' ' 35' ' ' GLU . 7.1 mp -108.1 154.08 22.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.271 -176.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.555 ' HG2' ' OE1' ' A' ' 34' ' ' GLU . 36.1 mmtm -78.85 -66.47 0.86 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.536 0.684 . . . . 0.0 109.176 171.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.4 m -75.68 126.64 31.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.686 -176.074 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -120.77 81.82 1.82 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.415 0.626 . . . . 0.0 109.887 171.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -125.83 -173.38 2.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.895 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -127.27 -177.19 14.75 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.204 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.473 ' HD2' ' O ' ' A' ' 88' ' ' ILE . 39.3 Cg_exo -61.94 -5.4 6.11 Favored 'Trans proline' 0 CA--C 1.533 0.45 0 C-N-CA 123.265 2.644 . . . . 0.0 113.254 -179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.3 mtm105 -67.22 -41.64 85.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.305 0.574 . . . . 0.0 110.015 175.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.546 ' HB3' HD23 ' A' ' 27' ' ' LEU . 5.6 m-20 -92.44 95.11 9.46 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.102 177.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -58.69 -47.17 85.44 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -170.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -72.33 -38.69 68.57 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.085 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.546 HD23 ' HB3' ' A' ' 24' ' ' ASP . 3.6 mm? -68.58 -29.19 67.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.003 0.43 . . . . 0.0 110.252 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.49 ' O ' HD23 ' A' ' 32' ' ' LEU . 63.3 t-105 -62.24 -47.69 83.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.978 175.491 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 50.7 t -57.26 -35.1 47.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.644 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -70.2 -39.01 75.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.911 176.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.691 ' NH2' ' HG3' ' A' ' 91' ' ' PRO . 27.5 ttt-85 -64.26 -39.78 94.65 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.054 -0.351 . . . . 0.0 110.054 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.49 HD23 ' O ' ' A' ' 28' ' ' TRP . 4.0 mm? -52.72 -58.48 6.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.002 177.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -61.7 -35.48 78.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 121.248 -0.181 . . . . 0.0 111.105 -177.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.555 ' OE1' ' HG2' ' A' ' 17' ' ' LYS . 46.0 mm-40 -62.34 -54.63 37.68 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.484 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.999 ' HB3' HD21 ' A' ' 16' ' ' LEU . 15.5 pt-20 -77.57 -27.08 51.33 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.515 -177.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.551 ' O ' HG13 ' A' ' 40' ' ' ILE . 2.0 m-85 -55.06 -45.0 75.26 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 169.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -59.98 -41.58 92.31 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.86 0.362 . . . . 0.0 110.598 176.252 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.3 t -60.81 -43.7 97.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.938 176.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.481 ' O ' HG23 ' A' ' 43' ' ' VAL . 79.2 mt -61.35 -49.97 74.81 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.878 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.0 mt -53.1 -43.36 48.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.58 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.87 -44.26 97.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.682 0.277 . . . . 0.0 110.49 -179.297 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -66.8 -41.3 87.79 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.854 0.359 . . . . 0.0 110.204 177.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.509 HG12 ' HE2' ' A' ' 47' ' ' LYS . 80.4 t -59.92 -42.93 91.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.731 178.385 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 44.0 mt-10 -55.83 -54.08 48.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.506 177.213 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -61.13 -50.26 73.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.662 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.5 ' OD1' ' HA ' ' A' ' 52' ' ' ASP . 18.1 t-20 -72.39 -32.46 66.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.285 -169.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.509 ' HE2' HG12 ' A' ' 43' ' ' VAL . 42.8 mtmt -71.33 -45.53 62.78 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.845 176.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -69.61 -18.73 63.63 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.236 0.541 . . . . 0.0 110.226 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.13 -2.3 47.88 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.806 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.5 t70 59.62 37.7 22.39 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.842 0.829 . . . . 0.0 109.329 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -133.44 29.29 3.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.135 -173.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.5 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 9.6 p-10 -69.16 105.34 2.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.691 0.758 . . . . 0.0 110.012 178.232 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 43.5 p-90 -108.94 10.43 26.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.309 -170.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 37.2 p90 -158.05 156.93 31.94 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.651 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.426 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 21.6 mmm180 -130.08 123.77 31.23 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.99 -1.004 . . . . 0.0 108.934 171.351 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 52.0 mt -123.56 124.62 43.22 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.149 0.5 . . . . 0.0 110.63 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -116.6 150.17 38.48 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.3 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.4 m -106.77 147.63 29.43 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.059 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -77.78 172.33 13.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 172.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -62.06 -23.45 66.5 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -175.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -91.99 -20.68 21.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.694 -177.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.66 16.9 80.01 Favored Glycine 0 C--O 1.228 -0.223 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.588 -175.164 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.0 p -98.79 -16.72 18.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.969 0.414 . . . . 0.0 111.367 -176.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -136.99 125.85 24.12 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.497 179.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 34.1 m95 -109.42 137.65 46.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.1 p90 -145.08 160.26 41.68 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.463 -176.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.426 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 162.75 -159.33 31.68 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.33 -0.938 . . . . 0.0 112.51 178.079 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -121.23 146.83 46.4 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.898 0.38 . . . . 0.0 110.972 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 51.1 t -112.34 123.96 51.42 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 168.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.456 ' HD1' ' HG2' ' A' ' 79' ' ' GLU . 6.9 m0 -106.02 122.07 45.41 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.788 -177.198 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -118.74 118.66 32.22 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 176.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 30.8 mm -99.88 119.95 48.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -127.62 115.34 18.62 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.04 -176.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.473 ' C ' HD22 ' A' ' 75' ' ' LEU . 39.7 m-20 67.65 -85.8 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 124.027 0.829 . . . . 0.0 110.432 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.473 HD22 ' C ' ' A' ' 74' ' ' ASP . 3.0 mm? -137.04 0.63 2.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.882 0.372 . . . . 0.0 110.108 178.129 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.8 mt -108.69 149.61 28.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.335 -170.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -110.19 119.64 39.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.784 179.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -110.06 115.13 29.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.456 ' HG2' ' HD1' ' A' ' 70' ' ' TRP . 30.5 mt-10 -100.63 136.56 40.32 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.635 -175.744 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -128.93 116.76 19.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.814 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.73 131.83 36.74 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 176.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.461 HG22 HG22 ' A' ' 99' ' ' VAL . 23.3 pt -126.21 147.9 30.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.909 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -155.09 141.6 18.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.761 178.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.605 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 44.7 p90 -156.25 147.29 22.18 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.362 0.601 . . . . 0.0 111.652 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.544 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 5.2 p-10 -92.26 156.29 17.39 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.433 178.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.7 mm -104.88 90.87 3.83 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.403 179.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.544 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 71.5 Cg_exo -48.53 148.78 7.7 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.3 2.667 . . . . 0.0 113.189 -178.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.473 ' O ' ' HD2' ' A' ' 22' ' ' PRO . 50.3 mm -58.43 -27.54 33.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.1 -178.74 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.758 HG22 ' HB ' ' A' ' 92' ' ' THR . 4.1 m -93.52 17.58 11.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.964 0.411 . . . . 0.0 111.588 -178.173 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 91' ' ' PRO . 87.4 t80 -68.56 138.24 91.07 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 174.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.691 ' HG3' ' NH2' ' A' ' 31' ' ' ARG . 35.7 Cg_endo -97.83 12.35 33.59 Favored 'Cis proline' 0 C--N 1.346 0.446 0 C-N-CA 124.377 -1.093 . . . . 0.0 113.096 -1.327 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.758 ' HB ' HG22 ' A' ' 89' ' ' THR . 24.3 m -56.38 -35.82 68.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.401 0.619 . . . . 0.0 109.805 177.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 52.5 m -117.86 125.31 50.27 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.368 -0.833 . . . . 0.0 108.761 171.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.402 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -67.76 144.75 97.67 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-O 120.779 0.323 . . . . 0.0 111.528 -174.603 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 9.4 Cg_exo -71.52 124.91 10.72 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.777 2.318 . . . . 0.0 111.8 177.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.713 ' HB3' ' HD2' ' A' ' 114' ' ' LYS . 36.9 mt-10 -75.94 103.42 6.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.792 178.678 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.605 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 58.3 mt -70.01 136.36 26.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.626 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -112.96 130.1 56.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.686 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.461 HG22 HG22 ' A' ' 82' ' ' ILE . 36.3 t -121.56 88.18 46.3 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.944 179.23 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -55.6 -29.53 70.54 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.999 2.466 . . . . 0.0 113.308 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -66.73 -36.25 82.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.777 0.322 . . . . 0.0 111.315 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 85.3 mt -90.96 1.06 57.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.972 0.415 . . . . 0.0 111.059 -177.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -65.24 109.58 2.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.821 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 98.58 -27.57 18.98 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.363 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -80.67 -12.41 59.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.888 0.375 . . . . 0.0 111.71 -175.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 C--N 1.322 -0.596 0 CA-C-O 120.923 0.392 . . . . 0.0 110.427 177.9 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.685 0 N-CA-C 112.437 -0.265 . . . . 0.0 112.437 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.713 ' HD2' ' HB3' ' A' ' 96' ' ' GLU . 71.3 mmtt -85.68 137.99 32.44 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.598 0.237 . . . . 0.0 110.625 -176.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.465 ' CD1' ' HB ' ' A' ' 97' ' ' ILE . 46.7 pt -76.83 157.61 5.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.428 0.633 . . . . 0.0 111.918 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 49.5 t -125.29 113.53 17.73 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.1 173.282 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 88.3 mt -81.9 -82.2 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.984 -176.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.6 t -163.39 154.42 16.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.368 -177.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -62.54 -30.03 71.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.504 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.6 t60 -73.4 -20.05 60.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.215 -175.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -68.54 -40.01 80.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.892 -174.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -61.35 -55.05 47.09 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -174.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.11 -32.77 83.35 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.702 1.601 . . . . 0.0 112.164 175.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.53 -43.51 76.58 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.892 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.534 ' O ' HG23 ' A' ' 129' ' ' VAL . 70.0 t-105 -61.56 -57.48 11.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.53 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.36 -30.06 68.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.929 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -77.7 -23.04 49.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.814 0.34 . . . . 0.0 111.529 -177.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.405 ' HB2' ' HE2' ' A' ' 132' ' ' PHE . 34.0 m-80 -106.0 10.29 32.29 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.185 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 125' ' ' TRP . 97.6 t -87.63 139.68 31.5 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.454 ' HA ' HG13 ' A' ' 129' ' ' VAL . 64.8 Cg_endo -95.6 -146.19 0.16 OUTLIER 'Cis proline' 0 C--N 1.353 0.77 0 C-N-CA 124.972 -0.845 . . . . 0.0 113.781 5.133 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.433 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 49.3 mtmt 75.07 11.06 3.63 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.698 -176.353 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' PHE . . . . . 0.405 ' HE2' ' HB2' ' A' ' 128' ' ' ASN . 0.2 OUTLIER -91.64 144.61 25.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.985 -179.863 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -146.57 167.42 28.09 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 178.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 43.6 tp -55.24 -33.13 62.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.143 0.471 . . . . 0.0 111.692 -177.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.87 -47.27 77.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.987 0.422 . . . . 0.0 111.43 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -71.29 -38.45 71.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.463 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.406 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 67.2 tp -65.33 -44.57 87.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.43 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 15.8 tpt -66.56 -47.97 71.12 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.927 0.394 . . . . 0.0 110.916 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.417 ' O ' ' HD3' ' A' ' 144' ' ' PRO . . . -71.2 -44.8 64.7 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.131 -175.024 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.8 mt -94.74 -0.24 54.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.796 0.331 . . . . 0.0 111.665 -174.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -113.24 -75.12 0.69 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.282 -0.961 . . . . 0.0 112.722 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.45 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 9.8 tt -67.49 -36.56 81.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.676 0.274 . . . . 0.0 110.832 -175.591 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.67 -61.85 6.86 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.177 -0.535 . . . . 0.0 113.274 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' PRO . . . . . 0.444 ' O ' HG23 ' A' ' 148' ' ' VAL . 32.9 Cg_exo -60.14 -33.04 95.32 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.549 2.166 . . . . 0.0 112.53 177.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 60.3 t90 -60.08 -39.55 86.48 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.903 0.383 . . . . 0.0 110.747 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 95.2 mt -58.04 -41.81 84.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.751 178.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.57 -15.06 63.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.819 -176.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 144' ' ' PRO . 56.3 t -88.06 -42.49 14.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.469 -177.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -104.02 -44.38 5.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -173.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.551 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.3 mm -55.99 -52.74 70.17 Favored Pre-proline 0 CA--C 1.54 0.562 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -170.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.551 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 51.8 Cg_exo -56.46 -31.62 86.47 Favored 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 122.01 1.807 . . . . 0.0 112.929 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -86.96 -26.72 23.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.833 0.349 . . . . 0.0 110.731 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.501 HD23 HD11 ' A' ' 159' ' ' ILE . 24.8 tp -70.21 -40.52 74.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.998 178.102 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 73.6 mt -63.19 -44.51 99.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.229 176.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.463 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . 6.3 tp60 -69.44 -22.94 63.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.06 -177.708 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -83.19 -2.21 54.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.169 0.509 . . . . 0.0 110.303 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 72.05 24.18 76.88 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 115.817 -0.629 . . . . 0.0 113.025 175.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 40.2 t -84.53 -31.34 7.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.216 0.531 . . . . 0.0 110.722 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.501 HD11 HD23 ' A' ' 153' ' ' LEU . 53.8 mt . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.53 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.457 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 CA--C 1.529 0.166 0 CA-C-O 120.723 0.297 . . . . 0.0 111.395 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.7 m -64.0 -36.67 84.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.054 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.17 -37.17 72.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.008 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -61.46 -38.84 88.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.894 0.378 . . . . 0.0 110.416 175.421 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 5' ' ' ALA . 88.5 t -57.28 -52.73 52.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.414 176.061 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 65.0 t -64.52 -35.32 74.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.504 -177.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.6 m -70.45 -36.28 73.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.801 -177.107 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.431 ' HB3' HD21 ' A' ' 45' ' ' ASN . 43.8 mt-10 -96.52 -16.93 20.84 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -176.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.446 HD12 HG13 ' A' ' 9' ' ' VAL . 25.6 mt -108.56 90.21 7.0 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 177.059 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -40.12 128.24 2.15 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.959 3.106 . . . . 0.0 113.872 -174.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.5 m -76.26 146.03 9.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.654 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mp -100.94 131.64 46.72 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.109 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -110.7 -29.38 8.03 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.16 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.6 m -68.32 97.17 0.71 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.455 175.584 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -134.76 128.41 32.82 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.809 0.337 . . . . 0.0 110.588 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -146.97 -37.39 0.22 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.514 178.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.47 161.36 10.89 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.935 -0.65 . . . . 0.0 111.599 178.055 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -69.47 -7.45 20.99 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.73 2.286 . . . . 0.0 112.303 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.43 ' CG ' HG23 ' A' ' 88' ' ' ILE . 22.8 mmm180 -88.6 -3.01 58.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.718 178.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -112.76 103.55 11.56 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.607 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -61.09 -52.18 66.01 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -170.28 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.607 ' HG3' HD22 ' A' ' 27' ' ' LEU . 11.0 pt-20 -72.87 -38.92 66.85 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.576 -0.45 . . . . 0.0 112.018 -171.867 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.607 HD22 ' HG3' ' A' ' 26' ' ' GLU . 4.0 mm? -71.98 -31.15 65.98 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.682 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 -68.21 -33.0 73.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.131 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 25' ' ' ARG . 67.0 t -58.2 -49.98 79.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.641 177.007 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -61.08 -47.25 87.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.784 0.326 . . . . 0.0 110.549 178.301 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.566 HH22 ' HA2' ' A' ' 133' ' ' GLY . 45.9 ttt-85 -64.44 -35.24 80.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -176.267 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.419 HD22 ' HA ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -60.59 -53.17 60.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.81 -177.929 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? -67.06 -41.14 86.96 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.046 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -64.71 -38.06 89.7 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.868 -179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -66.85 -36.32 82.07 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.442 ' O ' HG13 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -65.0 -46.94 79.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.25 178.731 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -63.03 -34.75 78.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.814 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -60.16 -46.64 88.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.866 174.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.524 ' O ' HG23 ' A' ' 43' ' ' VAL . 84.1 mt -61.02 -51.5 68.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.807 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.461 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 80.5 mt -56.81 -40.84 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.339 -178.339 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -45.6 87.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.037 0.446 . . . . 0.0 110.304 178.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -67.63 -34.97 78.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.341 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 39' ' ' LEU . 84.1 t -62.35 -40.78 89.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.319 175.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 49.3 mt-10 -58.78 -48.75 80.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.906 0.384 . . . . 0.0 110.198 175.125 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.431 HD21 ' HB3' ' A' ' 12' ' ' GLU . 6.5 m-20 -57.48 -40.25 78.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.837 177.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.52 -51.99 65.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.795 176.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.45 ' HE2' HG12 ' A' ' 43' ' ' VAL . 65.3 mttm -64.29 -28.86 70.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.384 -176.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -59.17 -41.03 87.44 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.638 175.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -90.56 -1.53 57.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.143 0.496 . . . . 0.0 110.49 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.0 t70 69.38 10.54 7.78 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.853 -178.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -95.76 68.17 2.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.521 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -81.67 86.6 6.38 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -97.85 -2.76 40.13 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -165.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -159.13 153.27 23.64 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.777 -0.769 . . . . 0.0 111.666 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -134.62 128.54 33.34 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 171.302 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.9 tp -131.08 125.13 32.38 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.58 -173.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -136.3 169.14 18.13 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.406 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 61.5 p -152.25 177.9 10.07 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.126 -179.025 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.466 ' OD1' ' HB2' ' A' ' 61' ' ' GLU . 4.2 p30 -71.52 163.89 26.88 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 168.569 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -73.38 -9.89 59.16 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.787 0.327 . . . . 0.0 111.737 -174.482 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.466 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 9.1 mm-40 -74.57 -36.43 63.06 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 171.171 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.99 20.97 69.11 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.509 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.3 p -90.74 -15.13 30.77 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.872 0.368 . . . . 0.0 111.556 -178.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 43.4 mtm180 -146.31 126.17 13.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.219 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.406 ' CD2' ' HB3' ' A' ' 58' ' ' SER . 50.0 m95 -114.26 158.27 21.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.693 -175.441 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -154.95 152.72 30.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.317 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.41 -162.61 29.47 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.336 178.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.413 ' HE3' ' HB2' ' A' ' 68' ' ' LYS . 35.6 ttmt -152.63 147.0 25.63 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.946 -0.391 . . . . 0.0 109.946 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 58.8 m -118.41 135.23 54.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.357 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 31.3 m-90 -114.52 121.69 44.28 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 176.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 47.8 t80 -120.66 122.95 41.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.195 0.521 . . . . 0.0 110.56 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 27.8 mm -102.87 114.14 41.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.557 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 14.5 t60 -130.21 105.23 7.78 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.137 179.677 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.3 t70 48.08 74.07 0.18 Allowed 'General case' 0 N--CA 1.465 0.297 0 O-C-N 124.307 1.004 . . . . 0.0 111.914 177.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 72.65 -33.52 0.27 Allowed 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.276 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.5 mt -74.87 123.56 25.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.032 0.444 . . . . 0.0 111.19 -178.052 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -115.66 119.01 34.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.213 177.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.417 ' CE1' ' HD2' ' A' ' 71' ' ' TYR . 7.1 p90 -140.03 144.96 37.17 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.503 177.955 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.04 148.8 50.12 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.333 -174.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -120.61 126.08 49.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.672 -177.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -88.2 114.85 25.23 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 99' ' ' VAL . 47.9 pt -124.89 150.07 29.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.282 0.563 . . . . 0.0 112.137 -172.049 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -156.18 159.58 39.1 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.649 175.092 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.506 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 43.7 p90 -165.13 163.61 20.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.92 0.39 . . . . 0.0 110.741 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -112.16 157.6 20.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.654 -178.568 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.438 ' HA ' ' HD2' ' A' ' 87' ' ' PRO . 49.5 mm -107.26 90.32 5.57 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.657 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.438 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 19.8 Cg_endo -56.37 157.86 17.06 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 122.996 2.464 . . . . 0.0 112.948 -177.625 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.43 HG23 ' CG ' ' A' ' 23' ' ' ARG . 70.1 mt -61.85 -26.41 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.289 -179.314 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.7 p -81.41 9.24 7.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.112 -0.494 . . . . 0.0 112.228 -176.123 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.418 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 67.5 t80 -72.93 141.18 81.48 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.522 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.418 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 97.0 Cg_endo -96.68 14.23 36.98 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.335 -1.111 . . . . 0.0 113.53 1.829 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.6 m -64.6 -35.53 81.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.372 0.606 . . . . 0.0 110.343 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.0 m -111.99 131.34 55.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 174.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.461 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -77.59 143.29 67.62 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 120.634 0.254 . . . . 0.0 111.166 -178.049 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 5.9 Cg_exo -79.97 123.51 5.19 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.208 2.606 . . . . 0.0 111.357 176.471 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 1.019 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 1.4 mp0 -84.59 126.16 33.09 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.178 -179.096 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.506 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 61.7 mt -72.86 134.6 29.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.459 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.436 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -105.89 128.93 54.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.721 0.296 . . . . 0.0 110.358 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.525 HG22 HG22 ' A' ' 82' ' ' ILE . 14.3 t -128.41 86.44 57.8 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.404 -178.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.8 -27.03 83.99 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 122.911 2.408 . . . . 0.0 112.814 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -65.11 -27.37 68.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.122 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 72.7 mt -96.87 2.94 52.31 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.689 -176.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -64.15 118.76 9.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.792 0.329 . . . . 0.0 110.746 178.5 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 85.78 -21.94 13.17 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.995 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -74.61 -45.87 42.19 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -179.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.7 t . . . . . 0 C--N 1.325 -0.476 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.628 176.331 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.429 0 CA-C-O 120.48 -0.067 . . . . 0.0 112.987 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 1.019 ' HD3' ' HB2' ' A' ' 96' ' ' GLU . 92.8 mttt -100.42 158.14 16.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.107 0.48 . . . . 0.0 111.211 -177.104 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 39.5 pt -78.96 176.57 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.846 -176.145 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 48.3 t -124.46 154.31 40.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.018 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 89.7 mt -124.97 -171.14 2.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.475 -176.796 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 7.1 t -89.91 158.48 17.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.919 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -62.93 -32.54 73.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.879 -177.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -73.95 -18.29 60.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.252 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -71.57 -38.27 70.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.344 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.465 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 73.4 mmtt -55.67 -58.76 13.97 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -176.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.465 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 38.2 Cg_endo -66.7 -34.61 31.22 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 121.744 1.629 . . . . 0.0 111.871 178.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.4 tp -60.83 -46.34 90.95 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.595 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.516 ' CZ3' HD13 ' A' ' 137' ' ' LEU . 40.8 t-105 -57.83 -57.08 14.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.698 178.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.87 -24.23 67.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.258 -174.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 -85.28 -20.52 29.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.714 0.292 . . . . 0.0 110.975 -177.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -105.81 36.53 2.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.125 0.488 . . . . 0.0 111.465 -177.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 98.2 t -116.77 130.96 24.18 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.469 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 89.6 Cg_endo -85.03 -149.64 0.49 Allowed 'Cis proline' 0 C--N 1.348 0.505 0 C-N-CA 123.973 -1.261 . . . . 0.0 113.267 1.693 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 99.3 mttt 75.98 9.16 3.41 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.862 0.865 . . . . 0.0 111.027 -174.417 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -114.94 165.6 12.69 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.204 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.566 ' HA2' HH22 ' A' ' 31' ' ' ARG . . . -163.15 175.17 39.49 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.957 -178.094 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 44.6 tp -67.61 -38.79 84.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.724 0.297 . . . . 0.0 110.606 -177.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.7 -35.94 77.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.399 0.618 . . . . 0.0 110.415 176.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -71.55 -33.5 69.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.305 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.516 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 54.8 tp -64.21 -35.62 81.39 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.844 177.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.1 mmt -69.8 -45.03 68.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.919 0.39 . . . . 0.0 110.873 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.59 -44.12 67.98 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.856 -177.271 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.3 mt -96.42 0.85 51.06 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -174.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.54 -68.78 0.22 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.812 -178.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 58.6 tp -65.38 -41.0 94.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.663 0.268 . . . . 0.0 111.104 -176.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.0 -61.9 6.46 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.413 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' PRO . . . . . 0.488 ' O ' HG23 ' A' ' 148' ' ' VAL . 24.0 Cg_endo -64.19 -30.37 64.71 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.492 2.128 . . . . 0.0 112.728 177.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 85.4 t90 -59.66 -45.93 90.56 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.016 0.436 . . . . 0.0 110.479 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 96.7 mt -58.53 -35.36 72.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.953 179.021 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.28 0.41 32.9 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -176.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 144' ' ' PRO . 89.6 t -95.0 -55.39 6.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.893 0.378 . . . . 0.0 111.098 178.208 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -96.26 -41.3 8.74 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -173.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.554 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 44.6 mm -55.96 -53.61 61.32 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -169.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.554 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 50.9 Cg_exo -54.88 -42.73 66.13 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.853 1.702 . . . . 0.0 112.302 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -74.44 -29.59 61.55 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.476 0.655 . . . . 0.0 110.441 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.54 ' HB3' HD11 ' A' ' 159' ' ' ILE . 13.9 tp -69.1 -34.15 74.63 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.642 178.72 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 150' ' ' ILE . 79.8 mt -63.98 -43.21 97.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.375 175.106 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -66.11 -28.05 68.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.187 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' LYS . . . . . 0.52 ' HE2' HD12 ' A' ' 153' ' ' LEU . 37.2 mtmm -76.72 -20.6 56.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.816 0.341 . . . . 0.0 110.73 177.426 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 92.86 -8.02 76.58 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.916 -0.659 . . . . 0.0 114.045 170.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.4 p -67.06 -30.61 50.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 117.012 0.406 . . . . 0.0 111.642 -175.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.54 HD11 ' HB3' ' A' ' 153' ' ' LEU . 36.3 mt . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.518 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.473 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 120.642 0.258 . . . . 0.0 111.281 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.508 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.7 OUTLIER -66.54 -46.89 74.63 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -175.938 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -66.27 -28.0 68.37 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.044 0.45 . . . . 0.0 110.203 -179.039 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -67.7 -43.54 79.85 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.154 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 5' ' ' ALA . 86.2 t -63.41 -40.72 90.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.462 177.037 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 6' ' ' THR . 91.6 t -64.12 -27.29 42.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.95 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.6 m -69.12 -26.68 65.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.737 0.303 . . . . 0.0 110.832 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -94.12 -7.82 41.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.772 0.32 . . . . 0.0 111.843 176.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.448 HG12 ' HB2' ' A' ' 42' ' ' TYR . 45.6 mt -118.55 86.75 29.68 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 175.363 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.656 ' HD2' ' HA ' ' A' ' 38' ' ' SER . 73.2 Cg_exo -49.3 151.99 6.04 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.71 2.94 . . . . 0.0 113.878 -172.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.605 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 30.2 m -85.15 151.83 3.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.414 178.757 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.506 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 7.1 mp -86.81 134.57 33.54 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.316 -179.221 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -91.41 -44.15 9.31 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.064 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 m -66.13 -74.8 0.1 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.627 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.459 ' OD1' ' HG3' ' A' ' 91' ' ' PRO . 38.8 t30 45.83 43.66 10.19 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.333 176.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.59 -84.49 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.378 -176.618 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 167.12 172.54 34.45 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.86 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -71.0 -11.34 29.09 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 123.184 2.589 . . . . 0.0 112.464 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 mtp-105 -66.94 -48.6 68.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.616 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.497 ' HB3' HD23 ' A' ' 27' ' ' LEU . 15.0 m-20 -84.31 104.9 14.72 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.567 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 72.5 mtm180 -58.12 -51.8 68.19 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.551 ' HG2' HD22 ' A' ' 27' ' ' LEU . 1.4 pm0 -72.83 -26.28 61.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.642 0.258 . . . . 0.0 111.405 -177.059 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.551 HD22 ' HG2' ' A' ' 26' ' ' GLU . 3.9 mm? -80.29 -30.95 38.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.709 0.29 . . . . 0.0 110.653 178.029 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.43 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 60.5 t-105 -67.35 -46.83 72.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.167 177.489 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 90.9 t -60.74 -38.36 78.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.943 0.402 . . . . 0.0 110.445 177.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -70.55 -32.89 70.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.901 0.382 . . . . 0.0 110.161 177.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 67.0 ttt-85 -69.21 -33.16 72.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.123 177.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 90.5 mt -58.39 -42.48 87.18 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.975 174.633 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -59.55 -47.52 85.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.282 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -54.94 -48.37 73.23 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.945 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -61.84 -48.2 81.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.084 178.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -65.11 -32.3 73.93 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -178.175 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -58.96 -45.3 90.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.228 0.537 . . . . 0.0 109.994 174.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.656 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 8.3 m -70.77 -44.22 67.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.57 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.448 ' O ' HG23 ' A' ' 43' ' ' VAL . 80.1 mt -60.17 -55.35 34.86 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.25 -179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 85.9 mt -58.05 -46.52 88.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.72 -176.458 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -58.81 -49.03 79.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.649 -0.25 . . . . 0.0 110.786 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.448 ' HB2' HG12 ' A' ' 13' ' ' ILE . 67.6 t80 -63.06 -49.85 72.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.711 0.291 . . . . 0.0 111.106 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.623 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 93.8 t -59.49 -45.69 93.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.904 -177.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -67.29 -35.0 78.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.667 0.27 . . . . 0.0 111.109 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -60.14 -39.9 87.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.749 0.309 . . . . 0.0 110.256 173.495 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.443 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 4.9 m-20 -71.65 -32.44 67.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.856 177.186 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.623 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 34.0 mmtp -57.79 -43.86 85.9 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.209 0.528 . . . . 0.0 110.047 174.132 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -72.76 -21.46 61.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.933 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -91.72 2.17 56.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.361 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.7 t70 63.43 23.76 13.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.583 0.706 . . . . 0.0 110.874 178.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.443 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 16.9 t30 -125.3 66.52 1.14 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.691 0.758 . . . . 0.0 110.48 -178.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -86.27 106.45 17.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.283 -0.871 . . . . 0.0 108.882 174.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 45.9 p-90 -120.61 6.85 10.52 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -168.423 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 69' ' ' CYS . 13.8 p90 -162.83 154.23 17.65 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.826 -0.75 . . . . 0.0 112.157 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -138.54 124.4 19.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.003 167.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.7 tp -117.13 124.54 49.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.709 -177.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -131.55 155.56 47.27 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.841 -174.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.6 t -149.12 176.99 10.01 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.105 0.479 . . . . 0.0 110.827 -177.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -86.11 176.73 7.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.463 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 60' ' ' LYS . 41.5 mmtm -66.53 -19.94 65.9 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -174.753 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -87.36 -17.58 32.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.714 0.292 . . . . 0.0 110.408 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.13 28.63 73.17 Favored Glycine 0 C--N 1.332 0.354 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.552 -179.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.5 p -85.83 -33.1 21.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.04 0.448 . . . . 0.0 111.812 -177.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -129.18 116.1 18.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.661 -179.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -102.33 128.19 49.0 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -136.5 159.46 41.72 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.978 -176.239 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 172.34 -165.75 38.39 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 119.867 -1.159 . . . . 0.0 112.372 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.5 pttm -142.38 139.74 31.82 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.041 0.448 . . . . 0.0 110.624 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 54' ' ' PHE . 45.7 m -112.49 153.31 27.63 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.263 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 26.0 m-90 -117.67 123.57 46.43 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.025 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -117.96 120.56 38.21 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 177.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.9 mm -88.21 114.71 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.892 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -148.35 110.63 4.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.401 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.7 t70 66.83 62.93 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.338 175.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.3 mt 68.57 -13.12 0.33 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.143 -0.935 . . . . 0.0 113.158 173.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 78.9 mt -109.06 136.67 48.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.259 0.552 . . . . 0.0 111.869 -175.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -93.44 112.22 24.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.287 174.244 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -97.86 130.26 44.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.715 -0.22 . . . . 0.0 111.043 -178.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -96.97 136.1 38.02 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -126.19 123.93 39.3 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -88.82 131.3 35.14 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.144 0.497 . . . . 0.0 110.054 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.52 HG22 HG22 ' A' ' 99' ' ' VAL . 46.5 pt -131.78 151.37 35.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.602 -178.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -153.22 155.33 36.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.83 174.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 35.3 p90 -159.05 152.73 23.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.4 176.596 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.54 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 2.2 p30 -97.94 155.24 17.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.673 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.6 mm -106.25 91.12 5.3 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.979 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.54 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 51.4 Cg_exo -54.75 153.89 22.81 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.882 2.388 . . . . 0.0 112.373 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 43.4 mt -61.25 -24.93 34.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.179 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.2 p -88.83 13.32 12.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.049 -178.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.542 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 61.4 t80 -77.59 145.65 71.78 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 176.491 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.542 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 50.2 Cg_endo -91.45 14.25 50.44 Favored 'Cis proline' 0 C--N 1.349 0.571 0 C-N-CA 124.305 -1.123 . . . . 0.0 114.072 0.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 86.4 m -62.02 -44.65 96.25 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.02 0.438 . . . . 0.0 110.128 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 39.2 m -102.64 119.39 38.75 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.036 174.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.71 144.48 91.05 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -78.81 172.73 14.6 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 122.9 2.4 . . . . 0.0 112.868 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.611 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 19.5 mt-10 -107.75 122.18 46.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.197 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.418 ' O ' HG12 ' A' ' 115' ' ' ILE . 34.8 mm -75.55 124.38 33.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.508 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.578 ' HB2' ' HG2' ' A' ' 114' ' ' LYS . . . -109.38 129.53 55.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.928 0.394 . . . . 0.0 111.162 179.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.52 HG22 HG22 ' A' ' 82' ' ' ILE . 21.9 t -123.52 86.58 52.39 Favored Pre-proline 0 C--O 1.237 0.401 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.832 178.141 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.69 -31.36 94.7 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.289 2.659 . . . . 0.0 113.753 -173.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -68.58 -28.8 67.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.842 0.353 . . . . 0.0 110.973 -177.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 82.4 mt -97.42 13.26 30.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.666 0.269 . . . . 0.0 111.175 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.75 106.39 0.4 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.715 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 88.8 -1.15 83.26 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.974 178.198 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -93.55 -16.0 24.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.887 0.375 . . . . 0.0 110.842 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.521 ' HB ' HD21 ' A' ' 153' ' ' LEU . 3.3 t . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.098 -178.033 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.471 0 N-CA-C 112.192 -0.363 . . . . 0.0 112.192 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.611 ' HD3' ' HB2' ' A' ' 96' ' ' GLU . 84.5 mttt -86.31 124.4 32.63 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.084 0.469 . . . . 0.0 110.419 177.245 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.418 HG12 ' O ' ' A' ' 97' ' ' ILE . 37.4 pt -76.73 158.01 5.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.227 -176.543 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 25.8 p -91.94 124.04 35.75 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.604 178.132 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 89.0 mt -86.71 161.1 18.61 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.3 173.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.405 ' O ' ' HB3' ' A' ' 121' ' ' PHE . 6.1 t -69.95 153.51 43.15 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.002 0.43 . . . . 0.0 111.268 -173.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -58.13 -49.62 76.32 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.883 -177.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -68.61 -4.07 14.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.69 -176.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.405 ' HB3' ' O ' ' A' ' 118' ' ' THR . 75.5 t80 -66.13 -47.39 74.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.863 -0.153 . . . . 0.0 110.96 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.535 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 39.6 mmtm -59.65 -51.97 77.29 Favored Pre-proline 0 CA--C 1.537 0.449 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.52 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.535 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 50.0 Cg_exo -56.44 -41.4 76.57 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 121.941 1.761 . . . . 0.0 112.193 174.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 45.4 tp -67.14 -38.04 84.83 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.01 0.433 . . . . 0.0 110.673 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.401 ' O ' HG23 ' A' ' 129' ' ' VAL . 66.8 t-105 -59.07 -57.44 13.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.294 178.05 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.21 -21.7 65.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.562 -178.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 123' ' ' PRO . 48.5 ttt180 -71.54 -29.34 64.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.482 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -98.61 -39.61 8.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.503 -177.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.644 HG13 ' HA ' ' A' ' 130' ' ' PRO . 70.5 t -57.52 142.84 76.35 Favored Pre-proline 0 CA--C 1.533 0.319 0 O-C-N 123.373 0.421 . . . . 0.0 110.261 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.644 ' HA ' HG13 ' A' ' 129' ' ' VAL . 5.0 Cg_exo -79.12 -163.07 3.21 Favored 'Cis proline' 0 C--N 1.355 0.872 0 C-N-CA 125.008 -0.83 . . . . 0.0 113.838 2.088 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.605 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 96.7 mttt 72.81 -18.53 0.35 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.545 0.738 . . . . 0.0 111.611 -178.106 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' PHE . . . . . 0.417 ' H ' ' C ' ' A' ' 130' ' ' PRO . 8.8 t80 -77.01 158.51 30.55 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.131 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -159.63 -179.59 34.54 Favored Glycine 0 C--O 1.236 0.235 0 C-N-CA 119.999 -1.096 . . . . 0.0 112.84 -174.297 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.427 HD12 HD23 ' A' ' 137' ' ' LEU . 58.8 tp -64.38 -37.48 87.67 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 122.999 0.52 . . . . 0.0 111.195 -175.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.63 -40.68 75.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.523 0.678 . . . . 0.0 110.66 177.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -71.32 -35.37 71.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.968 178.248 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.427 HD23 HD12 ' A' ' 134' ' ' LEU . 50.2 tp -66.07 -37.12 85.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.167 178.51 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' MET . . . . . 0.468 ' CE ' ' HA ' ' A' ' 138' ' ' MET . 17.9 mmt -62.21 -48.18 81.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.865 0.364 . . . . 0.0 110.441 177.852 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.89 -49.12 49.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.086 -177.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.4 10.18 37.3 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -172.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -124.23 -67.19 0.2 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.295 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.596 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 53.7 tp -65.79 -42.51 90.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.788 -0.206 . . . . 0.0 111.038 -177.664 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.43 -61.44 6.99 Favored Glycine 0 CA--C 1.525 0.662 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.627 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' PRO . . . . . 0.431 ' O ' HG23 ' A' ' 148' ' ' VAL . 17.0 Cg_endo -59.59 -37.38 88.75 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.555 2.17 . . . . 0.0 112.799 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 68.6 t90 -61.44 -44.38 97.21 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.963 0.411 . . . . 0.0 110.248 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 94.2 mt -59.04 -36.19 74.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.007 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.0 -15.64 61.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.85 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 144' ' ' PRO . 61.4 t -93.02 -53.96 7.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.282 -178.312 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -90.75 -43.53 10.04 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -171.124 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.479 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.3 mm -59.51 -49.91 89.82 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -169.492 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.511 ' HD3' ' O ' ' A' ' 146' ' ' LEU . 50.5 Cg_exo -56.06 -30.81 80.27 Favored 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 122.105 1.87 . . . . 0.0 112.879 -178.879 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -87.26 -37.87 16.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 109.994 177.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.611 HD22 ' HD3' ' A' ' 156' ' ' LYS . 0.2 OUTLIER -59.24 -42.76 91.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.554 -179.865 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 72.0 mt -64.47 -39.63 86.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.018 0.437 . . . . 0.0 110.353 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -66.09 -27.31 67.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.026 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' LYS . . . . . 0.611 ' HD3' HD22 ' A' ' 153' ' ' LEU . 59.6 mtpt -63.93 -22.25 66.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.788 175.705 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 72.74 16.45 77.95 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.409 178.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 17.0 m -92.46 -6.18 10.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.072 0.463 . . . . 0.0 111.308 -178.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.469 HD11 HD12 ' A' ' 153' ' ' LEU . 55.6 mt . . . . . 0 C--N 1.322 -0.606 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.125 175.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.469 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.249 0 CA-C-O 120.53 0.205 . . . . 0.0 110.969 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.452 ' O ' HG23 ' A' ' 10' ' ' VAL . 6.0 m -56.5 -54.52 44.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.097 -178.076 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -64.91 -31.89 73.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.091 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -64.3 -44.36 91.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.606 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 5' ' ' ALA . 66.0 t -62.86 -38.51 82.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.469 179.307 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 6' ' ' THR . 61.6 t -62.66 -33.1 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.178 179.708 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -69.92 -25.66 63.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.479 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.428 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 42.6 mt-10 -93.63 -13.07 28.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.882 0.373 . . . . 0.0 111.227 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.7 mt -113.76 87.06 11.63 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.428 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 50.9 Cg_exo -54.58 147.04 50.44 Favored 'Trans proline' 0 C--O 1.237 0.463 0 C-N-CA 123.453 2.768 . . . . 0.0 113.175 -173.234 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.48 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.7 m -72.34 161.38 4.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.192 176.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.719 HD23 ' HG3' ' A' ' 31' ' ' ARG . 10.2 mp -79.97 134.7 36.27 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.114 0.483 . . . . 0.0 111.532 -173.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.477 ' HB3' ' HG3' ' A' ' 34' ' ' GLU . 59.6 tttm -60.25 -44.08 95.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.852 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.547 HG21 HD12 ' A' ' 27' ' ' LEU . 31.7 m -129.38 130.02 45.49 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.946 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.67 ' HA ' ' HD3' ' A' ' 31' ' ' ARG . 16.8 m120 -120.43 119.63 33.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.752 0.311 . . . . 0.0 110.519 174.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -153.75 170.7 20.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.084 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.45 167.19 42.64 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.291 -178.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -72.56 3.65 4.1 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.397 2.732 . . . . 0.0 113.027 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.613 ' HA ' ' HE ' ' A' ' 23' ' ' ARG . 1.1 mmp_? -94.17 -26.24 16.77 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.308 0.575 . . . . 0.0 109.903 174.256 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -83.43 75.87 9.96 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 172.002 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -53.98 -41.95 68.45 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -169.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -58.25 -52.1 67.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.212 0.53 . . . . 0.0 110.911 179.08 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.547 HD12 HG21 ' A' ' 18' ' ' THR . 3.1 mm? -76.7 -23.51 53.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.743 -177.587 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.559 ' CH2' HG21 ' A' ' 86' ' ' ILE . 28.5 t-105 -64.29 -52.1 60.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.462 175.235 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.5 t -63.5 -33.71 63.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.084 0.468 . . . . 0.0 110.054 178.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -70.28 -42.81 71.6 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.495 178.804 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.719 ' HG3' HD23 ' A' ' 16' ' ' LEU . 51.5 ttp85 -64.54 -42.96 95.38 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 176.32 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -54.53 -50.01 68.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.722 -177.74 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.04 -33.13 71.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.532 0.206 . . . . 0.0 111.143 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.477 ' HG3' ' HB3' ' A' ' 17' ' ' LYS . 71.0 mm-40 -70.23 -45.63 66.12 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.286 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.565 ' HB3' HD21 ' A' ' 16' ' ' LEU . 15.3 pt-20 -75.01 -27.46 60.13 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.161 177.341 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.524 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -55.28 -44.27 75.53 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 169.445 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -63.96 -38.81 92.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.691 176.408 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.9 t -61.44 -40.23 93.71 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.031 -0.532 . . . . 0.0 109.711 174.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.426 ' O ' HG23 ' A' ' 43' ' ' VAL . 52.7 mt -63.31 -40.51 97.54 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.659 174.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 36' ' ' TYR . 77.4 mt -61.43 -35.56 67.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.868 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' A' ' 44' ' ' GLU . 0.5 OUTLIER -66.75 -36.33 82.19 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.115 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -68.74 -47.74 65.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.928 176.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 39' ' ' LEU . 87.4 t -62.05 -32.6 54.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.328 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.448 ' HB3' ' O ' ' A' ' 41' ' ' ARG . 28.1 tt0 -52.89 -59.21 4.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.361 176.188 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -57.21 -36.77 71.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.289 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -64.02 -43.82 94.42 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.679 176.456 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.516 ' HE2' ' HA ' ' A' ' 47' ' ' LYS . 7.6 mmpt? -68.52 -37.01 79.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.78 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -57.9 -35.3 70.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.98 0.419 . . . . 0.0 110.47 177.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -96.23 -2.29 46.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.091 178.513 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.9 t70 60.36 20.93 10.49 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.907 0.861 . . . . 0.0 110.442 -177.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -112.87 60.15 0.64 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.59 -177.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -85.9 86.15 7.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 122.045 0.926 . . . . 0.0 109.902 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -83.22 -7.37 59.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.06 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.47 ' HZ ' HD22 ' A' ' 56' ' ' LEU . 60.6 t80 -115.49 122.39 45.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.829 -173.045 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.68 124.48 38.01 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 176.185 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.47 HD22 ' HZ ' ' A' ' 54' ' ' PHE . 19.3 tp -144.94 124.95 13.53 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.772 -175.176 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -109.09 159.6 16.74 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.031 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 m -132.88 161.74 33.41 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.636 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -93.53 171.74 8.71 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 173.743 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -62.0 -28.3 69.48 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 -175.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.0 -23.7 48.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.791 0.329 . . . . 0.0 110.607 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.21 7.88 84.96 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.954 -0.641 . . . . 0.0 111.584 -172.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.9 p -83.24 -14.85 52.34 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -174.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -134.11 130.54 37.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.064 0.459 . . . . 0.0 111.029 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 46.0 m95 -118.65 126.29 51.62 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.342 175.492 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -139.82 140.3 36.57 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.088 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -175.68 -160.35 23.16 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.216 -0.993 . . . . 0.0 112.554 -178.255 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.537 ' HG2' ' HA ' ' A' ' 81' ' ' ASP . 96.7 mttt -144.19 154.93 43.64 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.956 0.408 . . . . 0.0 110.769 -176.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 62.6 m -112.35 132.13 55.16 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.795 175.278 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.512 ' CD1' ' HG2' ' A' ' 79' ' ' GLU . 3.2 m-90 -107.58 122.59 46.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.213 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -130.45 120.03 23.57 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.058 0.456 . . . . 0.0 109.823 172.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.445 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.7 mp -98.53 117.29 43.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.639 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.441 ' HB3' ' HE2' ' A' ' 78' ' ' TYR . 39.3 t60 -139.06 117.97 12.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.99 -176.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 60.34 52.21 4.95 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.812 0.695 . . . . 0.0 111.037 176.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.0 mt 70.62 1.96 3.91 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.631 176.228 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.1 mt -111.08 128.71 55.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.088 0.471 . . . . 0.0 111.512 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -93.24 107.22 19.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.424 174.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.441 ' HE2' ' HB3' ' A' ' 73' ' ' HIS . 77.8 m-85 -89.93 123.37 33.8 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.512 ' HG2' ' CD1' ' A' ' 70' ' ' TRP . 33.1 mt-10 -111.08 134.92 52.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.809 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -132.93 117.72 18.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.537 ' HA ' ' HG2' ' A' ' 68' ' ' LYS . 5.7 p-10 -87.84 136.91 32.75 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.156 0.503 . . . . 0.0 111.031 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.499 HG22 ' HB ' ' A' ' 99' ' ' VAL . 37.0 pt -136.22 149.66 27.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.486 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.48 153.04 37.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.351 0.596 . . . . 0.0 110.938 173.488 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -161.7 158.2 25.58 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.109 177.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -107.16 173.29 6.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.143 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.559 HG21 ' CH2' ' A' ' 28' ' ' TRP . 50.4 mm -111.81 89.22 10.92 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.922 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 32.3 Cg_endo -63.89 162.61 28.18 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.446 2.097 . . . . 0.0 111.905 177.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.439 ' N ' HD12 ' A' ' 88' ' ' ILE . 3.0 mp -61.97 -23.41 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.271 -177.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.545 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 12.1 p -68.36 -18.74 64.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.873 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.597 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 62.8 t80 -77.02 141.32 67.46 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.597 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 83.7 Cg_endo -95.44 11.39 44.44 Favored 'Cis proline' 0 N--CA 1.458 -0.595 0 C-N-CA 124.454 -1.061 . . . . 0.0 113.749 2.706 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 33.3 m -60.77 -42.17 96.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.428 0.632 . . . . 0.0 110.18 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.545 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 31.9 m -121.7 125.98 47.88 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.464 175.251 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.68 144.0 98.75 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.605 -0.271 . . . . 0.0 110.713 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.414 ' HD3' ' CD1' ' A' ' 90' ' ' TYR . 82.6 Cg_endo -82.0 150.18 15.9 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.65 2.234 . . . . 0.0 112.135 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -79.94 100.35 8.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.911 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.541 ' HB ' HD11 ' A' ' 115' ' ' ILE . 56.6 mt -67.38 130.75 32.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.18 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -105.19 137.47 42.91 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.947 0.403 . . . . 0.0 110.711 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.499 ' HB ' HG22 ' A' ' 82' ' ' ILE . 3.8 p -128.8 88.09 52.91 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-O 121.478 0.656 . . . . 0.0 110.431 177.201 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 99' ' ' VAL . 16.1 Cg_endo -56.29 -30.47 80.69 Favored 'Trans proline' 0 CA--C 1.529 0.255 0 C-N-CA 123.258 2.638 . . . . 0.0 113.496 -174.201 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -67.79 -40.4 83.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.906 0.384 . . . . 0.0 111.183 -179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.486 HD23 ' HG3' ' A' ' 105' ' ' LYS . 87.7 mt -85.99 5.47 33.16 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -174.276 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.17 -17.12 62.55 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.081 0.467 . . . . 0.0 110.673 -176.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -128.43 11.54 6.39 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.125 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.486 ' HG3' HD23 ' A' ' 102' ' ' LEU . 75.3 mmtt -95.63 -53.16 3.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.261 0.553 . . . . 0.0 109.627 179.095 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.539 ' HB ' HD13 ' A' ' 153' ' ' LEU . 13.3 t . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.529 -176.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.587 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 42.1 mttm -131.89 122.76 26.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.823 -0.189 . . . . 0.0 111.197 -172.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.541 HD11 ' HB ' ' A' ' 97' ' ' ILE . 46.2 pt -113.65 143.71 22.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 172.364 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 49.4 t -119.44 125.86 49.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.777 0.322 . . . . 0.0 110.206 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.565 HD13 ' HA3' ' A' ' 141' ' ' GLY . 47.5 mt -77.65 -80.4 0.11 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.198 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.554 ' OG1' ' HB2' ' A' ' 121' ' ' PHE . 24.0 p -141.85 156.75 45.53 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.67 -43.0 77.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.902 0.382 . . . . 0.0 110.613 -177.073 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' HIS . . . . . 0.442 ' C ' ' HD2' ' A' ' 123' ' ' PRO . 5.9 p80 -76.63 -5.54 48.23 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.56 -176.493 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.554 ' HB2' ' OG1' ' A' ' 118' ' ' THR . 56.4 t80 -71.22 -34.61 70.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.077 0.465 . . . . 0.0 109.868 176.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.639 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 16.6 mtpp -60.56 -52.28 73.86 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.787 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.639 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 31.6 Cg_exo -60.2 -41.25 52.73 Favored 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 121.769 1.646 . . . . 0.0 112.113 172.939 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 52.1 tp -61.31 -44.0 97.93 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.97 -177.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.463 ' O ' HG23 ' A' ' 129' ' ' VAL . 50.4 t-105 -61.42 -57.16 13.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.319 179.274 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.01 -29.43 69.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.954 -0.567 . . . . 0.0 112.037 -176.103 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -66.01 -43.07 88.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.507 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ASN . . . . . 0.525 ' HB2' ' CE2' ' A' ' 132' ' ' PHE . 55.5 m-80 -97.41 -0.11 46.82 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -168.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 125' ' ' TRP . 97.7 t -55.67 136.19 71.37 Favored Pre-proline 0 N--CA 1.466 0.346 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 174.466 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.487 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 70.3 Cg_endo -97.11 -142.25 0.14 OUTLIER 'Cis proline' 0 C--N 1.352 0.712 0 C-N-CA 124.73 -0.946 . . . . 0.0 113.589 4.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.487 ' H ' ' HB2' ' A' ' 130' ' ' PRO . 35.8 mtmm 75.53 1.4 3.61 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.875 0.87 . . . . 0.0 111.119 -176.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' PHE . . . . . 0.525 ' CE2' ' HB2' ' A' ' 128' ' ' ASN . 11.3 m-85 -79.95 160.39 25.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.675 175.134 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -166.01 170.41 40.71 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 -178.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 33.4 tp -59.57 -35.23 73.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.952 0.376 . . . . 0.0 111.306 -174.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.05 -41.31 83.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.06 0.457 . . . . 0.0 110.969 177.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -71.75 -37.1 70.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.506 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 63.7 tp -65.53 -46.53 79.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.245 -178.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 24.2 mmt -67.45 -39.61 85.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.295 -178.137 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.49 -47.53 60.08 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -176.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.8 mt -83.45 -16.44 45.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.314 -175.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.565 ' HA3' HD13 ' A' ' 117' ' ' LEU . . . -112.32 -74.88 0.71 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.316 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 40.6 tp -61.02 -41.96 97.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.77 -62.87 5.77 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 121.074 -0.584 . . . . 0.0 113.423 -177.251 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -66.2 -27.42 48.74 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.285 1.99 . . . . 0.0 112.285 178.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 59.1 t90 -63.52 -52.56 60.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.284 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 91.2 mt -61.62 -32.8 72.96 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.623 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.13 -15.78 63.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.484 -178.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 92.5 t -106.58 -45.23 7.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.792 0.33 . . . . 0.0 110.727 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 23.1 tp10 -67.53 -52.57 37.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.74 -175.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.479 ' O ' HG13 ' A' ' 154' ' ' ILE . 46.3 mm -55.92 -54.35 53.12 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -172.573 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 17.4 Cg_endo -58.35 -39.56 83.15 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 121.84 1.694 . . . . 0.0 112.257 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -68.23 -38.3 81.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.272 0.558 . . . . 0.0 110.246 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.601 HD12 ' HD3' ' A' ' 156' ' ' LYS . 31.1 tp -70.14 -36.03 74.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.948 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 150' ' ' ILE . 77.2 mt -64.25 -41.93 93.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.991 0.424 . . . . 0.0 110.33 176.694 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -67.1 -13.93 62.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.545 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 156' ' ' LYS . . . . . 0.601 ' HD3' HD12 ' A' ' 153' ' ' LEU . 21.4 mtpp -69.17 -16.93 63.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.687 0.279 . . . . 0.0 110.939 174.098 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 81.0 7.49 88.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.366 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 158' ' ' VAL . . . . . 0.714 HG23 HG13 ' A' ' 159' ' ' ILE . 27.7 m -88.31 -15.39 9.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.155 0.502 . . . . 0.0 110.437 178.655 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.714 HG13 HG23 ' A' ' 158' ' ' VAL . 56.8 mt . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.562 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.444 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 120.899 0.381 . . . . 0.0 109.988 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.7 m -59.18 -49.57 77.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.331 -179.182 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.45 ' HD3' ' N ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -68.9 -23.63 64.21 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.533 -177.875 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' A' ' 8' ' ' ARG . 10.2 ttp180 -71.92 -39.13 69.71 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.835 0.35 . . . . 0.0 110.188 177.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 5' ' ' ALA . 95.0 t -61.56 -45.2 99.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.591 177.745 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.9 t -67.17 -33.5 63.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.024 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -73.37 -41.76 63.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.39 -175.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -87.78 -0.76 57.37 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -175.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.427 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 57.8 mt -115.06 89.07 18.75 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 173.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.2 Cg_endo -49.99 151.22 8.92 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.951 3.101 . . . . 0.0 113.904 -172.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.7 m -83.39 157.83 3.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.744 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.428 ' N ' HD12 ' A' ' 16' ' ' LEU . 6.2 mp -100.48 147.63 25.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.509 -177.138 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -83.07 -39.61 20.96 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 175.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.9 m -87.59 121.4 29.97 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.738 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -145.72 120.65 9.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.784 172.335 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -159.07 -55.17 0.06 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.17 -178.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 121.82 -169.19 14.64 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.721 -0.752 . . . . 0.0 111.94 177.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -72.75 5.13 3.08 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.102 2.535 . . . . 0.0 112.04 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -74.23 -30.97 62.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.184 178.67 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.562 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 1.4 t0 -120.38 104.39 9.98 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.482 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 79.1 mtp180 -61.83 -40.92 96.98 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -170.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -66.09 -43.51 87.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.146 0.498 . . . . 0.0 110.244 179.442 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.562 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 3.8 mm? -74.05 -23.53 59.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.668 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 46.5 t-105 -63.65 -39.05 93.36 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.452 174.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.415 HG12 ' HE3' ' A' ' 33' ' ' LYS . 60.0 t -64.5 -41.99 93.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.008 175.267 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 64.4 mm-40 -59.17 -44.99 92.17 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.522 175.149 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.522 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 25.1 tpt180 -60.3 -44.71 95.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.546 178.752 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 1.4 mm? -58.41 -49.29 77.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.061 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 15.2 ptpt -70.76 -38.07 73.45 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.882 -175.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -66.95 -43.3 83.5 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.363 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.579 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 11.4 tp10 -68.88 -30.54 69.07 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.229 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.428 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.2 t80 -64.31 -43.48 94.54 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -60.14 -43.44 95.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.316 0.579 . . . . 0.0 109.858 174.351 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.424 ' HB3' ' O ' ' A' ' 35' ' ' GLU . 16.9 t -56.38 -46.57 80.04 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.848 175.493 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.651 HD23 ' HB2' ' A' ' 135' ' ' ALA . 82.2 mt -61.6 -55.34 31.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.913 178.782 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 36' ' ' TYR . 89.7 mt -52.22 -43.78 39.91 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.098 -178.022 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -45.28 91.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.86 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -71.3 -42.43 68.66 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.049 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.507 HG12 ' HE3' ' A' ' 47' ' ' LYS . 88.8 t -61.17 -44.31 98.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.767 0.317 . . . . 0.0 110.385 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.3 -38.6 85.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.626 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -57.65 -40.48 79.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.45 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.525 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 96.1 m-20 -62.24 -44.65 96.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.818 0.342 . . . . 0.0 110.487 177.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.507 ' HE3' HG12 ' A' ' 43' ' ' VAL . 89.4 mttt -64.64 -37.36 87.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.107 0.479 . . . . 0.0 110.647 178.39 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -70.68 -19.94 62.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.018 178.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -97.23 -1.38 44.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.287 175.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 65.27 30.69 11.1 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.994 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 8.2 t30 -131.52 93.52 3.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.925 0.393 . . . . 0.0 111.016 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -99.35 110.33 22.84 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 176.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 51.8 p-90 -124.24 -0.12 8.32 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -172.28 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.439 ' HA ' ' HA ' ' A' ' 69' ' ' CYS . 11.0 p90 -161.14 141.49 11.05 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.382 177.567 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -135.12 129.81 34.48 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 174.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.4 tp -147.23 126.52 13.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.931 -168.029 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -111.74 163.51 14.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.798 0.332 . . . . 0.0 110.28 176.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.458 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 10.9 p -125.41 157.34 37.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.109 -178.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -68.92 167.94 14.68 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.75 171.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -70.24 -19.15 63.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.393 0.616 . . . . 0.0 109.37 173.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -72.46 -32.94 66.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.16 173.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.8 8.85 84.91 Favored Glycine 0 C--N 1.333 0.411 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.079 -174.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.0 p -89.56 -30.21 18.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.028 0.442 . . . . 0.0 111.308 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 64' ' ' ARG . 65.9 mtt180 -114.77 133.8 55.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.58 179.066 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.458 ' CD2' ' HB3' ' A' ' 58' ' ' SER . 49.9 m95 -124.12 126.65 46.55 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.004 175.341 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -136.04 148.23 48.27 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.036 -174.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.89 -144.18 8.36 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.183 -0.767 . . . . 0.0 111.183 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.3 ptpp? -159.77 150.69 19.33 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 117.037 0.419 . . . . 0.0 110.959 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 54' ' ' PHE . 25.0 p -116.06 147.67 41.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.379 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.566 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 29.5 m-90 -115.15 129.16 56.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.351 179.202 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -118.53 124.21 46.98 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.3 mm -86.0 120.2 35.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.155 178.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -124.28 108.42 12.21 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.732 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.3 t0 64.44 -85.02 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.197 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 75' ' ' LEU . 2.3 mm? -132.64 6.61 4.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.751 0.31 . . . . 0.0 111.218 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.8 mp -112.38 147.25 36.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.17 0.51 . . . . 0.0 111.21 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -116.54 98.19 6.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.578 -177.416 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.527 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 74.8 m-85 -93.14 133.22 36.55 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.301 -175.197 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.566 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 0.8 OUTLIER -110.28 136.54 49.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.409 0.623 . . . . 0.0 110.861 175.567 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.485 ' O ' HG23 ' A' ' 82' ' ' ILE . 91.4 m-85 -122.12 117.02 25.27 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.347 175.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.85 117.65 9.25 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.665 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.485 HG23 ' O ' ' A' ' 80' ' ' PHE . 36.8 pt -118.51 161.64 17.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.475 0.655 . . . . 0.0 111.855 -171.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -165.42 161.83 19.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.007 175.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.597 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 55.6 p90 -162.64 167.16 23.62 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 123.182 0.301 . . . . 0.0 110.339 173.057 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -119.02 158.42 25.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.404 -178.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.1 mm -106.93 90.4 5.27 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.828 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -60.14 160.95 20.86 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.579 2.186 . . . . 0.0 112.087 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 27.2 mt -73.84 -5.2 6.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.475 0.655 . . . . 0.0 110.727 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.83 8.4 17.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.291 176.707 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 91' ' ' PRO . 76.3 t80 -77.64 142.0 65.58 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 174.751 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.404 ' HA ' ' HA ' ' A' ' 90' ' ' TYR . 98.1 Cg_endo -97.31 16.72 32.57 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.229 -1.155 . . . . 0.0 113.043 -1.134 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.2 m -59.56 -37.81 79.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.463 0.649 . . . . 0.0 110.453 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.9 m -122.66 142.26 50.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.606 176.259 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.81 144.8 96.32 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.823 178.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.0 144.7 99.44 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.87 2.38 . . . . 0.0 112.364 177.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.23 104.54 14.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.517 -176.301 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.597 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 58.8 mt -72.7 131.4 34.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.424 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.461 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -92.62 -74.81 0.51 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.103 -173.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.455 HG22 HG22 ' A' ' 82' ' ' ILE . 17.7 t 61.49 82.38 0.22 Allowed Pre-proline 0 N--CA 1.466 0.369 0 CA-C-O 121.249 0.547 . . . . 0.0 110.233 -174.383 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.71 -14.51 42.03 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 123.263 2.642 . . . . 0.0 113.74 -170.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -79.36 -31.41 42.94 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.718 0.294 . . . . 0.0 111.12 -177.092 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.7 mt -83.5 -7.67 59.49 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.726 -174.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -61.81 124.0 19.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.735 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 89.97 -8.3 80.08 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.552 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -101.08 -55.28 2.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.91 0.386 . . . . 0.0 110.259 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.1 t . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.84 -178.307 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 113' ' ' GLY . . . . . 0.461 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . . . . . . 0 N--CA 1.445 -0.749 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -147.1 116.73 7.09 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 177.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 39.7 pt -75.92 153.86 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.002 0.43 . . . . 0.0 111.202 -177.033 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 27.4 t -105.1 123.76 48.37 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.044 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.9 mt -71.58 161.86 30.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.261 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.3 p -67.88 159.74 29.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.025 0.441 . . . . 0.0 111.568 -176.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -61.51 -24.94 66.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.335 -0.848 . . . . 0.0 112.125 -173.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -93.39 -37.29 12.06 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.989 -0.285 . . . . 0.0 111.18 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -71.94 -35.84 69.73 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 -173.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.423 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 63.2 tttm -57.97 -52.28 75.62 Favored Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -177.064 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.423 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 56.6 Cg_endo -72.23 -25.44 18.81 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 121.826 1.684 . . . . 0.0 112.396 175.439 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 53.1 tp -62.44 -38.18 88.77 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.686 178.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.467 ' O ' HG23 ' A' ' 129' ' ' VAL . 57.1 t-105 -54.53 -55.44 29.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.941 0.401 . . . . 0.0 110.557 177.697 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -71.52 -14.19 62.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.163 -177.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.436 ' HD3' ' O ' ' A' ' 127' ' ' ARG . 3.3 tmt_? -80.54 -28.24 37.37 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -88.14 -39.14 14.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.572 -177.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.482 HG13 ' HA ' ' A' ' 130' ' ' PRO . 95.6 t -49.67 135.53 19.12 Favored Pre-proline 0 N--CA 1.472 0.653 0 O-C-N 123.512 0.508 . . . . 0.0 111.198 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.482 ' HA ' HG13 ' A' ' 129' ' ' VAL . 59.7 Cg_endo -86.51 -146.61 0.32 Allowed 'Cis proline' 0 C--N 1.353 0.77 0 C-N-CA 124.425 -1.073 . . . . 0.0 113.48 5.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 42.9 mmtm 72.89 -37.61 0.39 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.32 0.648 . . . . 0.0 112.035 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.97 158.05 26.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.007 0.432 . . . . 0.0 111.215 -178.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.522 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -141.66 175.16 22.65 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.753 -175.18 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.42 ' H ' ' CD ' ' A' ' 35' ' ' GLU . 53.0 tp -72.29 -39.7 68.1 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.724 0.409 . . . . 0.0 111.33 -174.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.651 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -60.72 -30.82 70.21 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.481 0.657 . . . . 0.0 110.444 177.703 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -67.68 -32.98 74.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.055 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.422 ' HB2' ' CZ3' ' A' ' 125' ' ' TRP . 59.4 tp -68.6 -36.72 79.07 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.914 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 59.5 mtt -65.73 -42.01 91.52 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.309 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -77.82 -50.32 12.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.227 -177.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.7 mt -93.62 -6.14 47.16 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -171.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -117.02 -67.56 0.38 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.263 -0.97 . . . . 0.0 112.753 -177.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.421 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 58.8 tp -60.33 -48.93 79.63 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 122.154 0.182 . . . . 0.0 111.482 -175.43 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.74 -61.64 6.87 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 121.256 -0.497 . . . . 0.0 113.143 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' PRO . . . . . 0.422 ' O ' HG23 ' A' ' 148' ' ' VAL . 50.8 Cg_exo -56.08 -37.71 95.92 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.629 2.219 . . . . 0.0 112.797 177.683 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 64.8 t90 -61.99 -46.69 88.11 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.914 0.388 . . . . 0.0 110.569 -179.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 97.2 mt -61.7 -37.69 85.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.187 0.518 . . . . 0.0 110.647 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.13 -9.72 56.5 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.798 -178.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 144' ' ' PRO . 85.0 t -70.53 -55.98 12.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.648 -179.016 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -141.81 11.16 2.03 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -175.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.494 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 29.7 mm -69.3 -50.75 19.12 Favored Pre-proline 0 CA--C 1.535 0.404 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.502 174.018 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 15.0 Cg_endo -59.12 -31.23 95.09 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.763 1.642 . . . . 0.0 111.189 171.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 30.0 t70 -66.39 -45.0 81.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.402 178.444 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.598 ' HA ' ' HD3' ' A' ' 156' ' ' LYS . 41.0 tp -56.01 -38.81 71.0 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.518 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 62.7 mt -68.19 -44.41 84.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.669 177.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -69.98 -23.07 63.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.356 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 156' ' ' LYS . . . . . 0.598 ' HD3' ' HA ' ' A' ' 153' ' ' LEU . 28.8 mtpp -65.67 -18.19 65.14 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.849 176.335 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 85.8 26.1 36.08 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.67 -177.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 54.6 t -86.52 -43.85 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.976 0.417 . . . . 0.0 110.14 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 60.6 mt . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.48 -179.841 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.409 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.85 0.357 . . . . 0.0 110.814 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.494 ' O ' HG23 ' A' ' 10' ' ' VAL . 28.1 m -60.54 -53.84 52.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.433 -179.297 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.419 ' HD3' ' N ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -64.65 -28.9 69.92 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.807 0.337 . . . . 0.0 111.325 -176.063 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.419 ' N ' ' HD3' ' A' ' 7' ' ' ARG . 54.3 mtp180 -70.5 -36.56 73.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.679 0.276 . . . . 0.0 110.912 178.133 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 5' ' ' ALA . 99.5 t -72.88 -44.08 58.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.389 176.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 6' ' ' THR . 44.4 t -68.0 -14.36 18.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.196 0.522 . . . . 0.0 110.711 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.2 t -69.09 -34.33 74.94 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.127 174.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -96.65 -21.29 17.71 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.985 0.421 . . . . 0.0 110.369 178.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.3 mt -117.42 81.81 14.4 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 174.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -76.81 174.25 13.16 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 123.142 2.561 . . . . 0.0 113.852 -168.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.1 m -79.66 152.3 4.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.308 176.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.45 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 9.4 mp -86.9 134.66 33.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.771 -177.189 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.528 ' N ' ' HD2' ' A' ' 17' ' ' LYS . 12.2 mptt -87.2 -31.61 20.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.049 0.452 . . . . 0.0 110.238 -178.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.453 ' O ' ' HG3' ' A' ' 31' ' ' ARG . 11.6 m -93.64 105.76 17.78 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.603 176.661 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -125.24 133.36 52.73 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.803 0.335 . . . . 0.0 111.27 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -165.63 167.62 17.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.088 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.76 170.67 23.18 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.685 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -61.85 -10.62 17.86 Favored 'Trans proline' 0 N--CA 1.476 0.465 0 C-N-CA 123.232 2.621 . . . . 0.0 112.999 -177.249 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.856 ' HA ' ' HE ' ' A' ' 23' ' ' ARG . 0.4 OUTLIER -69.24 -27.02 65.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.953 177.936 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -112.91 97.52 6.59 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 29' ' ' VAL . 37.3 mtt180 -66.8 -29.68 69.69 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -176.098 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -62.68 -53.36 55.58 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.086 0.47 . . . . 0.0 110.195 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 27' ' ' LEU . 4.3 mm? -75.62 -26.74 58.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.829 178.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.473 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 74.7 t-105 -64.42 -46.5 82.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.768 177.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 25' ' ' ARG . 68.1 t -60.03 -40.9 84.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 120.743 0.306 . . . . 0.0 110.455 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -67.42 -42.69 82.81 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.67 177.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 18' ' ' THR . 38.6 ttt-85 -65.18 -34.45 78.4 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.532 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -63.56 -43.92 95.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.567 -178.237 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.5 ' NZ ' ' HB3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -74.32 -26.92 60.46 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.933 179.778 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -71.57 -35.91 70.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.141 0.496 . . . . 0.0 109.858 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.427 ' CD ' ' H ' ' A' ' 134' ' ' LEU . 10.1 tp10 -64.42 -40.73 96.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.395 174.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.41 ' HD2' ' HA ' ' A' ' 33' ' ' LYS . 5.3 m-85 -55.03 -40.39 70.16 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.913 175.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 71.8 mm-40 -58.71 -49.26 78.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.208 0.528 . . . . 0.0 110.261 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.6 t -62.16 -39.56 93.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.656 179.091 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.536 HD23 ' HB2' ' A' ' 135' ' ' ALA . 94.4 mt -65.09 -54.94 22.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.155 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 83.6 mt -54.13 -45.32 65.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.061 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -43.99 97.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.035 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -65.12 -43.69 91.16 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.745 0.307 . . . . 0.0 110.906 -179.042 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 39' ' ' LEU . 55.3 t -73.39 -43.0 56.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.475 -176.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.63 -29.01 64.18 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -178.443 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -65.63 -31.38 72.38 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 174.465 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.585 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 13.1 m-80 -71.49 -39.34 70.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.319 175.537 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.401 ' NZ ' HG12 ' A' ' 43' ' ' VAL . 59.0 mttp -62.6 -33.28 74.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.049 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -66.82 -14.8 63.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 111.07 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -106.04 5.03 29.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.326 175.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.8 t70 63.33 27.7 15.44 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.99 0.9 . . . . 0.0 109.985 -176.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.585 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 11.9 t30 -122.07 72.06 1.02 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.692 -175.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -92.56 88.99 6.54 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 9.6 p-90 -99.89 -8.15 24.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.498 -0.773 . . . . 0.0 112.363 -170.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -161.43 144.88 12.68 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.707 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 55' ' ' ARG . 37.2 mtm180 -143.16 124.31 14.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.066 171.511 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.494 HD21 ' HB3' ' A' ' 65' ' ' TRP . 5.1 tt -131.05 127.81 39.0 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.439 -169.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -121.41 177.06 5.35 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.121 -175.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.448 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 78.6 p -146.26 174.72 11.09 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.518 ' OD1' ' HB2' ' A' ' 61' ' ' GLU . 4.8 p30 -73.12 166.57 22.86 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 167.659 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.681 ' HA ' ' HE3' ' A' ' 60' ' ' LYS . 0.3 OUTLIER -76.12 -5.57 47.25 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.026 0.441 . . . . 0.0 111.264 -175.31 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.518 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 6.7 mm-40 -78.89 -32.68 45.93 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 171.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.34 13.39 83.63 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.662 177.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -92.26 -5.53 52.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.861 0.363 . . . . 0.0 111.791 -177.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.473 ' HB3' HD21 ' A' ' 59' ' ' ASN . 15.3 ttm180 -151.2 128.01 10.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.016 177.61 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.494 ' HB3' HD21 ' A' ' 56' ' ' LEU . 46.6 m95 -115.37 149.57 37.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.368 -176.104 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -156.11 140.65 16.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.473 -178.027 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.488 ' HA3' ' HA ' ' A' ' 56' ' ' LEU . . . -175.41 -174.91 42.4 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 119.897 -1.144 . . . . 0.0 112.637 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.7 mttp -117.8 145.25 44.66 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.9 0.381 . . . . 0.0 110.735 -178.461 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 48.5 t -130.75 127.5 38.89 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.528 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' TRP . . . . . 0.565 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 7.8 p90 -130.28 132.77 46.07 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.66 -178.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -118.29 143.71 46.38 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 42.8 mm -105.24 116.15 48.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 120.842 0.353 . . . . 0.0 110.829 -175.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -127.47 106.6 9.3 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 5.1 m-20 52.22 58.49 5.37 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.918 0.761 . . . . 0.0 111.247 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.2 mm? 73.34 -22.46 0.23 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.44 176.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.22 118.07 14.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.713 0.292 . . . . 0.0 110.404 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -105.96 135.7 46.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.204 178.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.418 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 7.4 p90 -143.74 114.73 7.81 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.688 179.324 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.565 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 0.6 OUTLIER -106.09 136.43 45.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.559 177.914 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -117.04 139.19 51.0 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.469 178.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -93.15 115.62 28.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.175 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 pt -127.13 152.34 35.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.483 -178.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.11 161.71 42.22 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.992 0.425 . . . . 0.0 110.303 176.395 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.575 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 48.0 p90 -160.09 152.06 20.34 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.44 -179.47 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.524 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 7.2 p-10 -100.8 167.91 9.99 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.978 0.418 . . . . 0.0 110.14 178.264 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.1 mm -109.2 89.5 6.99 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.399 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.524 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 37.1 Cg_exo -56.55 164.11 6.05 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 123.095 2.53 . . . . 0.0 112.529 -178.513 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 35.0 mt -74.36 -10.96 14.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.365 0.603 . . . . 0.0 110.226 -178.075 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.1 p -80.91 -6.82 59.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.948 176.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.515 ' CG ' ' HA ' ' A' ' 91' ' ' PRO . 51.2 t80 -75.86 144.15 75.78 Favored Pre-proline 0 C--N 1.328 -0.352 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.515 ' HA ' ' CG ' ' A' ' 90' ' ' TYR . 24.2 Cg_endo -94.04 11.82 49.31 Favored 'Cis proline' 0 N--CA 1.458 -0.614 0 C-N-CA 124.244 -1.148 . . . . 0.0 113.937 2.545 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 19.1 m -65.04 -36.11 83.32 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.175 0.512 . . . . 0.0 110.355 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 49.9 m -113.43 140.56 47.97 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.739 175.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.52 146.24 95.99 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.752 179.245 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.53 153.91 76.27 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.646 2.231 . . . . 0.0 112.5 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -81.66 90.74 6.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.956 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.575 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 65.3 mt -74.9 119.84 23.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.263 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -107.06 130.75 54.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.787 0.327 . . . . 0.0 111.505 -176.465 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 19.7 t -130.55 77.27 76.16 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 173.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -66.25 -21.79 54.34 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 123.073 2.515 . . . . 0.0 112.538 -176.039 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -57.88 -33.33 68.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.894 0.378 . . . . 0.0 111.272 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 87.5 mt -86.72 1.97 50.23 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -173.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.18 -16.14 63.87 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.39 0.614 . . . . 0.0 110.772 -176.622 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -131.21 26.3 3.96 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.631 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -117.88 -59.33 1.92 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.123 0.487 . . . . 0.0 109.876 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.438 179.69 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.396 0 CA-C-O 120.77 0.095 . . . . 0.0 113.126 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -86.99 149.49 24.73 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 42.9 pt -73.05 146.23 10.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.489 . . . . 0.0 111.362 -175.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 33.8 m -100.02 128.4 46.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.53 -179.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 91.9 mt -120.61 159.8 24.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.535 -178.095 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.0 t -65.0 150.13 48.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.632 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.16 -21.39 59.31 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.25 176.431 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -66.54 -30.26 70.53 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.945 0.402 . . . . 0.0 110.802 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -68.96 -34.7 75.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.331 -175.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.523 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 50.1 mtpt -58.66 -58.65 17.64 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.752 -174.912 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.523 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 43.2 Cg_endo -69.06 -31.09 24.39 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.796 1.664 . . . . 0.0 112.075 176.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 55.6 tp -60.42 -49.38 77.79 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.479 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.539 ' O ' HG23 ' A' ' 129' ' ' VAL . 51.2 t-105 -60.03 -56.38 22.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.687 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.05 -24.73 68.05 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -174.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -78.77 -26.11 44.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.961 0.41 . . . . 0.0 110.759 -179.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -96.07 5.4 51.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.042 -177.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 125' ' ' TRP . 86.3 t -96.15 138.11 21.64 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 174.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.473 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 63.0 Cg_endo -90.8 -160.92 1.28 Allowed 'Cis proline' 0 C--N 1.347 0.463 0 C-N-CA 124.302 -1.124 . . . . 0.0 113.49 4.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 53.8 mttp 75.09 5.14 4.27 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.999 0.812 . . . . 0.0 111.861 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -90.82 134.66 34.27 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -108.21 155.42 16.2 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.402 -177.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.427 ' H ' ' CD ' ' A' ' 35' ' ' GLU . 52.7 tp -64.34 -37.85 88.97 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 122.824 0.45 . . . . 0.0 111.39 -174.497 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.536 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -54.66 -30.32 55.04 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.393 0.616 . . . . 0.0 111.337 179.652 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -67.66 -31.26 71.12 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.385 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 58.7 tp -65.15 -35.38 80.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.715 178.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -65.61 -44.8 85.46 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.97 0.414 . . . . 0.0 110.522 176.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -73.61 -41.12 63.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.254 -176.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.0 mt -98.1 -6.94 30.6 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -173.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -129.29 -63.69 0.11 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.174 -1.012 . . . . 0.0 113.203 -177.102 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.6 tp -57.82 -50.97 71.51 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -175.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.55 -62.0 6.79 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.16 -0.543 . . . . 0.0 113.598 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' PRO . . . . . 0.405 ' O ' HG23 ' A' ' 148' ' ' VAL . 12.3 Cg_endo -58.47 -31.69 94.77 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.498 2.132 . . . . 0.0 113.107 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 51.1 t90 -65.9 -50.08 65.75 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.044 0.45 . . . . 0.0 110.033 179.325 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.11 -37.92 89.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.668 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.25 -14.25 60.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.185 -176.221 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 144' ' ' PRO . 96.1 t -105.45 -50.54 8.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.8 0.333 . . . . 0.0 111.689 -179.069 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -81.68 -32.76 31.62 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -171.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.498 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 38.7 mm -67.2 -54.32 20.23 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -175.757 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.4 Cg_endo -52.45 -41.02 70.04 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 122.446 2.097 . . . . 0.0 112.8 -178.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 152' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 156' ' ' LYS . 32.2 t70 -67.89 -37.16 81.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.577 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.476 ' HG ' HG13 ' A' ' 159' ' ' ILE . 30.9 tp -69.62 -31.41 69.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.696 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 150' ' ' ILE . 72.2 mt -67.19 -53.82 29.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.41 176.408 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -70.42 -15.98 62.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.4 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 156' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 152' ' ' ASP . 20.3 ttmm -68.64 -18.18 64.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.921 175.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 87.83 21.32 47.25 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.281 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 51.7 t -99.96 -44.95 11.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.731 0.301 . . . . 0.0 111.115 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 159' ' ' ILE . . . . . 0.476 HG13 ' HG ' ' A' ' 153' ' ' LEU . 52.2 mt . . . . . 0 C--N 1.326 -0.43 0 CA-C-O 121.378 0.608 . . . . 0.0 110.458 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.466 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.261 0 CA-C-O 120.875 0.369 . . . . 0.0 110.495 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.471 ' O ' HG23 ' A' ' 10' ' ' VAL . 88.8 m -58.77 -48.39 81.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.384 179.318 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.0 ppt_? -70.08 -20.22 63.22 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.104 -178.134 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -71.23 -46.09 61.84 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 171.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 5' ' ' ALA . 83.7 t -57.21 -45.05 84.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.419 176.559 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 6' ' ' THR . 85.6 t -57.73 -43.18 83.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.643 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.4 p -70.29 -20.64 63.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.795 0.331 . . . . 0.0 111.542 -178.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -97.55 0.72 47.94 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.118 0.485 . . . . 0.0 110.584 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 9' ' ' VAL . 60.3 mt -113.74 88.57 14.12 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 115.409 -0.814 . . . . 0.0 108.82 173.207 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.437 ' HD2' ' HA ' ' A' ' 38' ' ' SER . 78.0 Cg_exo -47.16 141.96 12.37 Favored 'Trans proline' 0 C--O 1.237 0.431 0 C-N-CA 123.605 2.87 . . . . 0.0 113.798 -171.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.7 m -82.61 165.71 2.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.735 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.847 HD21 ' HB3' ' A' ' 35' ' ' GLU . 7.6 mp -101.76 134.89 44.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.97 -176.032 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -87.81 -34.01 18.42 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.584 0.707 . . . . 0.0 109.64 174.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.547 HG21 ' HB3' ' A' ' 30' ' ' GLN . 19.7 m -110.82 118.78 37.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.233 -177.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.437 ' HA ' ' CG ' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -152.89 136.81 16.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.27 0.557 . . . . 0.0 111.674 176.382 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -157.13 173.15 17.43 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.154 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.0 161.31 52.06 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.211 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.15 3.32 1.68 Allowed 'Trans proline' 0 N--CA 1.473 0.273 0 C-N-CA 123.074 2.516 . . . . 0.0 112.554 -178.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -72.61 -23.83 60.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.864 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -112.24 108.91 18.3 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.514 ' O ' HG23 ' A' ' 29' ' ' VAL . 64.0 mtt180 -69.66 -36.24 75.87 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -173.412 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -71.96 -46.09 58.68 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.091 -175.496 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 27' ' ' LEU . 4.5 mm? -69.42 -25.88 64.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 177.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 64.0 t-105 -69.3 -45.3 69.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.385 176.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 25' ' ' ARG . 73.1 t -60.75 -42.47 92.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 110.718 177.53 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.547 ' HB3' HG21 ' A' ' 18' ' ' THR . 9.8 tt0 -70.12 -31.82 69.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.135 0.493 . . . . 0.0 110.032 178.566 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.598 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 2.9 tmt_? -61.44 -40.07 93.13 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 174.706 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 6.5 mp -62.43 -41.74 98.93 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.894 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 7.7 ptmm? -66.31 -33.3 75.41 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.597 -178.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 21.6 mm-40 -64.6 -51.83 60.65 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.166 0.508 . . . . 0.0 110.385 177.748 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.847 ' HB3' HD21 ' A' ' 16' ' ' LEU . 17.2 pt-20 -75.34 -29.19 59.89 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.503 -176.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.436 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -60.36 -43.58 96.39 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 176.481 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -62.04 -38.13 87.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.403 175.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.437 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 8.8 t -62.71 -46.76 86.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.202 176.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.476 HD22 ' HZ ' ' A' ' 54' ' ' PHE . 66.2 mt -60.12 -55.61 31.71 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.083 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 77.9 mt -59.19 -39.21 78.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.15 -176.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.0 tpp180 -63.12 -45.53 91.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.479 -178.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -67.22 -44.55 79.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.956 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 39' ' ' LEU . 93.5 t -61.89 -42.45 94.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.254 178.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -57.67 -49.31 76.92 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.57 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -54.11 -45.36 71.85 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.322 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -77.33 -28.47 53.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.879 0.371 . . . . 0.0 110.67 -177.283 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -61.66 -26.58 68.1 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.657 174.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -65.8 -17.62 64.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.932 177.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -99.95 11.0 40.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.211 176.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.4 t70 68.83 15.54 8.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.115 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -120.24 99.75 6.77 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.408 179.54 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -76.49 124.6 27.82 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 175.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.522 ' HE3' ' HB3' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -63.56 -58.66 6.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.269 -171.433 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.522 ' HB3' ' HE3' ' A' ' 53' ' ' TRP . 35.7 p90 -154.57 161.21 41.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.019 0.438 . . . . 0.0 110.914 -174.019 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.0 mtt180 -134.0 121.78 22.09 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.62 HD21 ' HB3' ' A' ' 65' ' ' TRP . 5.7 tt -157.3 137.73 12.92 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -167.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.427 ' N ' HD23 ' A' ' 56' ' ' LEU . 17.6 mm-40 -126.16 168.99 13.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.853 0.359 . . . . 0.0 110.391 -175.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.0 t -143.67 172.46 12.79 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.197 -178.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -68.04 173.71 4.38 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.468 174.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -72.91 -27.01 61.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.114 0.483 . . . . 0.0 109.732 177.171 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -79.64 -14.02 59.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.396 172.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.74 32.59 84.69 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.739 -179.125 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.4 p -89.28 -29.15 19.4 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -176.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 -130.46 123.49 29.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.62 ' HB3' HD21 ' A' ' 56' ' ' LEU . 47.3 m95 -109.61 132.91 53.7 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.129 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -143.39 139.12 29.84 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.445 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.431 ' HA3' ' HA ' ' A' ' 56' ' ' LEU . . . 172.17 -166.98 39.89 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.118 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.483 ' HZ1' ' HB2' ' A' ' 81' ' ' ASP . 23.0 mtpp -133.65 156.28 48.17 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -178.499 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.663 ' SG ' ' HB2' ' A' ' 80' ' ' PHE . 5.1 p -118.65 149.64 41.06 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.214 175.442 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 11.8 m-90 -120.97 138.59 54.07 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -176.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -146.23 120.09 9.31 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.008 0.432 . . . . 0.0 110.332 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.415 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.6 mp -95.62 127.84 47.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 175.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -130.07 108.35 10.01 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -179.101 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 64.53 -85.95 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.639 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -123.57 -11.63 7.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.192 -176.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.8 mt -103.27 145.84 29.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.17 0.51 . . . . 0.0 111.64 -174.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.421 ' HB3' ' HE3' ' A' ' 77' ' ' LYS . 1.1 tmmt? -128.52 120.99 27.82 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.395 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -132.42 153.12 51.14 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.958 0.409 . . . . 0.0 111.152 -176.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -116.79 139.21 50.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.698 -176.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.663 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . 46.7 m-85 -121.51 117.37 26.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.855 0.36 . . . . 0.0 110.477 175.663 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.486 ' H ' ' CB ' ' A' ' 101' ' ' GLU . 9.6 t70 -83.18 130.86 35.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.082 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.507 HG22 HG22 ' A' ' 99' ' ' VAL . 23.2 pt -133.92 147.47 30.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.946 -177.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -154.75 151.84 29.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.61 176.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.436 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 50.3 p90 -167.93 170.31 10.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.186 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -114.15 166.4 11.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.415 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 46.2 mm -107.12 90.23 5.31 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.696 178.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.33 164.47 17.54 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.86 2.374 . . . . 0.0 112.697 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.1 mm -63.74 -27.35 42.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.892 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' THR . . . . . 0.46 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 3.7 p -75.69 -14.02 60.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.998 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.488 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 73.3 t80 -78.11 143.58 65.78 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.488 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.4 Cg_endo -95.63 9.73 45.03 Favored 'Cis proline' 0 C--N 1.35 0.641 0 C-N-CA 124.488 -1.047 . . . . 0.0 113.509 1.146 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.411 ' HA ' HG11 ' A' ' 129' ' ' VAL . 21.5 m -61.03 -31.02 70.66 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.392 0.615 . . . . 0.0 110.201 178.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.46 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 22.9 m -126.33 144.3 50.86 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.195 173.815 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.83 143.95 82.09 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 120.54 0.21 . . . . 0.0 111.2 -178.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -86.73 171.88 6.91 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.993 2.462 . . . . 0.0 112.421 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLU . . . . . 0.806 ' HB3' ' HD3' ' A' ' 114' ' ' LYS . 40.6 mt-10 -101.5 113.53 26.73 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.625 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.436 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 57.7 mt -92.79 141.42 14.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.726 -177.451 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -118.27 140.31 50.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.733 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.507 HG22 HG22 ' A' ' 82' ' ' ILE . 27.6 t -119.57 86.43 34.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.851 0.357 . . . . 0.0 110.288 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.65 -18.51 48.26 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 123.184 2.589 . . . . 0.0 113.138 -175.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.486 ' CB ' ' H ' ' A' ' 81' ' ' ASP . 4.7 tp10 -74.83 -19.0 60.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.036 0.446 . . . . 0.0 110.9 -177.064 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.8 mt -97.66 14.47 26.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.239 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -58.89 131.52 51.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.178 -176.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 61.5 23.73 63.03 Favored Glycine 0 C--N 1.334 0.435 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.51 176.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -133.85 -38.0 0.9 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.984 0.421 . . . . 0.0 110.436 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.7 t . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.837 176.871 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.239 0 N-CA-C 112.366 -0.294 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.806 ' HD3' ' HB3' ' A' ' 96' ' ' GLU . 53.8 mttp -93.56 156.5 16.7 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.486 HD12 HD21 ' A' ' 117' ' ' LEU . 30.3 pt -74.25 139.11 19.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.041 0.448 . . . . 0.0 111.401 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 18.6 t -94.11 109.06 20.86 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.486 HD21 HD12 ' A' ' 115' ' ' ILE . 96.0 mt -91.19 175.62 6.87 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.23 -177.252 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.565 HG23 ' HB2' ' A' ' 121' ' ' PHE . 4.7 t -71.98 146.2 47.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.904 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ASP . . . . . 0.463 ' HA ' ' HE3' ' A' ' 122' ' ' LYS . 13.4 t70 -65.49 -30.26 71.01 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.621 -176.058 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -80.03 -15.57 56.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.753 -172.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.565 ' HB2' HG23 ' A' ' 118' ' ' THR . 49.1 t80 -70.93 -34.15 71.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.006 -176.389 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.53 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 42.3 mttt -57.81 -58.67 16.87 Favored Pre-proline 0 CA--C 1.539 0.522 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.085 -176.215 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.53 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 29.0 Cg_endo -64.37 -34.87 53.04 Favored 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 121.83 1.687 . . . . 0.0 111.976 178.709 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 42.3 tp -61.62 -45.24 94.92 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.837 0.351 . . . . 0.0 110.349 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.47 ' O ' HG23 ' A' ' 129' ' ' VAL . 57.2 t-105 -59.23 -57.26 13.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.587 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.03 -32.17 71.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.884 -175.038 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -70.36 -36.56 74.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.903 0.382 . . . . 0.0 111.169 -178.267 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -89.36 -31.16 17.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.061 -173.07 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.562 HG13 ' HA ' ' A' ' 130' ' ' PRO . 51.2 t -53.64 138.95 51.05 Favored Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 176.128 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.562 ' HA ' HG13 ' A' ' 129' ' ' VAL . 6.9 Cg_endo -88.59 -151.64 0.52 Allowed 'Cis proline' 0 C--N 1.349 0.591 0 C-N-CA 124.727 -0.947 . . . . 0.0 114.453 6.452 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 9.4 mtmp? 75.24 36.66 0.5 Allowed 'General case' 0 C--N 1.343 0.309 0 C-N-CA 123.759 0.823 . . . . 0.0 110.427 -172.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -128.01 152.9 47.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.828 -179.2 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.598 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -146.1 175.17 25.72 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 47.6 tp -58.45 -38.25 77.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 117.355 0.578 . . . . 0.0 111.497 -176.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.12 -43.85 70.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.732 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 29.5 m80 -70.33 -36.61 74.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.682 0.277 . . . . 0.0 110.73 -178.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.75 -50.57 62.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.283 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 21.8 ptm -71.69 -31.67 67.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.55 -175.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -73.22 -45.35 56.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.682 0.277 . . . . 0.0 111.418 -179.108 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.2 mt -85.72 -15.98 40.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.569 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -98.79 -69.44 0.93 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.433 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' LEU . . . . . 0.589 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 94.9 mt -65.97 -38.69 89.19 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -176.298 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.32 -62.28 6.15 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 121.086 -0.578 . . . . 0.0 113.352 -177.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -64.4 -31.17 62.38 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.55 2.167 . . . . 0.0 112.414 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 38.3 t90 -62.57 -39.51 93.9 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.009 0.433 . . . . 0.0 110.621 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.624 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 98.7 mt -60.1 -34.52 73.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.876 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.02 -4.89 41.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.759 -176.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 61.4 t -85.47 -56.12 5.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.702 -0.226 . . . . 0.0 111.511 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -107.07 -29.49 9.36 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -172.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' ILE . . . . . 0.624 ' HB ' ' O ' ' A' ' 146' ' ' LEU . 1.7 mp -57.91 -48.7 96.67 Favored Pre-proline 0 CA--C 1.541 0.622 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -175.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 151' ' ' PRO . . . . . 0.448 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 54.3 Cg_exo -54.59 -37.87 90.65 Favored 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 121.79 1.66 . . . . 0.0 112.346 175.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.31 -44.4 87.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.401 179.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.84 -36.9 80.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.887 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 150' ' ' ILE . 64.9 mt -66.48 -41.18 88.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.816 178.495 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 151' ' ' PRO . 52.8 mt-30 -62.89 -39.06 93.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.023 0.439 . . . . 0.0 111.326 178.687 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -85.98 -5.58 59.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.633 -178.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 71.8 38.31 60.78 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.06 -0.591 . . . . 0.0 112.781 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 5.4 t -91.07 4.17 6.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.546 0.689 . . . . 0.0 110.105 -178.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.8 mm . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.174 179.245 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.681 0.277 . . . . 0.0 110.984 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.73 -161.02 0.81 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.0 t70 65.52 23.98 11.83 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.883 0.849 . . . . 0.0 110.432 175.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -66.9 -37.96 85.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.089 -175.745 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.58 -41.55 86.01 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.884 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.462 ' O ' HG23 ' A' ' 10' ' ' VAL . 11.0 m -59.57 -47.41 85.68 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.597 178.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 -67.08 -29.59 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.013 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.564 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 96.0 mtt180 -60.63 -50.79 72.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.95 0.405 . . . . 0.0 110.067 175.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.37 -42.5 95.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.88 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.5 HG21 HD21 ' A' ' 140' ' ' LEU . 64.7 t -62.52 -32.35 55.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.911 0.386 . . . . 0.0 110.589 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.4 t -69.54 -21.89 63.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.695 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.07 -3.31 54.4 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.06 0.457 . . . . 0.0 110.129 177.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.421 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 42.6 mt -108.35 88.46 4.97 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.57 175.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 10.3 Cg_endo -49.1 147.89 10.43 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 123.588 2.859 . . . . 0.0 113.318 -173.088 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.528 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 29.5 m -79.17 142.36 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.503 178.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.624 HD23 ' HG2' ' A' ' 31' ' ' ARG . 7.3 mp -81.33 134.16 35.53 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HD3' ' H ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -106.23 -4.43 20.19 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.748 -173.921 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.1 m -87.55 -53.98 4.51 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 173.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.8 t30 46.25 81.13 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.52 0 O-C-N 124.037 0.836 . . . . 0.0 112.276 175.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.71 165.43 23.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.946 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -100.67 177.97 28.41 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.938 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.45 5.76 2.21 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 123.399 2.733 . . . . 0.0 113.238 -176.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.526 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 3.4 mmp_? -84.14 -48.0 10.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.828 0.347 . . . . 0.0 110.86 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -91.66 92.59 8.52 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 176.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.55 ' O ' HG23 ' A' ' 29' ' ' VAL . 61.4 mtt85 -59.9 -31.26 69.65 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -175.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.26 -52.16 60.03 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.603 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 12.3 mt -72.82 -28.57 62.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.716 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.546 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 67.9 t-105 -60.87 -49.54 77.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.463 175.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 25' ' ' ARG . 86.4 t -61.55 -30.5 48.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.927 178.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.439 ' O ' ' HG3' ' A' ' 34' ' ' GLU . 47.7 mt-30 -68.85 -49.94 54.11 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.84 0.352 . . . . 0.0 110.568 175.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.624 ' HG2' HD23 ' A' ' 16' ' ' LEU . 16.3 ttp180 -63.36 -32.16 73.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.063 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -59.47 -48.47 81.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.683 -179.405 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.5 ptpp? -72.16 -34.89 68.83 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.248 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 30' ' ' GLN . 49.3 mt-10 -60.02 -46.92 87.92 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.718 0.77 . . . . 0.0 109.485 174.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -67.02 -42.45 84.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.614 -1.176 . . . . 0.0 111.028 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.24 -45.1 95.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.946 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -60.77 -39.2 87.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.955 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.4 m -62.89 -39.29 94.04 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.348 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.424 ' O ' HG23 ' A' ' 43' ' ' VAL . 96.1 mt -65.34 -47.78 75.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.584 177.546 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.63 -43.32 98.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.681 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.4 tpp180 -56.2 -47.19 78.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.737 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.413 ' HD2' ' HE1' ' A' ' 54' ' ' PHE . 43.1 t80 -65.06 -45.58 84.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.724 -178.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.71 HG21 HH21 ' A' ' 55' ' ' ARG . 98.2 t -63.01 -45.16 99.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.107 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -59.94 -50.4 73.92 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.555 0.693 . . . . 0.0 110.137 177.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -53.64 -40.94 66.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.54 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.652 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 91.8 m-20 -68.49 -44.53 74.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.175 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -62.99 -31.9 73.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.284 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -64.24 -36.1 82.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 0.0 110.199 176.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.17 0.43 40.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.859 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.9 t70 74.02 12.12 4.29 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.291 177.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.652 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 5.3 t30 -119.82 92.78 3.87 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.12 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.89 146.86 35.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.692 0.282 . . . . 0.0 110.703 -176.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.779 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -104.94 -68.69 0.84 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -171.556 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.779 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 26.5 p90 -160.65 165.91 29.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.733 0.777 . . . . 0.0 112.923 -165.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.71 HH21 HG21 ' A' ' 43' ' ' VAL . 2.4 mmp_? -131.44 121.84 25.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.641 -1.163 . . . . 0.0 108.898 166.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.514 HD21 HD11 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -134.11 125.32 27.73 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 -177.004 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -131.93 168.77 17.31 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.844 0.354 . . . . 0.0 110.321 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.465 ' OG ' ' HA2' ' A' ' 62' ' ' GLY . 6.3 t -130.48 178.2 6.79 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.31 -0.404 . . . . 0.0 109.948 -175.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -84.43 -177.98 6.78 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.4 ptpp? -60.66 -28.43 68.58 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -93.59 -10.9 33.12 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.592 0.234 . . . . 0.0 111.092 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.465 ' HA2' ' OG ' ' A' ' 58' ' ' SER . . . 71.48 13.31 74.1 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.913 -0.66 . . . . 0.0 113.047 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.8 p -80.64 -15.92 55.36 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -174.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.516 ' HA ' ' HA ' ' A' ' 85' ' ' ASP . 32.1 ttm180 -143.65 122.1 12.41 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 55.3 m95 -103.12 139.03 39.16 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.361 -178.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 p90 -146.0 146.43 30.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.93 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.54 -153.51 21.94 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.836 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.601 ' HG3' ' HZ3' ' A' ' 70' ' ' TRP . 5.5 ptpp? -151.23 143.81 24.31 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.098 0.475 . . . . 0.0 110.987 -178.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 15.9 p -122.79 141.23 52.05 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.561 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.659 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 2.9 p90 -122.7 137.06 55.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.462 0.649 . . . . 0.0 110.877 -178.766 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -117.89 123.27 45.44 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.708 -176.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 34.7 mm -87.59 126.71 41.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.117 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.422 ' HB3' ' HE1' ' A' ' 78' ' ' TYR . 11.8 t60 -140.59 124.76 17.51 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 176.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.443 ' C ' HD22 ' A' ' 75' ' ' LEU . 39.1 t70 68.3 -85.95 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.93 0.769 . . . . 0.0 110.422 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.737 ' HB2' ' HB2' ' A' ' 172' ' ' HIS . 2.2 mm? -142.03 5.62 1.72 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 175.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 82.0 mt -111.47 153.67 25.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.898 0.38 . . . . 0.0 111.116 -172.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -116.68 129.01 55.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.958 176.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.422 ' HE1' ' HB3' ' A' ' 73' ' ' HIS . 43.0 m-85 -115.74 101.21 8.62 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.837 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.659 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 1.1 pm0 -96.2 135.76 37.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.092 0.473 . . . . 0.0 110.926 177.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.404 ' HD1' ' HG2' ' A' ' 101' ' ' GLU . 60.9 m-85 -124.75 138.76 54.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.919 -179.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -93.93 124.58 38.03 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.514 HD11 HD21 ' A' ' 56' ' ' LEU . 39.5 pt -130.8 160.32 42.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.927 0.394 . . . . 0.0 111.608 -173.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -154.14 153.39 31.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.398 177.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -172.55 162.31 5.16 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.516 ' HA ' ' HA ' ' A' ' 64' ' ' ARG . 5.6 p-10 -115.64 176.1 5.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.625 0.25 . . . . 0.0 110.504 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.405 HG21 ' CH2' ' A' ' 28' ' ' TRP . 50.6 mm -114.34 89.05 16.62 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.227 -175.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 20.6 Cg_endo -61.05 165.4 12.41 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.596 2.197 . . . . 0.0 112.122 177.203 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 55.6 mt -64.32 -21.84 29.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.256 0.551 . . . . 0.0 110.974 -178.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.16 -20.11 64.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.293 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.656 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 49.6 t80 -88.31 144.51 34.18 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.656 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.2 Cg_endo -95.5 17.67 36.31 Favored 'Cis proline' 0 N--CA 1.459 -0.531 0 C-N-CA 124.495 -1.044 . . . . 0.0 113.822 3.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 10.3 m -65.24 -38.45 90.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.51 0.671 . . . . 0.0 110.186 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -129.18 141.73 51.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.612 175.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.44 144.48 91.78 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.636 -0.257 . . . . 0.0 111.256 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.416 ' HD3' ' CD1' ' A' ' 90' ' ' TYR . 95.2 Cg_endo -92.98 -171.9 0.33 Allowed 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.159 2.572 . . . . 0.0 112.39 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -106.71 123.21 47.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.392 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.86 126.22 41.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.581 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -92.24 117.64 30.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.116 -178.083 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.459 HG22 HG22 ' A' ' 82' ' ' ILE . 25.6 t -119.96 87.24 38.19 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.439 178.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -68.74 -6.5 18.1 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.867 2.378 . . . . 0.0 113.008 -176.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.404 ' HG2' ' HD1' ' A' ' 80' ' ' PHE . 14.6 tp10 -78.87 -43.25 25.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.046 0.45 . . . . 0.0 110.53 178.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.8 HD22 ' HG ' ' A' ' 153' ' ' LEU . 86.7 mt -86.76 -35.11 19.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.977 -175.08 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.0 128.67 38.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.364 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 95.86 -29.36 10.0 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.147 -177.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -92.34 4.59 53.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.914 0.388 . . . . 0.0 111.392 -177.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.9 t -150.09 151.84 33.82 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 175.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -82.94 -21.66 34.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.174 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -89.31 81.3 6.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.217 0.532 . . . . 0.0 110.381 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 7.6 tpt -135.06 136.44 42.05 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.487 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -61.53 -53.93 49.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.213 0.53 . . . . 0.0 110.657 -178.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -163.3 157.88 20.73 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -48.95 96.56 0.01 OUTLIER Glycine 0 CA--C 1.521 0.417 0 O-C-N 123.696 0.623 . . . . 0.0 114.013 -176.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLY . . . . . 0.581 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . 113.89 -23.92 12.5 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.079 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -96.51 131.19 43.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.941 0.401 . . . . 0.0 111.652 -173.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 33.3 pt -75.86 170.75 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.688 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 35.1 m -111.14 93.7 4.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.13 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 93.5 mt -74.28 157.32 36.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.722 0.296 . . . . 0.0 110.859 179.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.457 HG23 ' HB2' ' A' ' 121' ' ' PHE . 2.6 t -72.37 151.97 42.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.029 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -67.06 -25.38 66.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.601 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -78.56 -20.03 51.51 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.428 -176.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.457 ' HB2' HG23 ' A' ' 118' ' ' THR . 56.3 t80 -71.44 -34.43 70.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.953 -177.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.58 -53.53 63.63 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.009 -176.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.43 ' O ' ' HG3' ' A' ' 127' ' ' ARG . 37.0 Cg_endo -67.47 -34.17 27.07 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.529 1.486 . . . . 0.0 112.227 175.753 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.3 tp -60.35 -45.56 93.06 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.859 0.362 . . . . 0.0 110.462 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.539 ' O ' HG23 ' A' ' 129' ' ' VAL . 41.6 t-105 -59.91 -54.88 40.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.143 177.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.95 -34.68 68.26 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.413 -175.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.43 ' HG3' ' O ' ' A' ' 123' ' ' PRO . 97.0 mtt180 -69.15 -30.12 68.29 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -178.149 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -95.62 -21.8 18.0 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -172.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 125' ' ' TRP . 89.3 t -46.22 129.96 7.58 Favored Pre-proline 0 N--CA 1.473 0.678 0 O-C-N 123.446 0.466 . . . . 0.0 111.542 -178.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 129' ' ' VAL . 72.0 Cg_endo -96.72 -120.08 0.0 OUTLIER 'Cis proline' 0 CA--C 1.536 0.59 0 C-N-CA 124.016 -1.243 . . . . 0.0 113.156 2.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.528 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 64.8 mttm 67.42 22.37 9.41 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.331 175.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -91.84 -178.95 5.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.587 0.708 . . . . 0.0 112.151 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -178.31 157.71 21.87 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.393 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.6 tp -54.19 -40.24 67.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.792 0.296 . . . . 0.0 111.618 -177.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.43 -38.26 74.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.061 0.458 . . . . 0.0 111.015 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -71.87 -45.85 59.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.161 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.3 tp -59.19 -46.81 87.43 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.343 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' MET . . . . . 0.41 ' HE1' ' CD2' ' A' ' 42' ' ' TYR . 7.8 tmm? -62.38 -47.69 83.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.215 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.75 -38.79 73.51 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -176.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.5 HD21 HG21 ' A' ' 10' ' ' VAL . 95.9 mt -86.87 -17.95 32.09 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -175.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -112.55 -66.63 0.5 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.296 -0.954 . . . . 0.0 113.041 -177.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.603 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 54.9 tp -66.45 -42.85 87.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.664 0.269 . . . . 0.0 111.031 -175.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -51.75 -61.94 6.0 Favored Glycine 0 CA--C 1.523 0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.63 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' PRO . . . . . 0.476 ' O ' HG23 ' A' ' 148' ' ' VAL . 33.9 Cg_endo -65.63 -31.86 49.05 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.314 2.009 . . . . 0.0 112.702 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 33.5 t90 -64.5 -33.74 76.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.694 0.283 . . . . 0.0 111.0 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 90.4 mt -58.55 -40.65 83.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.953 0.406 . . . . 0.0 110.167 177.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.0 -2.12 29.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.306 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 144' ' ' PRO . 90.8 t -104.85 -55.19 5.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.529 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -95.74 -32.48 12.71 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -173.09 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.607 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 40.2 mm -56.45 -41.19 89.88 Favored Pre-proline 0 CA--C 1.54 0.565 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -176.182 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.607 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 1.2 Cg_endo -46.18 -40.56 21.59 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 122.395 2.063 . . . . 0.0 112.792 171.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -61.93 -49.31 76.65 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.041 0.448 . . . . 0.0 110.097 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.8 ' HG ' HD22 ' A' ' 102' ' ' LEU . 3.7 mm? -60.52 -42.81 97.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.086 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.94 -53.3 31.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.038 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -65.31 -36.34 83.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.389 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' LYS . . . . . 0.431 ' HB3' ' HZ3' ' A' ' 156' ' ' LYS . 5.8 ttpm? -70.99 -16.53 62.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.986 0.422 . . . . 0.0 110.42 -178.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.71 17.69 63.19 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.333 172.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 29.1 m -87.54 -19.99 7.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.861 0.331 . . . . 0.0 110.969 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.519 HG13 ' HB3' ' A' ' 153' ' ' LEU . 44.5 mt -83.82 121.88 37.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 175.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -80.65 66.16 6.06 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.46 0.648 . . . . 0.0 110.051 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' HIS . . . . . 0.507 ' HB2' HG22 ' A' ' 159' ' ' ILE . 42.3 m80 -152.24 41.41 0.64 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.535 -178.118 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -69.45 -22.68 63.64 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.029 0.443 . . . . 0.0 110.937 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -143.06 174.95 10.23 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -121.52 -24.66 5.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.018 0.437 . . . . 0.0 110.589 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' CYS . . . . . 0.628 ' SG ' ' HB2' ' A' ' 168' ' ' LEU . 12.7 t -137.82 -43.23 0.53 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.556 -176.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 8.5 t30 59.68 95.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.274 178.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.457 ' HA ' ' OE1' ' A' ' 167' ' ' GLN . 14.3 mm-40 72.49 -29.98 0.2 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 171.185 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.628 ' HB2' ' SG ' ' A' ' 165' ' ' CYS . 11.2 mp -60.61 -71.0 0.15 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.714 0.293 . . . . 0.0 110.572 179.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -84.76 -75.31 0.36 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.961 0.41 . . . . 0.0 110.26 175.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -165.45 152.55 10.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 -175.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -69.27 155.15 40.89 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 174.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 172' ' ' HIS . . . . . 0.737 ' HB2' ' HB2' ' A' ' 75' ' ' LEU . 10.4 p80 -64.68 93.61 0.11 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 122.426 1.108 . . . . 0.0 108.512 170.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 21.5 t-160 -172.65 99.07 0.14 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.276 -1.329 . . . . 0.0 107.598 -168.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' HIS . . . . . 0.454 ' HB2' HD21 ' A' ' 75' ' ' LEU . 6.7 t60 -85.7 -15.03 43.58 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -166.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 58.5 m170 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.202 175.782 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.3 mtp . . . . . 0 N--CA 1.481 1.112 0 CA-C-O 120.602 0.239 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.78 -11.48 20.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.482 0.658 . . . . 0.0 109.83 173.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -85.57 20.31 2.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.528 -177.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 44.9 mt-10 -55.33 -41.42 72.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.989 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.491 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -60.54 -44.1 96.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.981 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.2 m -61.12 -42.63 98.88 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.517 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -64.41 -38.35 90.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.442 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 21.9 mtp180 -62.97 -40.37 97.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.06 178.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 5' ' ' ALA . 96.3 t -58.53 -47.36 88.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 120.93 0.395 . . . . 0.0 110.448 178.012 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.2 t -67.17 -25.72 34.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.868 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.6 m -81.71 -40.71 22.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.375 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.498 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 34.9 mt-10 -79.1 -12.21 60.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.655 0.264 . . . . 0.0 111.372 -179.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.7 mt -105.35 89.76 3.44 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 172.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.498 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 87.8 Cg_exo -45.52 151.2 1.15 Allowed 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 124.058 3.172 . . . . 0.0 114.25 -172.066 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.585 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 20.0 m -86.05 145.21 8.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.716 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.742 HD21 ' HG2' ' A' ' 35' ' ' GLU . 8.2 mp -85.11 134.58 34.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.893 -178.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -82.07 -32.87 30.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.721 0.772 . . . . 0.0 109.545 174.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.494 HG23 HD12 ' A' ' 27' ' ' LEU . 25.4 m -85.03 135.21 34.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.427 -175.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -135.24 93.23 2.96 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.388 178.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -162.42 161.38 27.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.516 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -103.77 -176.61 25.85 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.397 -179.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.51 -6.54 13.86 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 123.454 2.769 . . . . 0.0 113.051 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.438 ' HG3' HG23 ' A' ' 88' ' ' ILE . 45.7 mtp180 -71.31 -24.63 62.16 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.566 0.222 . . . . 0.0 111.239 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -113.83 96.42 5.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.526 ' O ' HG23 ' A' ' 29' ' ' VAL . 87.6 mtm180 -64.44 -32.95 74.78 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -173.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -68.41 -45.53 72.39 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.418 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.494 HD12 HG23 ' A' ' 18' ' ' THR . 4.5 mm? -71.7 -26.95 62.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.208 0.528 . . . . 0.0 110.203 174.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.531 ' HH2' HG21 ' A' ' 86' ' ' ILE . 63.7 t-105 -64.1 -41.84 97.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.297 178.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 25' ' ' ARG . 96.5 t -60.08 -37.84 74.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.158 0.504 . . . . 0.0 110.174 175.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 38.7 mt-30 -67.07 -43.49 82.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.14 178.088 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.469 HH11 ' HG3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -62.41 -30.51 71.27 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.35 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.494 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 2.1 mm? -65.29 -49.45 69.48 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.225 177.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.442 ' HG2' ' HA ' ' A' ' 30' ' ' GLN . 19.7 ptpt -66.37 -38.59 87.92 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 120.826 -0.349 . . . . 0.0 110.961 -178.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.534 ' HB3' ' HG ' ' A' ' 16' ' ' LEU . 26.4 mm-40 -61.88 -51.1 69.57 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.973 0.416 . . . . 0.0 110.392 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.742 ' HG2' HD21 ' A' ' 16' ' ' LEU . 6.0 mm-40 -63.36 -42.06 98.85 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.578 177.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.494 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -58.85 -45.02 91.06 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.281 -178.241 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 84.3 mm-40 -58.99 -43.09 91.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.027 0.442 . . . . 0.0 110.438 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.448 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 18.0 m -66.54 -40.58 89.16 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.763 177.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 35' ' ' GLU . 95.9 mt -62.95 -49.01 76.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.014 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 36' ' ' TYR . 85.8 mt -55.59 -47.44 78.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 O-C-N 123.163 0.289 . . . . 0.0 110.582 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -61.52 -41.07 96.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.375 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.484 ' HE2' ' HZ ' ' A' ' 54' ' ' PHE . 80.0 t80 -72.1 -46.21 57.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.22 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.44 ' O ' ' HG3' ' A' ' 47' ' ' LYS . 85.3 t -62.91 -37.34 78.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.068 0.461 . . . . 0.0 110.295 179.135 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.7 -50.56 70.65 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 175.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -53.72 -48.66 69.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.52 177.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -62.49 -39.36 93.21 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -178.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 32.2 mtmm -68.88 -37.28 78.93 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.312 177.268 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -66.5 -34.91 78.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.713 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -85.86 -1.61 57.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.256 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.9 t70 61.62 29.68 18.3 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.667 0.746 . . . . 0.0 110.48 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -122.9 55.1 1.2 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.575 -175.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -93.7 106.59 18.55 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 65.0 p-90 -125.5 5.16 7.6 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -174.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.484 ' HZ ' ' HE2' ' A' ' 42' ' ' TYR . 19.7 p90 -154.64 147.0 23.91 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.077 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.53 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 23.0 tpt180 -126.57 123.32 37.42 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.575 178.285 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.1 mt -121.52 124.6 44.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.002 0.43 . . . . 0.0 110.112 175.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -134.78 152.37 51.7 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.178 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.6 m -126.23 159.35 33.27 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 120.771 0.32 . . . . 0.0 111.553 -171.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -75.74 173.2 11.41 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -69.14 -12.73 61.94 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -170.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -85.35 -25.53 27.04 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.831 0.348 . . . . 0.0 110.373 175.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.39 17.74 77.85 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.984 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.9 p -83.73 -30.28 26.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.953 0.406 . . . . 0.0 111.757 -177.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 64' ' ' ARG . 50.3 mtp180 -128.72 128.32 43.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.239 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -110.91 126.43 54.71 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.436 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 83' ' ' GLU . 39.7 p90 -136.46 167.05 22.08 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.53 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 168.33 -138.77 5.31 Favored Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.011 -1.09 . . . . 0.0 112.544 178.232 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 81' ' ' ASP . 20.7 ttmm -153.03 134.73 14.53 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -172.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 64.5 m -119.67 122.66 42.0 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 174.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.585 ' HB3' ' HG2' ' A' ' 79' ' ' GLU . 41.5 p90 -124.43 129.98 51.65 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.284 0.564 . . . . 0.0 110.399 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -121.01 133.96 55.28 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 -179.244 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 43.3 mm -96.9 121.47 47.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.411 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -147.15 116.87 7.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.035 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 57.24 58.4 3.93 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.918 0.761 . . . . 0.0 111.224 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.1 mt 72.65 -38.64 0.42 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.385 0.674 . . . . 0.0 112.641 175.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.35 137.14 55.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.318 0.58 . . . . 0.0 112.068 -175.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -108.55 102.37 11.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.667 175.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 17.8 p90 -104.6 119.71 39.62 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.185 0.517 . . . . 0.0 110.6 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.585 ' HG2' ' HB3' ' A' ' 70' ' ' TRP . 57.4 mt-10 -105.77 136.44 45.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.328 -178.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -121.25 112.57 18.79 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.507 ' HA ' ' HA ' ' A' ' 68' ' ' LYS . 2.3 m-20 -83.34 112.97 20.39 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 38.2 pt -114.62 173.76 3.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.266 -173.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.456 ' HA ' ' HA ' ' A' ' 66' ' ' PHE . 10.0 pt-20 -162.44 157.71 22.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.785 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.583 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 36.0 p90 -160.91 148.15 15.43 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.084 0.469 . . . . 0.0 111.077 176.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -93.34 164.0 13.38 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.831 177.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.531 HG21 ' HH2' ' A' ' 28' ' ' TRP . 39.7 mm -107.45 91.98 7.75 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.631 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 1.3 Cg_endo -40.79 148.22 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 124.181 3.254 . . . . 0.0 113.807 -178.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.438 HG23 ' HG3' ' A' ' 23' ' ' ARG . 50.2 mm -58.52 -39.42 75.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.957 -174.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.3 p -83.19 40.5 0.71 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.213 0.53 . . . . 0.0 112.064 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.534 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 25.0 t80 -77.76 147.65 74.75 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.483 177.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.534 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 19.9 Cg_endo -94.76 13.35 44.72 Favored 'Cis proline' 0 N--CA 1.453 -0.856 0 C-N-CA 124.513 -1.036 . . . . 0.0 112.883 -2.234 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 22.5 m -62.28 -35.84 80.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.33 0.586 . . . . 0.0 110.191 178.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.6 m -105.77 119.66 39.71 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.641 173.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -81.41 152.05 69.79 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.528 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.563 ' HG2' HD13 ' A' ' 134' ' ' LEU . 50.9 Cg_exo -55.31 136.47 73.66 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.891 2.394 . . . . 0.0 112.163 174.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.486 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 19.9 mt-10 -79.74 -22.68 42.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.201 -173.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.583 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 62.8 mt 65.95 116.24 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-O 121.363 0.601 . . . . 0.0 111.665 -178.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.738 ' HB2' ' HG2' ' A' ' 114' ' ' LYS . . . -119.62 138.38 53.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.357 0.599 . . . . 0.0 111.84 -177.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.524 ' HB ' ' HE1' ' A' ' 109' ' ' MET . 16.7 t -124.43 86.18 55.26 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.713 176.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.91 -21.71 65.6 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.333 2.689 . . . . 0.0 114.138 -172.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.65 -29.81 56.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.208 0.528 . . . . 0.0 110.375 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.836 ' HB2' ' HE1' ' A' ' 109' ' ' MET . 75.2 mt -89.92 4.05 51.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.309 -176.41 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -62.26 110.57 1.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 87.02 -2.55 87.08 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.26 -178.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.482 ' HD2' HD23 ' A' ' 102' ' ' LEU . 4.2 ttmp? -101.9 -5.87 24.2 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 121.433 0.635 . . . . 0.0 110.045 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 t -153.02 163.47 39.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.648 177.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -113.41 14.22 19.1 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.099 0.476 . . . . 0.0 110.447 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -96.19 35.81 1.4 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.781 -177.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.836 ' HE1' ' HB2' ' A' ' 102' ' ' LEU . 59.8 mtt -139.24 164.68 29.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.055 0.455 . . . . 0.0 111.759 -176.393 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -90.76 179.4 5.8 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.584 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -64.37 112.34 3.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.917 177.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 126.5 -16.05 6.67 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.536 177.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.81 12.93 42.01 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.229 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.738 ' HG2' ' HB2' ' A' ' 98' ' ' ALA . 95.0 mttt -91.8 137.54 32.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 176.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.5 pt -82.13 167.55 2.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.376 0.607 . . . . 0.0 112.32 -168.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 17.6 p -114.27 116.71 29.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.054 176.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.8 mt -85.7 -175.14 5.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.183 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.454 HG22 ' H ' ' A' ' 120' ' ' HIS . 31.5 m -59.86 131.93 52.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.092 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -63.57 -32.33 73.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.82 -177.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.454 ' H ' HG22 ' A' ' 118' ' ' THR . 25.2 m80 -75.18 -22.11 58.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.09 -179.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -71.5 -33.57 69.36 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.35 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.434 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 28.1 ttpp -55.69 -56.75 26.46 Favored Pre-proline 0 CA--C 1.542 0.647 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.975 -178.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.434 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 36.3 Cg_endo -67.28 -31.28 35.75 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.589 1.526 . . . . 0.0 112.104 175.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 54.5 tp -61.33 -44.8 96.59 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.414 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.549 ' O ' HG23 ' A' ' 129' ' ' VAL . 49.9 t-105 -59.84 -54.61 44.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.309 178.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.12 -16.13 63.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.968 -176.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -86.35 -21.6 27.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.958 0.408 . . . . 0.0 110.591 178.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -110.11 25.61 11.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.972 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.549 HG23 ' O ' ' A' ' 125' ' ' TRP . 87.2 t -102.13 135.23 19.69 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.641 174.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.484 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 88.3 Cg_endo -89.05 -153.33 0.64 Allowed 'Cis proline' 0 N--CA 1.462 -0.344 0 C-N-CA 124.085 -1.215 . . . . 0.0 112.851 1.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.585 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 53.5 mtmt 76.28 7.1 3.54 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.836 0.855 . . . . 0.0 111.759 -176.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.2 171.25 7.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 173.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -169.94 176.02 43.85 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.43 -0.89 . . . . 0.0 112.244 -174.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.563 HD13 ' HG2' ' A' ' 95' ' ' PRO . 60.9 tp -61.97 -37.09 83.46 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 122.784 0.433 . . . . 0.0 111.49 -174.552 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.54 -39.58 76.93 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.403 0.62 . . . . 0.0 110.591 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -69.93 -36.1 75.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.065 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.501 HD22 ' HD2' ' A' ' 95' ' ' PRO . 57.3 tp -66.42 -53.49 35.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.414 -179.087 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.2 ptt? -62.18 -35.64 79.44 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.522 -175.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.34 -41.76 69.4 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.7 mt -95.61 -12.12 26.15 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -172.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -112.91 -53.9 0.47 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.155 -1.022 . . . . 0.0 113.739 -175.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.501 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 52.0 tp -64.36 -42.54 96.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.715 0.258 . . . . 0.0 111.479 -173.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.05 -61.69 7.22 Favored Glycine 0 CA--C 1.522 0.471 0 C-N-CA 121.244 -0.503 . . . . 0.0 113.068 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -58.38 -29.01 86.92 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.733 2.288 . . . . 0.0 113.081 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -66.87 -37.46 84.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.744 0.307 . . . . 0.0 110.818 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 91.8 mt -55.21 -38.13 68.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.316 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.57 -6.11 46.66 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 57.5 t -82.14 -40.1 17.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.734 0.302 . . . . 0.0 111.584 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -125.01 -39.78 2.22 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -173.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.469 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 48.2 mm -55.02 -52.56 70.0 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -169.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.6 Cg_endo -54.27 -33.86 77.38 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.102 1.868 . . . . 0.0 112.921 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.506 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 20.7 t70 -87.14 -29.67 21.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.9 0.381 . . . . 0.0 110.371 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.624 ' HA ' ' HE2' ' A' ' 156' ' ' LYS . 24.2 tp -56.96 -39.65 74.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.589 179.389 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 60.4 mt -64.18 -40.32 88.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.361 176.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -66.93 -34.62 78.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.223 -178.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' LYS . . . . . 0.624 ' HE2' ' HA ' ' A' ' 153' ' ' LEU . 54.4 mttm -55.6 -30.76 61.45 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.087 0.47 . . . . 0.0 110.962 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.88 13.64 71.69 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.688 -0.768 . . . . 0.0 111.756 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 28.7 m -79.7 -17.12 12.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.136 0.494 . . . . 0.0 110.78 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 61.8 mt -91.95 125.84 44.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.007 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 19.6 tm0? -71.15 130.56 41.79 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 9.0 p80 -67.44 95.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.177 0.513 . . . . 0.0 111.301 -178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -94.95 -167.52 1.65 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.595 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 67.39 6.66 5.03 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.679 174.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -75.27 -42.46 54.88 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 177.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 40.6 t -71.82 129.14 37.91 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 174.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -78.06 93.89 4.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.961 0.41 . . . . 0.0 110.745 -176.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -105.73 136.67 44.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.867 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 49.0 tp -120.91 137.01 54.8 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 177.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.04 149.3 25.92 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 58.2 t60 -129.21 88.67 2.74 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -86.77 110.1 19.69 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.025 -177.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 70.4 t60 -58.17 117.86 4.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.102 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 37.6 m80 -87.1 175.2 8.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.094 177.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 11.6 p80 -71.62 -16.16 62.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.185 0.517 . . . . 0.0 109.915 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 117.983 -1.008 . . . . 0.0 109.253 -178.23 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ptm . . . . . 0 N--CA 1.481 1.103 0 CA-C-O 120.53 0.205 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.39 82.45 7.21 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.743 0.306 . . . . 0.0 110.871 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 58.4 73.16 0.49 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.757 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -67.52 -30.19 69.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.171 -176.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.421 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -60.63 -43.11 97.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.106 0.479 . . . . 0.0 109.856 176.046 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 25.0 m -66.94 -43.5 83.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.42 177.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.08 -49.19 78.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.696 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.445 ' HG3' ' N ' ' A' ' 9' ' ' VAL . 12.4 ptm180 -65.44 -45.3 84.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.437 -175.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.445 ' N ' ' HG3' ' A' ' 8' ' ' ARG . 88.4 t -61.73 -43.65 97.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 C-N-CA 121.124 -0.231 . . . . 0.0 111.047 -177.013 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.7 t -63.96 -31.35 52.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.915 0.388 . . . . 0.0 110.696 178.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.1 m -83.18 -17.33 43.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.257 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -93.08 -4.3 52.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.328 0.585 . . . . 0.0 110.095 175.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.1 mt -116.63 89.07 26.82 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.619 176.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -40.67 139.52 1.24 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.058 3.172 . . . . 0.0 113.687 -176.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.599 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.5 m -81.23 151.46 4.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.325 -177.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.6 mp -83.98 169.53 14.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.436 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.405 ' N ' ' HD2' ' A' ' 17' ' ' LYS . 2.6 mptp? -122.64 -48.39 2.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.959 0.409 . . . . 0.0 110.235 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.8 m -84.32 95.54 8.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.407 0.623 . . . . 0.0 110.957 -177.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -89.22 79.46 7.11 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.444 0.64 . . . . 0.0 110.089 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -122.68 168.23 12.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.075 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.53 ' HA3' ' O ' ' A' ' 90' ' ' TYR . . . -125.38 177.89 16.79 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.247 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.551 ' HB2' HG23 ' A' ' 88' ' ' ILE . 18.0 Cg_exo -66.45 -4.46 10.81 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 123.317 2.678 . . . . 0.0 112.959 -175.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.465 ' HD2' HG22 ' A' ' 88' ' ' ILE . 15.0 mmm180 -64.65 -35.44 81.02 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.946 0.403 . . . . 0.0 109.948 174.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -110.25 106.41 15.8 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.59 ' O ' HG23 ' A' ' 29' ' ' VAL . 74.6 mtm180 -61.6 -39.46 91.32 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.807 -173.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -70.02 -47.47 61.97 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.899 0.38 . . . . 0.0 110.958 -175.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 27' ' ' LEU . 4.4 mm? -67.96 -28.43 67.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.373 177.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 59.6 t-105 -64.59 -39.46 93.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.891 174.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.59 HG23 ' O ' ' A' ' 25' ' ' ARG . 72.4 t -55.8 -44.27 76.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.489 175.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -64.46 -50.74 66.31 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.369 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.417 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 22.8 ttt180 -62.47 -36.59 82.95 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.07 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.81 -40.86 69.95 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 178.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.547 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 66.9 mttm -65.86 -44.65 84.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.3 177.181 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -64.71 -41.46 95.97 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.531 -178.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -58.87 -43.33 90.82 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.2 0.524 . . . . 0.0 109.661 175.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -65.74 -31.35 72.3 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.451 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.547 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 28.9 mm-40 -61.01 -47.44 86.45 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.806 0.336 . . . . 0.0 110.419 178.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.0 m -63.04 -40.62 98.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.491 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.483 ' O ' HG23 ' A' ' 43' ' ' VAL . 95.7 mt -63.78 -55.43 23.13 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.229 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 97.9 mt -56.63 -43.08 78.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 O-C-N 123.29 0.368 . . . . 0.0 111.267 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.1 tpp85 -57.99 -47.19 83.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.605 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -69.82 -37.69 76.31 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.782 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 39' ' ' LEU . 75.3 t -60.56 -40.24 83.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.878 0.37 . . . . 0.0 110.675 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.591 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 40.7 mt-10 -70.32 -37.86 74.81 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.979 177.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -57.69 -42.61 83.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.426 0.631 . . . . 0.0 109.698 172.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.606 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 1.5 m120 -62.55 -57.56 10.68 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.708 -1.133 . . . . 0.0 112.008 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.591 ' HG2' ' HA ' ' A' ' 44' ' ' GLU . 21.7 ptmt -66.6 -25.64 66.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.483 -175.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -76.42 -21.02 56.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.951 0.405 . . . . 0.0 110.692 176.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -97.95 4.04 49.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.059 175.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.4 t70 60.06 26.38 15.71 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.956 0.884 . . . . 0.0 110.908 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -134.67 87.55 2.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.005 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.606 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 41.9 t0 -83.06 156.71 23.21 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.053 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.566 ' HB3' ' CD2' ' A' ' 54' ' ' PHE . 1.2 m95 -100.25 -56.9 2.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.863 -170.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.566 ' CD2' ' HB3' ' A' ' 53' ' ' TRP . 44.5 p90 -161.51 157.52 25.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.327 0.584 . . . . 0.0 111.87 -172.277 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.449 ' HD2' ' HA ' ' A' ' 55' ' ' ARG . 19.7 tpt180 -108.46 123.72 49.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 168.028 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.0 tp -130.92 124.12 30.41 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.061 0.458 . . . . 0.0 110.683 -173.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -101.9 158.51 16.08 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.465 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.2 m -141.84 149.92 40.93 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.753 0.311 . . . . 0.0 110.687 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.0 p-10 -79.27 169.97 17.33 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 172.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.662 ' HD3' ' H ' ' A' ' 60' ' ' LYS . 1.9 mppt? -63.31 -24.04 67.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.764 0.316 . . . . 0.0 111.534 -175.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -82.0 -22.41 36.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.911 -177.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.25 21.93 79.26 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.783 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.518 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . 15.4 p -99.42 -28.09 13.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.176 0.512 . . . . 0.0 111.182 -177.553 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.733 HH22 ' HB3' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -119.27 109.11 15.44 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.462 -178.399 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.99 ' HB2' ' HB2' ' A' ' 84' ' ' PHE . 27.1 m95 -107.51 140.18 40.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.138 177.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -152.35 142.42 22.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.789 0.328 . . . . 0.0 110.687 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 173.71 -149.82 11.33 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -142.02 138.61 31.95 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.894 0.347 . . . . 0.0 110.596 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.445 ' HA ' ' HB3' ' A' ' 54' ' ' PHE . 49.0 t -122.34 150.93 41.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.008 -178.366 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.722 ' HB3' ' HA ' ' A' ' 79' ' ' GLU . 47.5 p90 -159.9 159.98 33.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.817 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -149.2 139.64 22.44 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 172.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 26.1 mm -84.03 114.4 24.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.011 0.434 . . . . 0.0 110.938 -173.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 35.2 t-80 -127.11 122.19 33.55 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.476 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 62.3 34.07 16.09 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 123.667 0.604 . . . . 0.0 110.075 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.664 HD12 ' HA ' ' A' ' 164' ' ' LYS . 1.8 tm? 75.36 -20.03 0.37 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.927 -178.15 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.4 mt -66.2 115.79 6.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.737 0.303 . . . . 0.0 110.86 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -94.34 106.97 18.95 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.478 ' HD1' ' HE1' ' A' ' 80' ' ' PHE . 6.7 p90 -121.8 117.69 27.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.129 0.49 . . . . 0.0 110.432 177.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.722 ' HA ' ' HB3' ' A' ' 70' ' ' TRP . 0.9 OUTLIER -110.72 138.98 46.42 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.867 -177.424 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.478 ' HE1' ' HD1' ' A' ' 78' ' ' TYR . 65.5 m-85 -127.83 129.79 47.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.63 -177.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -73.65 125.0 27.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.226 0.536 . . . . 0.0 110.206 174.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.509 HG22 HG13 ' A' ' 99' ' ' VAL . 38.3 pt -127.92 155.34 39.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.659 -175.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.733 ' HB3' HH22 ' A' ' 64' ' ' ARG . 44.7 mt-10 -127.37 163.0 24.98 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.771 175.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.99 ' HB2' ' HB2' ' A' ' 65' ' ' TRP . 93.2 m-85 -134.94 143.32 46.82 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.435 176.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -121.56 137.96 54.51 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.518 ' HB ' ' HA ' ' A' ' 63' ' ' THR . 51.0 mm -108.3 89.38 5.79 Favored Pre-proline 0 C--N 1.312 -1.057 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.463 -178.404 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -56.98 150.31 56.55 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.101 1.867 . . . . 0.0 110.531 175.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.551 HG23 ' HB2' ' A' ' 22' ' ' PRO . 2.1 mt -79.16 1.48 2.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.544 0.688 . . . . 0.0 109.996 -174.404 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.1 p -88.02 -4.94 58.74 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.737 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.717 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 33.5 t80 -65.39 145.51 99.06 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.528 175.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.717 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 98.1 Cg_endo -95.75 5.53 45.67 Favored 'Cis proline' 0 N--CA 1.455 -0.753 0 C-N-CA 124.453 -1.061 . . . . 0.0 113.029 0.161 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 10.2 m -62.13 -33.7 74.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.537 0.684 . . . . 0.0 109.653 178.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.0 m -111.59 135.47 52.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.065 171.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.56 146.16 98.99 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.051 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.534 ' HD3' ' CE1' ' A' ' 90' ' ' TYR . 57.3 Cg_endo -73.74 159.07 46.16 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.54 2.16 . . . . 0.0 111.697 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -104.5 129.8 52.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.187 0.518 . . . . 0.0 111.178 -175.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.499 HD12 HD13 ' A' ' 115' ' ' ILE . 54.4 mt -101.64 123.64 54.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.215 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -113.08 135.0 54.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.115 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.509 HG13 HG22 ' A' ' 82' ' ' ILE . 18.7 t -121.09 87.74 44.21 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-O 120.588 0.233 . . . . 0.0 111.407 -176.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.45 -20.63 71.08 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.993 2.462 . . . . 0.0 112.347 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.41 ' HG2' ' HA ' ' A' ' 80' ' ' PHE . 9.8 tp10 -71.75 -29.03 64.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.204 0.526 . . . . 0.0 110.602 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.0 mt -98.28 -31.43 12.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -50.86 109.64 0.34 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 123.724 0.64 . . . . 0.0 111.554 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 92.23 -36.75 3.57 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.747 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.407 ' HG2' HG11 ' A' ' 158' ' ' VAL . 37.2 ttpt -81.45 -26.55 35.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.081 0.467 . . . . 0.0 111.031 -175.191 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 5.8 t -113.83 161.79 17.13 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.838 0.352 . . . . 0.0 110.596 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.56 ' O ' ' HB3' ' A' ' 108' ' ' LYS . . . -111.61 -173.44 2.24 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.675 ' HB3' ' NZ ' ' A' ' 108' ' ' LYS . 3.8 ttpm? 75.31 -29.56 0.19 Allowed 'General case' 0 N--CA 1.471 0.576 0 O-C-N 123.3 0.375 . . . . 0.0 111.686 176.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 41.6 ttm -73.45 124.39 25.72 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 172.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.488 ' HE1' ' HB3' ' A' ' 116' ' ' CYS . 20.5 p90 -66.78 152.71 45.0 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 177.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.49 ' HD2' ' HA ' ' A' ' 111' ' ' ARG . 11.5 tpt180 -61.55 113.58 2.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.101 0.477 . . . . 0.0 110.628 -179.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 177.28 -35.32 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.75 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 87.94 -13.22 61.74 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.419 176.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 97' ' ' ILE . 17.1 ptpt -101.87 158.68 15.95 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.499 HD13 HD12 ' A' ' 97' ' ' ILE . 38.6 pt -72.28 147.98 9.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.958 0.409 . . . . 0.0 111.323 -176.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.488 ' HB3' ' HE1' ' A' ' 110' ' ' TYR . 2.0 p -97.97 116.98 31.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.523 178.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 96.7 mt -92.77 158.69 15.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.988 0.423 . . . . 0.0 111.28 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.2 t -87.62 157.39 19.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.207 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.28 -53.35 59.16 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 -172.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -71.59 -10.01 59.11 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -173.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -71.06 -33.96 70.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.928 0.394 . . . . 0.0 110.238 178.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -62.14 -55.39 41.04 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.632 -177.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -62.42 -34.84 75.27 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.584 1.523 . . . . 0.0 111.917 175.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 49.2 tp -59.35 -46.41 88.7 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.368 177.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 57.3 t-105 -59.33 -56.03 27.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.707 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.33 -36.51 82.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.159 -175.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -67.72 -31.89 72.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.301 -177.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -95.96 20.97 9.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.455 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 90.4 t -91.28 137.6 26.11 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 172.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.444 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 97.5 Cg_endo -93.36 -152.88 0.37 Allowed 'Cis proline' 0 N--CA 1.46 -0.493 0 C-N-CA 124.265 -1.139 . . . . 0.0 113.58 2.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.599 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 9.6 mtmp? 77.21 -5.96 2.08 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.955 0.902 . . . . 0.0 111.614 -176.138 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -80.74 152.22 28.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.291 174.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.417 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -156.72 179.17 32.74 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.797 -0.716 . . . . 0.0 111.977 -174.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' A' ' 138' ' ' MET . 53.9 tp -64.73 -40.76 95.87 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 122.57 0.348 . . . . 0.0 111.197 -174.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.42 -35.91 76.92 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.499 0.666 . . . . 0.0 110.751 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' HIS . . . . . 0.417 ' HE1' ' HA ' ' A' ' 15' ' ' VAL . 47.7 m80 -71.23 -33.02 69.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.166 178.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 62.0 tp -66.49 -33.81 76.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.321 176.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 134' ' ' LEU . 23.7 mmt -56.87 -55.65 31.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.098 0.475 . . . . 0.0 110.173 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.17 -40.77 82.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.674 -0.693 . . . . 0.0 112.657 -177.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.1 mt -86.36 -28.97 23.31 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -171.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -115.61 -57.13 0.34 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.285 -0.959 . . . . 0.0 113.165 -175.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.496 HD12 HD13 ' A' ' 97' ' ' ILE . 10.2 tt -62.48 -49.51 75.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.64 0.257 . . . . 0.0 111.208 -174.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.25 -61.45 7.38 Favored Glycine 0 CA--C 1.524 0.65 0 CA-C-N 116.178 -0.465 . . . . 0.0 113.49 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.83 -35.77 89.39 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.891 2.394 . . . . 0.0 113.059 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -65.22 -40.93 94.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.613 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 80.1 mt -59.95 -33.58 72.11 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.805 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.73 -13.87 62.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.663 -177.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 44.8 t -103.17 -35.85 3.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.091 0.472 . . . . 0.0 110.641 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -85.71 -51.89 6.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.027 -174.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.561 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 40.8 mm -60.67 -52.11 74.9 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -170.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.561 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 56.2 Cg_exo -53.74 -34.71 75.74 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 122.18 1.92 . . . . 0.0 112.707 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -67.14 -41.03 86.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.595 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 57.8 tp -68.81 -35.72 77.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.082 0.468 . . . . 0.0 110.371 176.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.516 HG12 HD12 ' A' ' 159' ' ' ILE . 77.2 mt -62.4 -48.3 88.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.363 177.324 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -66.01 -26.06 67.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.842 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' LYS . . . . . 0.565 ' HE3' HG21 ' A' ' 158' ' ' VAL . 34.8 ttpt -74.0 -16.03 61.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.987 0.422 . . . . 0.0 110.268 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 83.62 18.32 64.16 Favored Glycine 0 C--O 1.229 -0.164 0 C-N-CA 121.078 -0.582 . . . . 0.0 113.607 172.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' VAL . . . . . 0.565 HG21 ' HE3' ' A' ' 156' ' ' LYS . 41.1 t -88.4 -18.59 8.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.526 0.679 . . . . 0.0 110.751 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.516 HD12 HG12 ' A' ' 154' ' ' ILE . 66.0 mt -93.19 129.28 43.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.454 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.29 119.88 7.18 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 177.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -70.05 108.32 4.02 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -176.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.525 ' HA ' ' HE3' ' A' ' 162' ' ' LYS . 0.8 OUTLIER -63.19 134.78 56.52 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.251 -177.205 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.18 121.2 17.92 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.265 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.664 ' HA ' HD12 ' A' ' 75' ' ' LEU . 3.7 ttmp? -89.98 -26.14 20.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.039 -174.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' CYS . . . . . 0.632 ' HA ' HD12 ' A' ' 168' ' ' LEU . 84.1 m -83.35 4.29 27.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.033 0.444 . . . . 0.0 111.184 -177.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -103.87 126.03 50.71 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 66.46 28.03 9.65 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.787 0.803 . . . . 0.0 109.596 -177.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.632 HD12 ' HA ' ' A' ' 165' ' ' CYS . 1.2 tt -77.12 110.86 12.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.428 -178.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -55.04 -36.6 65.69 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.542 -0.753 . . . . 0.0 111.85 -174.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' HIS . . . . . 0.505 ' HB2' HD22 ' A' ' 168' ' ' LEU . 26.8 m-70 -64.0 -22.09 66.78 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -112.27 -20.29 11.91 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.072 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -64.13 -41.4 97.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.456 174.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -109.12 121.99 46.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.719 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -72.35 119.48 16.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.411 -178.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 . . . . . 0 C--O 1.245 0.844 0 CA-C-O 118.495 -0.764 . . . . 0.0 109.542 178.575 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.904 0 CA-C-O 120.85 0.357 . . . . 0.0 110.204 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -114.61 14.17 17.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.231 0.539 . . . . 0.0 110.403 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -120.92 127.32 51.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.643 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.46 ' H ' ' CD ' ' A' ' 4' ' ' GLU . 0.1 OUTLIER -78.34 -35.15 47.92 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.092 -177.972 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.47 ' HA ' ' NE ' ' A' ' 8' ' ' ARG . . . -62.98 -46.37 88.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.907 0.384 . . . . 0.0 110.745 -178.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.452 ' O ' HG23 ' A' ' 10' ' ' VAL . 24.8 m -56.62 -49.53 74.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.186 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.6 ptt180 -67.79 -38.24 83.07 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -173.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.47 ' NE ' ' HA ' ' A' ' 5' ' ' ALA . 17.3 ptt180 -71.17 -32.23 68.65 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.535 -177.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 5' ' ' ALA . 79.1 t -68.64 -45.59 81.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 6' ' ' THR . 57.4 t -67.89 -26.5 34.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.891 0.377 . . . . 0.0 110.899 178.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.3 t -70.03 -50.79 37.83 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.741 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.424 ' O ' ' HD2' ' A' ' 41' ' ' ARG . 50.2 mt-10 -83.94 -8.96 59.04 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -176.097 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.416 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 54.0 mt -104.74 88.2 2.16 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 170.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.6 Cg_endo -49.42 146.09 14.83 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.919 3.079 . . . . 0.0 113.657 -170.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.0 m -77.55 160.8 4.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.255 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.505 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 6.1 mp -110.05 148.99 30.65 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.161 -176.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -110.24 -20.96 12.47 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 -174.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 32.7 m -88.44 115.86 26.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.771 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -112.49 104.34 12.45 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -151.07 157.94 43.44 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.266 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.17 -177.05 29.04 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.152 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.95 5.68 5.15 Favored 'Trans proline' 0 CA--C 1.531 0.348 0 C-N-CA 122.913 2.409 . . . . 0.0 113.103 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.811 ' HA ' ' HE ' ' A' ' 23' ' ' ARG . 0.4 OUTLIER -92.52 -46.61 7.55 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 177.598 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -80.16 75.9 6.93 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 174.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.591 ' HA ' ' HB3' ' A' ' 28' ' ' TRP . 93.8 mtt180 -71.22 -25.06 62.34 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -168.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.602 ' HG3' HD22 ' A' ' 27' ' ' LEU . 7.5 pt-20 -63.53 -35.78 81.61 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.371 171.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.602 HD22 ' HG3' ' A' ' 26' ' ' GLU . 3.8 mm? -81.29 -29.52 34.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.046 0.451 . . . . 0.0 109.954 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.591 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 64.5 t-105 -61.16 -39.18 89.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.445 177.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 25' ' ' ARG . 87.2 t -59.55 -40.96 83.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 121.107 0.479 . . . . 0.0 110.414 175.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -66.86 -41.76 86.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.226 0.536 . . . . 0.0 109.678 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.551 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 11.8 tpt180 -62.23 -36.54 82.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.805 176.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 61.9 mt -57.8 -54.9 41.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.215 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.47 ' HB2' ' HE3' ' A' ' 33' ' ' LYS . 19.1 ptmt -61.23 -37.02 81.57 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.572 -176.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -59.31 -50.87 72.32 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.133 0.492 . . . . 0.0 110.68 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.452 ' HA ' HD21 ' A' ' 16' ' ' LEU . 8.5 tp10 -65.44 -42.05 92.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.138 -178.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.474 ' O ' HG13 ' A' ' 40' ' ' ILE . 23.5 m-85 -60.53 -45.36 94.11 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.165 178.284 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -60.66 -40.63 92.77 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.655 0.264 . . . . 0.0 110.848 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.405 ' HA ' ' HG2' ' A' ' 14' ' ' PRO . 8.3 t -64.73 -46.89 80.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.97 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.497 ' O ' HG23 ' A' ' 43' ' ' VAL . 64.0 mt -56.07 -53.92 51.26 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.293 177.151 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.523 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 82.5 mt -55.98 -40.67 64.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.883 -175.27 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.483 ' HD3' ' O ' ' A' ' 41' ' ' ARG . 0.0 OUTLIER -61.33 -44.34 97.35 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.704 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -65.91 -36.99 84.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.11 178.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 39' ' ' LEU . 94.9 t -64.89 -42.46 94.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.62 177.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 42.1 mt-10 -53.51 -56.21 18.9 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 123.315 0.384 . . . . 0.0 111.289 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -52.22 -41.85 63.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.146 0.498 . . . . 0.0 111.075 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.599 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 83.3 m-20 -72.47 -51.07 21.73 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.602 -176.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 31.9 mmmt -59.08 -38.93 80.61 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.557 0.218 . . . . 0.0 111.14 176.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -63.57 -41.46 98.38 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.499 178.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.18 3.69 22.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.865 0.364 . . . . 0.0 110.495 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.1 t70 67.9 9.38 7.1 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.681 0.792 . . . . 0.0 111.23 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.599 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 5.9 t30 -98.78 77.3 2.24 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.77 102.5 0.59 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.386 0.613 . . . . 0.0 109.848 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.574 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -67.04 -57.16 7.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.66 -1.155 . . . . 0.0 112.437 -168.808 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.574 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 37.1 p90 -156.72 161.44 39.82 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.27 0.557 . . . . 0.0 111.152 -171.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.499 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 18.4 tpp85 -121.46 123.42 42.02 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 171.311 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 19.4 tp -124.03 122.68 38.54 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.031 0.443 . . . . 0.0 110.401 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -105.59 156.06 18.61 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.442 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.8 p -135.54 159.72 40.73 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.767 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.406 ' ND2' ' HB3' ' A' ' 64' ' ' ARG . 97.8 m-20 -73.1 176.32 5.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.104 173.374 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -57.56 -43.08 84.21 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.915 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -81.22 -20.47 40.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.718 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.82 25.97 65.93 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.646 -0.787 . . . . 0.0 111.314 -173.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.7 p -85.71 -4.89 59.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.972 0.415 . . . . 0.0 112.014 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.406 ' HB3' ' ND2' ' A' ' 59' ' ' ASN . 56.0 ttt180 -155.95 129.86 8.58 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 -179.232 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -121.22 142.09 50.24 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 -177.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -155.0 160.99 41.48 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 -177.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.499 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 163.68 -160.09 32.83 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.537 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -115.21 147.07 40.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.811 0.339 . . . . 0.0 110.91 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.588 ' SG ' ' HB2' ' A' ' 80' ' ' PHE . 5.3 p -117.49 134.26 55.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.134 172.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.457 ' CD1' ' HG2' ' A' ' 79' ' ' GLU . 13.6 m-90 -114.24 128.65 56.46 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.221 0.534 . . . . 0.0 111.559 -175.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -136.21 120.6 18.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.088 175.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.415 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.7 mp -105.61 123.73 60.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.981 0.419 . . . . 0.0 110.486 -176.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -128.46 108.31 10.44 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.717 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.27 57.69 4.33 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.674 0.609 . . . . 0.0 111.31 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.587 ' HB3' ' HB3' ' A' ' 164' ' ' LYS . 88.8 mt 70.11 -0.6 2.72 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.355 -0.839 . . . . 0.0 113.141 175.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 66.5 mt -91.91 113.69 26.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.999 0.428 . . . . 0.0 110.571 177.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.3 tttt -99.95 96.3 7.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.181 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -104.54 125.96 51.18 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.053 0.454 . . . . 0.0 110.182 176.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.457 ' HG2' ' CD1' ' A' ' 70' ' ' TRP . 28.4 mt-10 -106.88 135.41 48.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.186 -174.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.588 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . 84.7 m-85 -120.9 129.97 53.71 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.679 0.276 . . . . 0.0 110.871 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -88.09 121.09 30.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.859 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.403 HG22 HG22 ' A' ' 99' ' ' VAL . 40.1 pt -125.34 157.19 34.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.541 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -158.57 158.99 35.0 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.723 174.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.42 ' CE1' HD21 ' A' ' 134' ' ' LEU . 30.5 p90 -159.14 153.79 24.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.349 177.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.433 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 8.7 p-10 -99.41 166.6 11.1 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.89 -177.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.3 mm -111.95 89.68 12.0 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.201 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.433 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 11.0 Cg_exo -66.02 164.66 26.62 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.551 2.167 . . . . 0.0 112.12 -177.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 58.0 mt -66.49 -22.14 29.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.36 0.6 . . . . 0.0 110.052 177.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -82.23 3.38 27.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.041 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -77.94 142.72 65.17 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -96.23 10.51 41.76 Favored 'Cis proline' 0 N--CA 1.457 -0.645 0 C-N-CA 124.178 -1.176 . . . . 0.0 113.126 -1.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.523 ' HA ' HG11 ' A' ' 129' ' ' VAL . 15.9 m -56.51 -35.3 67.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.32 0.581 . . . . 0.0 110.99 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.4 m -130.66 127.62 39.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.886 175.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.4 ' HB2' ' CE2' ' A' ' 125' ' ' TRP . . . -73.38 143.44 82.81 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.824 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -83.63 134.0 6.31 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.69 2.26 . . . . 0.0 112.226 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.625 ' HB2' ' HD2' ' A' ' 114' ' ' LYS . 2.9 mp0 -62.24 132.64 53.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.149 176.079 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.501 ' O ' HG12 ' A' ' 115' ' ' ILE . 57.7 mt -75.64 143.47 13.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.391 -178.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.517 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -107.45 124.1 49.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.792 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.403 HG22 HG22 ' A' ' 82' ' ' ILE . 25.6 t -119.98 87.22 38.25 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.016 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -70.73 6.2 1.74 Allowed 'Trans proline' 0 N--CA 1.474 0.379 0 C-N-CA 123.5 2.8 . . . . 0.0 114.046 -173.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -103.95 -44.03 5.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.836 0.351 . . . . 0.0 110.84 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.826 ' HA ' ' HD3' ' A' ' 105' ' ' LYS . 91.4 mt -83.47 0.33 46.78 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -172.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.497 ' HA ' ' SD ' ' A' ' 109' ' ' MET . 8.1 p-10 -64.6 -15.1 60.6 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -171.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -114.8 2.71 23.03 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.56 -0.828 . . . . 0.0 113.633 -177.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.826 ' HD3' ' HA ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -127.96 -20.34 3.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.688 0.744 . . . . 0.0 112.37 -178.466 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.578 HG22 ' O ' ' A' ' 102' ' ' LEU . 7.7 t -110.85 -32.88 6.69 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.382 173.135 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 59.58 25.92 14.86 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.87 177.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.9 tppt? -83.11 7.05 17.09 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.266 0.555 . . . . 0.0 110.368 -178.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.497 ' SD ' ' HA ' ' A' ' 103' ' ' ASP . 1.9 mpt? -91.45 134.74 34.37 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.152 -178.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -114.92 6.3 15.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.174 0.511 . . . . 0.0 110.735 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.664 ' HB3' ' HB2' ' A' ' 114' ' ' LYS . 24.0 ttm180 -156.49 82.18 0.97 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.531 175.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 63.45 -103.47 0.68 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.196 -177.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLY . . . . . 0.517 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . -100.42 -5.54 54.13 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.292 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.664 ' HB2' ' HB3' ' A' ' 111' ' ' ARG . 64.1 mmtt -70.03 111.77 5.94 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 122.422 0.289 . . . . 0.0 110.978 -179.184 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 97' ' ' ILE . 34.9 pt -81.65 164.17 3.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.312 -178.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 53.0 t -99.85 119.89 38.9 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.058 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 96.1 mt -79.17 177.07 9.1 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.859 175.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.65 140.18 58.84 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.561 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.09 -46.56 61.83 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -171.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.6 m170 -92.91 -5.93 49.73 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.414 -174.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -71.38 -41.18 69.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.357 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.566 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 79.2 tttt -65.79 -49.89 57.11 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.68 -177.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.566 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 34.6 Cg_exo -60.99 -32.15 92.08 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.839 1.693 . . . . 0.0 111.83 175.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 52.3 tp -60.82 -46.98 88.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.984 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.492 ' O ' HG23 ' A' ' 129' ' ' VAL . 17.7 t-105 -54.23 -56.66 16.18 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.565 177.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -58.23 -35.21 71.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.648 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 127' ' ' ARG . 6.1 ttp180 -68.31 -36.31 79.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.066 0.46 . . . . 0.0 110.801 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -79.76 -31.4 40.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.513 -173.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.523 HG11 ' HA ' ' A' ' 92' ' ' THR . 94.8 t -53.5 137.24 51.75 Favored Pre-proline 0 N--CA 1.468 0.433 0 O-C-N 123.394 0.434 . . . . 0.0 110.545 176.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.493 ' HA ' HG13 ' A' ' 129' ' ' VAL . 86.5 Cg_endo -90.43 -147.55 0.28 Allowed 'Cis proline' 0 C--N 1.349 0.572 0 C-N-CA 124.28 -1.133 . . . . 0.0 113.204 5.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 33.1 ttpt 67.5 4.69 3.93 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.409 0.684 . . . . 0.0 111.439 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -101.56 159.96 14.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.789 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.551 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -136.78 158.25 24.07 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.947 -174.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.42 HD21 ' CE1' ' A' ' 84' ' ' PHE . 53.6 tp -63.84 -38.76 92.29 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.23 0.612 . . . . 0.0 111.198 -177.015 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.59 -31.03 56.24 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.407 0.622 . . . . 0.0 111.165 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -71.2 -31.46 67.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.514 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 63.1 tp -61.73 -48.34 81.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.943 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 5.4 mpp? -66.25 -41.03 90.52 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.738 0.304 . . . . 0.0 111.206 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.18 -49.99 44.83 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 87.8 mt -88.86 -21.71 23.54 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -172.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -106.77 -62.58 0.59 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.01 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.501 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 53.9 tp -64.75 -42.15 95.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 -175.026 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.03 -61.87 6.49 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 121.248 -0.501 . . . . 0.0 112.991 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' PRO . . . . . 0.478 ' O ' HG23 ' A' ' 148' ' ' VAL . 48.9 Cg_exo -58.66 -33.84 98.52 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.635 2.223 . . . . 0.0 112.699 176.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 39.9 t90 -59.72 -44.31 93.78 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.994 0.426 . . . . 0.0 110.258 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 76.8 mt -62.75 -37.75 87.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.719 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.9 -11.84 61.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.907 -176.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 144' ' ' PRO . 59.5 t -89.13 -46.66 15.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.787 0.327 . . . . 0.0 110.828 178.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.444 ' O ' HD23 ' A' ' 153' ' ' LEU . 59.2 mm-40 -83.8 -43.14 15.72 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -173.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.504 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 1.6 mp -54.21 -50.97 81.63 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -170.273 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.504 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 11.6 Cg_endo -54.91 -34.0 84.31 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 122.108 1.872 . . . . 0.0 113.055 -178.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -87.5 -43.2 12.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.98 0.419 . . . . 0.0 110.75 -177.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 149' ' ' GLU . 4.2 mm? -60.44 -35.58 76.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.639 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.534 ' HA ' ' HB ' ' A' ' 159' ' ' ILE . 67.9 mt -65.25 -40.32 88.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.066 0.46 . . . . 0.0 110.187 175.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -66.14 -34.75 78.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.564 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' LYS . . . . . 0.413 ' HD3' HD13 ' A' ' 153' ' ' LEU . 58.8 mtpt -65.29 -17.93 64.9 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.28 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 81.19 22.03 61.61 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.7 178.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 28.5 m -103.2 -21.16 5.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.855 0.359 . . . . 0.0 110.797 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.534 ' HB ' ' HA ' ' A' ' 154' ' ' ILE . 45.0 mm -84.25 138.62 18.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -65.32 102.82 0.71 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.188 0.518 . . . . 0.0 111.754 -176.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -102.86 110.46 22.39 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 172.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.457 ' HG3' ' H ' ' A' ' 163' ' ' GLU . 9.4 tptm -135.96 -158.05 0.84 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.523 -172.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.457 ' H ' ' HG3' ' A' ' 162' ' ' LYS . 34.4 mt-10 -60.32 131.65 51.44 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.059 -178.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.587 ' HB3' ' HB3' ' A' ' 75' ' ' LEU . 54.1 mttp -77.39 -18.12 57.57 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.194 -173.061 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 51.3 t -103.57 118.02 35.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.0 0.429 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -81.05 82.63 6.95 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -81.14 -2.61 49.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.94 -178.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -77.79 106.21 9.47 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.75 -179.5 3.96 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.199 177.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -117.59 126.71 53.03 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.954 -172.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -95.85 98.99 10.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.165 175.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 23.2 p80 -142.25 142.48 32.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.588 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 7.0 p80 -141.44 128.71 21.06 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.984 178.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -74.13 -31.69 62.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 177.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 78.9 t60 . . . . . 0 C--O 1.248 1.025 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.415 175.782 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.11 -21.15 29.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.868 0.366 . . . . 0.0 111.32 -177.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -89.78 20.57 4.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.101 0.477 . . . . 0.0 110.245 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.49 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 2.7 tm-20 -58.3 -54.64 44.75 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.097 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.465 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -59.58 -42.14 91.83 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.856 177.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.1 m -58.88 -51.14 71.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.609 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 4' ' ' GLU . 14.3 ptm180 -65.26 -38.07 89.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.702 -174.24 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.1 ppt_? -75.16 -23.5 57.78 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.247 -177.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 5' ' ' ALA . 76.1 t -75.56 -50.68 22.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.826 0.346 . . . . 0.0 110.217 175.655 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.8 t -62.29 -30.4 48.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.876 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.8 t -64.31 -21.89 66.76 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.386 -178.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -95.98 2.37 53.41 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.975 0.416 . . . . 0.0 110.812 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.462 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 32.1 mt -118.93 88.0 35.1 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.462 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 6.4 Cg_endo -46.76 148.64 3.63 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 124.398 3.399 . . . . 0.0 114.382 -170.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.4 m -83.36 152.88 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.237 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.761 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 6.1 mp -103.21 136.15 43.53 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.382 -175.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.47 ' N ' ' HD2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -94.76 -45.62 7.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.188 0.518 . . . . 0.0 110.779 -173.434 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.44 HG21 ' HB3' ' A' ' 30' ' ' GLN . 0.6 OUTLIER -88.86 83.35 6.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.224 -174.681 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.455 ' OD1' ' HD2' ' A' ' 31' ' ' ARG . 84.9 m-20 -124.62 127.37 47.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.413 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.457 ' HB3' ' HB3' ' A' ' 27' ' ' LEU . . . -140.45 -65.5 0.45 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.866 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 158.85 166.71 18.43 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.873 -0.679 . . . . 0.0 111.694 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.9 -10.87 29.47 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.061 2.508 . . . . 0.0 111.89 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.507 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 4.8 mmp_? -63.63 -44.47 93.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.417 176.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.539 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 10.3 t0 -91.74 111.28 22.73 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 -178.485 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.459 ' O ' HG23 ' A' ' 29' ' ' VAL . 18.1 mtp180 -55.14 -51.28 66.95 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.026 -178.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.77 -44.02 94.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.901 0.381 . . . . 0.0 111.345 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.539 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 4.4 mm? -70.55 -29.39 65.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.204 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.546 ' CH2' HG21 ' A' ' 86' ' ' ILE . 75.6 t-105 -73.99 -42.0 61.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 177.056 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 25' ' ' ARG . 72.1 t -60.97 -42.51 93.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.982 0.42 . . . . 0.0 110.082 176.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.454 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 8.6 mm-40 -62.15 -52.43 63.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.604 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.534 HH12 HD22 ' A' ' 16' ' ' LEU . 1.8 ttt85 -56.62 -39.37 73.49 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.144 0.278 . . . . 0.0 111.338 178.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.523 ' HG ' ' CE2' ' A' ' 36' ' ' TYR . 18.1 tp -57.34 -47.57 81.26 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.773 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -67.5 -38.97 85.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.863 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 6.7 mm-40 -55.76 -50.67 69.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.232 0.539 . . . . 0.0 110.312 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.539 ' HA ' HD21 ' A' ' 16' ' ' LEU . 12.6 tp10 -65.53 -37.85 87.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.424 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.523 ' CE2' ' HG ' ' A' ' 32' ' ' LEU . 10.7 m-85 -59.78 -38.28 81.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.145 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -60.59 -45.12 95.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.993 0.425 . . . . 0.0 110.252 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.7 t -63.77 -47.04 82.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.552 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.436 ' O ' HG23 ' A' ' 43' ' ' VAL . 94.7 mt -58.78 -48.08 82.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.093 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 36' ' ' TYR . 80.0 mt -57.86 -47.14 86.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.778 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -63.43 -40.25 96.67 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.704 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -59.76 -48.87 79.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.524 HG12 ' HE2' ' A' ' 47' ' ' LYS . 94.3 t -59.19 -38.41 74.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.781 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.63 -50.31 74.31 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 173.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.2 -40.47 81.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.918 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.431 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 16.2 m120 -55.72 -55.28 34.14 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.916 176.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.524 ' HE2' HG12 ' A' ' 43' ' ' VAL . 53.8 mttm -66.21 -34.81 78.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.973 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -68.41 -28.32 66.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.704 0.287 . . . . 0.0 111.384 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -93.81 2.16 56.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.754 0.312 . . . . 0.0 110.788 177.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.1 t0 64.24 20.14 12.06 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.827 0.822 . . . . 0.0 110.677 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -118.39 72.96 0.89 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.627 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.431 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 14.8 t70 -91.85 88.81 6.78 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.172 -179.307 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.444 ' HB2' ' O ' ' A' ' 70' ' ' TRP . 24.1 p-90 -117.28 2.95 12.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.986 -173.625 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -119.23 129.88 55.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.498 0.666 . . . . 0.0 112.195 -167.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -140.45 124.23 17.24 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.906 -1.043 . . . . 0.0 108.376 174.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.7 tp -134.49 127.99 32.52 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.764 0.316 . . . . 0.0 110.259 -178.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -128.39 160.42 32.28 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.5 p -142.23 172.72 12.31 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.997 0.427 . . . . 0.0 111.019 -176.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 33.1 p30 -89.66 163.55 15.09 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 168.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.472 ' HB2' ' HE2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -66.27 -21.39 66.28 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -172.825 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -74.38 -25.94 59.8 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.572 175.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.03 22.36 78.0 Favored Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.162 -177.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 26.8 p -89.97 -26.94 20.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.864 0.364 . . . . 0.0 111.336 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.3 mtt180 -127.58 132.99 49.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.034 0.445 . . . . 0.0 110.553 175.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -115.82 128.21 55.65 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.244 175.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.7 p90 -130.4 129.32 42.91 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -131.24 166.84 22.67 Favored Glycine 0 N--CA 1.435 -1.401 0 C-N-CA 119.838 -1.173 . . . . 0.0 113.28 -172.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -124.24 131.23 53.51 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.0 p -128.64 131.6 48.07 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.418 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.444 ' O ' ' HB2' ' A' ' 53' ' ' TRP . 6.7 p90 -133.26 121.47 22.5 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.261 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.435 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 14.5 t80 -117.82 129.44 55.66 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.896 -172.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.449 ' N ' HD12 ' A' ' 72' ' ' ILE . 4.0 mp -93.83 113.79 29.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -138.21 118.68 13.83 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.653 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 56.79 45.21 22.09 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.58 0.55 . . . . 0.0 110.84 -176.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.605 ' HB2' ' HB2' ' A' ' 166' ' ' ASN . 4.4 mm? 67.26 4.74 3.83 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.479 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 99.2 mt -96.96 113.14 24.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.106 0.479 . . . . 0.0 110.126 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -96.44 93.47 6.84 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.32 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.435 ' CE1' ' HB3' ' A' ' 71' ' ' TYR . 14.2 p90 -99.66 150.13 22.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.597 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -124.37 136.27 53.95 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.499 -174.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.412 ' HD1' ' HG2' ' A' ' 101' ' ' GLU . 96.4 m-85 -133.5 137.96 45.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.948 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -102.75 137.1 41.41 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.011 0.434 . . . . 0.0 110.051 176.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 99' ' ' VAL . 40.8 pt -136.41 158.16 37.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.396 -176.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -155.79 156.4 34.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.245 0.545 . . . . 0.0 110.829 175.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.589 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 42.4 p90 -155.46 149.81 25.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.23 177.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -102.36 163.52 12.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.503 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.546 HG21 ' CH2' ' A' ' 28' ' ' TRP . 50.8 mm -105.66 91.49 5.12 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.189 -178.278 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.04 164.01 10.86 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.677 2.251 . . . . 0.0 112.798 -179.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 73.4 mt -66.33 -33.39 63.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.196 -177.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.9 p -85.19 17.57 2.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.25 0.548 . . . . 0.0 111.64 -176.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.502 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 69.0 t80 -79.15 143.4 60.86 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 176.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.502 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.4 Cg_endo -96.7 14.74 36.42 Favored 'Cis proline' 0 N--CA 1.459 -0.509 0 C-N-CA 124.497 -1.043 . . . . 0.0 113.689 2.126 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.5 m -65.57 -26.93 68.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.543 0.687 . . . . 0.0 109.972 178.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.3 m -114.01 131.57 56.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.543 172.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -70.73 144.92 91.6 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.804 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 5.7 Cg_exo -72.8 143.41 37.14 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.8 2.334 . . . . 0.0 112.307 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.499 ' HB3' ' HD3' ' A' ' 114' ' ' LYS . 48.0 mt-10 -86.63 101.17 13.0 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.993 0.425 . . . . 0.0 110.046 179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.589 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 61.6 mt -74.35 125.42 33.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.781 -178.127 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -105.58 134.14 49.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.54 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.525 HG22 HG22 ' A' ' 82' ' ' ILE . 42.5 t -127.78 86.84 57.33 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.54 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.04 -24.53 73.93 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.861 2.374 . . . . 0.0 112.664 -175.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.412 ' HG2' ' HD1' ' A' ' 80' ' ' PHE . 10.4 tp10 -63.58 -38.9 92.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.574 176.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 98.7 mt -108.99 34.16 3.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.312 -177.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -63.01 -16.98 61.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.03 -175.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -171.74 30.17 0.12 Allowed Glycine 0 C--N 1.314 -0.65 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.145 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -100.08 8.2 44.11 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -175.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.572 HG23 ' HB2' ' A' ' 109' ' ' MET . 4.2 t -121.07 154.96 35.42 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 174.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -76.09 -27.95 57.36 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.7 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 21.9 pttm -115.49 101.03 8.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.391 0.615 . . . . 0.0 110.111 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.572 ' HB2' HG23 ' A' ' 106' ' ' THR . 12.6 tpt -139.26 156.62 46.94 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.711 -173.043 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -75.98 162.79 27.78 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -66.6 84.14 0.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.935 0.397 . . . . 0.0 111.053 176.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 135.71 -163.46 24.98 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 121.097 -0.573 . . . . 0.0 111.752 178.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -97.66 29.34 11.18 Favored Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.302 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.499 ' HD3' ' HB3' ' A' ' 96' ' ' GLU . 59.4 mttp -109.36 139.18 44.64 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 35.4 pt -68.02 146.69 12.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.149 0.499 . . . . 0.0 112.314 -173.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.2 t -104.53 100.07 9.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.885 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 97.3 mt -88.16 171.84 9.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.334 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 10.2 t -64.83 142.07 58.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.795 0.331 . . . . 0.0 110.161 178.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -65.42 -25.09 67.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.521 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -79.93 -6.67 57.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.734 0.302 . . . . 0.0 111.61 -177.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -71.71 -36.44 70.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.707 0.289 . . . . 0.0 110.529 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.453 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 99.8 mttt -68.21 -50.51 29.46 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.987 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 10.3 Cg_endo -55.29 -37.81 94.2 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 121.932 1.755 . . . . 0.0 111.88 172.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.77 -46.05 87.01 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.721 0.296 . . . . 0.0 110.27 176.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.58 ' O ' HG23 ' A' ' 129' ' ' VAL . 17.9 t-105 -53.16 -57.6 9.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.624 176.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.43 -27.35 68.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.647 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 -74.44 -25.29 59.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.958 0.409 . . . . 0.0 110.945 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -104.01 15.12 29.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.858 -175.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 125' ' ' TRP . 95.9 t -98.57 137.26 20.63 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.434 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 82.0 Cg_endo -89.98 -158.25 1.02 Allowed 'Cis proline' 0 N--CA 1.46 -0.473 0 C-N-CA 123.871 -1.304 . . . . 0.0 113.243 -0.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.761 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 57.8 mttp 75.51 0.79 3.5 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.898 0.879 . . . . 0.0 111.73 -174.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -79.08 169.77 17.68 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -149.32 160.48 28.45 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.652 -176.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' A' ' 137' ' ' LEU . 49.3 tp -69.85 -38.45 76.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 122.678 0.391 . . . . 0.0 110.368 -177.626 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.9 -30.82 64.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.246 0.546 . . . . 0.0 110.809 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -70.38 -31.9 69.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.45 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.424 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 49.5 tp -60.52 -51.96 67.22 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.137 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 5.4 mpp? -67.19 -33.61 75.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.732 0.301 . . . . 0.0 111.141 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.7 -48.39 47.68 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.976 -178.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 84.5 mt -97.97 -2.94 39.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -173.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -119.13 -64.82 0.29 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.316 -0.945 . . . . 0.0 112.586 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.473 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 52.6 tp -62.3 -51.86 66.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.47 0.176 . . . . 0.0 111.37 -176.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -50.7 -61.07 6.32 Favored Glycine 0 CA--C 1.523 0.581 0 CA-C-N 116.181 -0.463 . . . . 0.0 113.298 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' PRO . . . . . 0.569 ' O ' HG23 ' A' ' 148' ' ' VAL . 72.6 Cg_exo -53.49 -40.42 78.79 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.724 2.283 . . . . 0.0 112.73 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -63.47 -41.82 98.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.709 0.29 . . . . 0.0 110.616 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.494 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 89.7 mt -59.99 -39.28 85.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.091 0.472 . . . . 0.0 110.092 176.625 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.63 -18.66 64.34 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.736 -179.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 144' ' ' PRO . 86.4 t -71.61 -56.68 9.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -175.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -134.5 0.53 3.04 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -172.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.582 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 33.4 mm -68.2 -52.18 23.22 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.157 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.582 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 38.2 Cg_exo -61.42 -29.36 85.24 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.734 1.623 . . . . 0.0 111.516 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -69.84 -40.98 75.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.008 178.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.537 HD23 HD11 ' A' ' 159' ' ' ILE . 24.7 tp -68.11 -30.93 70.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.499 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 150' ' ' ILE . 74.3 mt -62.14 -44.86 99.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.073 0.463 . . . . 0.0 110.077 175.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 54.3 tp60 -69.16 -14.66 63.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.081 -178.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' LYS . . . . . 0.559 ' HE2' ' HA ' ' A' ' 156' ' ' LYS . 11.2 mmpt? -68.3 -20.94 64.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.95 0.405 . . . . 0.0 110.228 174.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 88.96 13.15 62.75 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.722 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 27.5 m -100.11 -16.31 7.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.844 0.354 . . . . 0.0 111.645 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.537 HD11 HD23 ' A' ' 153' ' ' LEU . 55.6 mt -104.86 107.45 22.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.12 0.486 . . . . 0.0 110.391 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -146.15 93.21 2.29 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.594 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -95.08 -15.55 23.33 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.409 -174.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.541 ' HG3' ' OE1' ' A' ' 163' ' ' GLU . 14.8 tptp -142.45 162.26 35.93 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.219 -175.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.541 ' OE1' ' HG3' ' A' ' 162' ' ' LYS . 0.1 OUTLIER -94.92 8.61 42.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.523 -177.87 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -56.32 -63.63 1.13 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.035 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 41.2 m 55.13 87.03 0.05 Allowed 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.715 0.635 . . . . 0.0 111.606 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' ASN . . . . . 0.605 ' HB2' ' HB2' ' A' ' 75' ' ' LEU . 8.5 t30 -85.93 -37.89 18.58 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.164 0.507 . . . . 0.0 109.759 179.222 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -71.28 132.31 44.73 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.929 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 88.6 mt -74.33 103.6 4.78 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 176.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -54.91 121.34 8.45 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.014 -175.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -82.69 142.48 31.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.514 177.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 -56.07 115.8 2.64 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.068 0.461 . . . . 0.0 110.449 -175.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -130.76 146.94 52.35 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.081 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 6.0 p-80 -123.39 139.65 53.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.195 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -147.38 140.06 24.83 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -177.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.494 -0.765 . . . . 0.0 108.977 177.807 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 121.021 0.438 . . . . 0.0 110.592 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.56 4.85 52.78 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.611 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.563 ' HB3' ' HB ' ' A' ' 6' ' ' THR . 55.1 m-20 64.38 47.24 3.13 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.945 177.139 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -56.91 -54.81 42.37 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.723 -178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.485 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -57.9 -43.91 86.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.625 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.563 ' HB ' ' HB3' ' A' ' 3' ' ' ASP . 17.4 m -57.43 -48.63 78.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.59 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 24.0 mmt180 -64.11 -38.98 93.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.79 0.328 . . . . 0.0 110.658 -178.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 8' ' ' ARG . 44.5 ttp180 -65.2 -40.02 93.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.286 177.171 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 5' ' ' ALA . 52.3 t -63.96 -44.14 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.04 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 6' ' ' THR . 46.7 t -68.38 -20.15 25.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 121.103 0.478 . . . . 0.0 110.613 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.1 m -81.54 -47.61 12.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.786 176.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -69.85 -27.88 65.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.896 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.608 HG23 ' HB2' ' A' ' 38' ' ' SER . 39.6 mt -106.56 88.67 3.54 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.827 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -65.69 179.32 1.77 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.981 2.454 . . . . 0.0 113.109 -174.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.592 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.8 m -88.85 162.98 2.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.102 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.812 HD21 ' HB3' ' A' ' 35' ' ' GLU . 9.1 mp -92.07 156.09 17.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.448 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -71.45 -33.06 69.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.151 0.5 . . . . 0.0 110.267 178.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.567 HG23 ' HB3' ' A' ' 31' ' ' ARG . 3.0 t -146.74 152.36 38.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.629 -176.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -132.1 36.32 3.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.084 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.63 149.48 48.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.439 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.38 176.78 54.58 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.327 -179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.8 -3.44 6.88 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.364 2.709 . . . . 0.0 112.587 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.546 ' HD2' HG22 ' A' ' 88' ' ' ILE . 0.3 OUTLIER -64.11 -29.5 70.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.7 176.944 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -109.33 110.55 21.74 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 57.9 mtp85 -56.61 -51.59 68.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.647 -174.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -65.6 -52.82 49.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.68 0.276 . . . . 0.0 111.197 -174.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.502 HD12 HG21 ' A' ' 18' ' ' THR . 4.4 mm? -63.67 -33.42 75.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.002 -177.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.467 ' CZ2' HG21 ' A' ' 86' ' ' ILE . 63.7 t-105 -63.19 -52.05 63.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.633 176.595 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.6 t -64.7 -34.34 69.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.975 0.417 . . . . 0.0 110.662 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -71.58 -44.48 64.42 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.053 -178.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.567 ' HB3' HG23 ' A' ' 18' ' ' THR . 6.8 ptm180 -68.37 -28.54 67.2 Favored 'General case' 0 CA--C 1.523 -0.095 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -43.72 76.08 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.046 174.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -67.51 -40.48 85.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.536 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -61.12 -45.05 96.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.233 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.812 ' HB3' HD21 ' A' ' 16' ' ' LEU . 22.0 pt-20 -77.41 -29.29 52.99 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.953 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.491 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.0 OUTLIER -57.35 -47.1 82.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.92 0.39 . . . . 0.0 110.404 171.747 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -63.98 -37.92 89.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.732 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.608 ' HB2' HG23 ' A' ' 13' ' ' ILE . 0.6 OUTLIER -72.18 -31.38 65.86 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.732 177.068 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 56.9 mt -62.28 -49.28 76.3 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 170.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.3 mt -58.32 -40.66 78.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.837 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.432 ' HA ' ' NE ' ' A' ' 41' ' ' ARG . 4.5 mmp_? -53.42 -52.54 59.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.75 0.31 . . . . 0.0 111.192 176.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -63.16 -47.2 83.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.697 -177.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.8 t -62.67 -41.38 92.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.546 ' OE2' ' HD3' ' A' ' 47' ' ' LYS . 6.7 tp10 -61.72 -51.34 68.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.354 0.597 . . . . 0.0 110.318 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -59.31 -39.45 83.1 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.89 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -66.9 -47.42 71.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.573 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.546 ' HD3' ' OE2' ' A' ' 44' ' ' GLU . 22.8 ptmt -66.59 -28.75 68.75 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.207 -0.197 . . . . 0.0 110.887 -178.053 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -71.98 -24.72 61.63 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.245 0.545 . . . . 0.0 110.302 176.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -88.17 7.06 33.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.266 176.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.7 t70 72.81 3.87 4.81 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.469 176.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 -117.81 86.11 2.46 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.27 136.07 51.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.088 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -88.79 -78.78 0.33 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.906 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -150.95 171.25 17.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.124 0.488 . . . . 0.0 111.453 -170.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 -132.48 124.05 27.81 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.043 172.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.0 mt -126.69 127.12 44.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.94 0.4 . . . . 0.0 111.378 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -133.22 163.32 29.55 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.354 173.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -129.54 166.72 19.11 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.737 0.303 . . . . 0.0 110.738 -173.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.494 ' HB3' ' OE1' ' A' ' 61' ' ' GLU . 4.3 m-20 -58.71 159.71 6.42 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 167.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -67.19 -17.94 65.04 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 -177.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.494 ' OE1' ' HB3' ' A' ' 59' ' ' ASN . 1.4 mp0 -85.78 -17.66 35.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.021 0.438 . . . . 0.0 110.519 174.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.03 11.55 83.89 Favored Glycine 0 C--O 1.227 -0.311 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.542 -177.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.4 p -77.37 -36.7 53.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.884 0.373 . . . . 0.0 111.808 -177.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.7 mtt180 -123.07 144.22 49.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.095 0.474 . . . . 0.0 110.857 175.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.97 ' HB2' ' HB2' ' A' ' 84' ' ' PHE . 22.8 m95 -118.89 150.33 40.05 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.196 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -154.12 150.61 28.34 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 174.27 -165.1 36.5 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.297 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -138.29 142.3 39.8 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.461 ' SG ' HD13 ' A' ' 82' ' ' ILE . 78.1 m -115.9 129.63 56.49 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.065 177.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.64 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 28.9 m-90 -100.5 125.85 46.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.949 0.404 . . . . 0.0 109.963 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 38.5 t80 -117.37 120.32 37.81 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.131 0.491 . . . . 0.0 110.367 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 50.8 mm -94.9 118.44 41.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.7 178.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 10.2 t60 -141.56 121.43 13.57 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.69 41.49 15.01 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.465 0.65 . . . . 0.0 110.156 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.8 mt 71.92 -4.89 1.83 Allowed 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.214 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.551 HD22 ' HE1' ' A' ' 161' ' ' HIS . 63.7 mt -91.95 144.6 25.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.666 0.27 . . . . 0.0 110.762 -177.031 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.406 ' HB2' ' HZ2' ' A' ' 77' ' ' LYS . 3.8 ttmp? -109.34 117.42 34.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.508 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -130.28 128.68 42.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.782 0.325 . . . . 0.0 110.14 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.64 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 9.6 pt-20 -102.29 145.24 29.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.158 -177.614 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -123.48 135.78 54.24 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.874 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -92.14 129.82 38.0 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.803 -178.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.523 HG22 HG22 ' A' ' 99' ' ' VAL . 42.5 pt -126.78 149.58 31.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.734 -174.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -131.15 163.44 27.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.981 174.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.97 ' HB2' ' HB2' ' A' ' 65' ' ' TRP . 44.9 m-85 -150.11 148.66 29.25 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.854 -179.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -129.85 148.13 51.69 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 169.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.467 HG21 ' CZ2' ' A' ' 28' ' ' TRP . 47.9 mm -109.68 91.7 10.94 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -172.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 15.0 Cg_endo -56.19 159.02 13.48 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.533 2.155 . . . . 0.0 111.715 174.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.546 HG22 ' HD2' ' A' ' 23' ' ' ARG . 23.3 mm -71.99 -14.58 17.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.373 0.606 . . . . 0.0 110.702 -175.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.2 p -89.69 1.98 55.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.634 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.6 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 65.6 t80 -80.62 146.87 61.73 Favored Pre-proline 0 C--N 1.328 -0.336 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 176.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.6 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 85.1 Cg_endo -95.18 16.41 39.24 Favored 'Cis proline' 0 C--N 1.351 0.671 0 C-N-CA 124.519 -1.034 . . . . 0.0 113.608 1.12 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -64.04 -37.06 86.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.591 0.71 . . . . 0.0 109.586 176.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.4 m -111.16 124.73 52.78 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.799 176.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -71.58 144.43 88.73 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.811 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -89.48 -164.44 0.16 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.907 2.405 . . . . 0.0 112.04 177.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -123.89 127.15 47.59 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.6 HG12 ' CZ ' ' A' ' 84' ' ' PHE . 47.6 mt -66.05 115.76 4.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -89.54 112.38 23.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.026 -176.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.523 HG22 HG22 ' A' ' 82' ' ' ILE . 34.0 t -125.28 85.34 58.45 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.804 176.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -73.58 -9.62 22.91 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.795 2.33 . . . . 0.0 112.59 -175.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -73.68 -43.13 60.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.398 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.409 ' O ' HG22 ' A' ' 106' ' ' THR . 90.3 mt -82.36 -30.19 30.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.836 -178.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.502 ' HB2' ' HA2' ' A' ' 113' ' ' GLY . 16.6 t70 -53.66 124.91 16.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.949 178.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 106.37 -27.25 17.55 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.214 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.796 ' HG2' HG11 ' A' ' 158' ' ' VAL . 10.5 mptt -101.25 -42.4 6.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.016 0.436 . . . . 0.0 110.424 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.572 ' HB ' HD21 ' A' ' 153' ' ' LEU . 5.7 t -93.6 155.59 17.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.386 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -126.65 11.95 7.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.073 -179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -86.66 -8.31 57.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.827 0.346 . . . . 0.0 110.638 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.498 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 2.5 ppp? -121.27 -171.86 2.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.265 -176.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -86.37 120.65 27.95 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.006 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -59.87 111.86 1.63 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.83 176.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 148.31 -13.31 1.24 Allowed Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.567 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLY . . . . . 0.502 ' HA2' ' HB2' ' A' ' 103' ' ' ASP . . . 109.61 2.9 30.74 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.856 -0.688 . . . . 0.0 113.014 176.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.16 136.91 43.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.901 0.381 . . . . 0.0 111.056 -178.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 43.4 pt -69.19 162.18 3.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.878 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.498 ' HB2' ' HA ' ' A' ' 109' ' ' MET . 53.1 t -113.63 105.32 13.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.847 0.356 . . . . 0.0 110.345 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.1 mt -93.74 -178.33 4.65 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.842 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.8 t -85.14 158.81 20.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.002 -176.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -75.32 -12.88 60.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.069 0.462 . . . . 0.0 110.741 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -80.79 -12.26 59.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.264 0.554 . . . . 0.0 110.201 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -70.75 -45.18 65.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.346 -172.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.45 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 14.7 mmmm -60.53 -52.23 74.26 Favored Pre-proline 0 C--O 1.236 0.392 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -175.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 26.5 Cg_endo -63.85 -31.87 67.31 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 121.769 1.646 . . . . 0.0 112.205 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 47.4 tp -66.1 -45.09 82.42 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.9 0.381 . . . . 0.0 110.171 177.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 41.8 t-105 -56.88 -49.3 75.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.482 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.14 -21.85 65.81 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.727 -176.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -84.64 -35.16 22.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.125 0.488 . . . . 0.0 110.3 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -73.85 -42.43 60.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.076 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.571 HG13 ' HA ' ' A' ' 130' ' ' PRO . 98.7 t -60.28 141.07 91.25 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.571 ' HA ' HG13 ' A' ' 129' ' ' VAL . 65.6 Cg_endo -84.29 -159.47 1.82 Allowed 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 124.909 -0.871 . . . . 0.0 114.061 6.49 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.592 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 73.7 mmtt 71.36 11.25 6.7 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.631 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -94.65 163.27 13.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.208 0.528 . . . . 0.0 111.742 -171.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -159.43 162.63 32.98 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.064 -0.814 . . . . 0.0 111.064 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.7 tp -60.39 -29.14 68.75 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -173.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.13 -39.12 66.19 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.187 0.518 . . . . 0.0 111.781 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.0 m80 -71.47 -32.48 68.34 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.95 -178.031 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 49.3 tp -63.28 -44.05 96.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 110.746 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 14.4 mmt -64.11 -52.69 57.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.512 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.08 -34.16 77.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.548 -175.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.1 mt -98.39 -17.9 18.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -174.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -111.72 -64.04 0.49 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.981 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 38.5 tp -63.16 -41.31 99.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 -171.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.95 -61.79 6.98 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.084 -179.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -58.74 -28.69 87.46 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.766 2.311 . . . . 0.0 112.908 177.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 64.7 t90 -72.05 -45.64 60.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.052 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 96.7 mt -60.16 -34.99 74.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.079 0.466 . . . . 0.0 111.16 -178.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.23 -2.81 20.29 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.989 -176.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 60.5 t -92.82 -55.28 6.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -109.82 -12.49 14.59 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -170.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.586 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 1.4 mp -55.58 -45.52 99.86 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.689 178.307 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 11.0 Cg_endo -55.77 -32.36 84.07 Favored 'Trans proline' 0 C--N 1.357 1.02 0 C-N-CA 122.026 1.817 . . . . 0.0 112.73 174.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.604 ' HA ' ' HG2' ' A' ' 155' ' ' GLN . 31.6 t70 -71.29 -36.48 71.68 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 120.589 0.233 . . . . 0.0 110.645 -179.139 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.572 HD21 ' HB ' ' A' ' 106' ' ' THR . 4.3 mm? -65.7 -31.63 72.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.9 0.381 . . . . 0.0 110.362 176.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 66.0 mt -72.51 -47.11 53.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.616 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.604 ' HG2' ' HA ' ' A' ' 152' ' ' ASP . 13.3 pt20 -71.16 -20.84 62.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.805 0.336 . . . . 0.0 110.723 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -72.68 -32.39 65.77 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.105 0.479 . . . . 0.0 109.762 175.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 99.58 10.08 48.29 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.176 177.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' VAL . . . . . 0.796 HG11 ' HG2' ' A' ' 105' ' ' LYS . 42.1 t -91.62 -14.06 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.356 0.598 . . . . 0.0 110.485 -178.198 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.401 HG12 ' HB3' ' A' ' 153' ' ' LEU . 37.4 mm -84.07 111.89 20.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.139 176.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -84.98 118.13 24.37 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.257 -178.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' HIS . . . . . 0.551 ' HE1' HD22 ' A' ' 76' ' ' LEU . 82.2 t60 -75.52 120.38 20.86 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.93 0.395 . . . . 0.0 111.315 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -102.25 -71.56 0.71 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.562 176.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -155.95 162.49 40.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.582 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.97 -79.01 0.5 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.977 0.418 . . . . 0.0 111.064 -178.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 64.5 m -100.79 139.67 36.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.696 -176.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -100.73 6.57 43.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.092 0.472 . . . . 0.0 109.963 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -143.53 170.41 15.88 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -177.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.471 ' H ' HD12 ' A' ' 168' ' ' LEU . 5.4 mp -70.94 152.64 43.42 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 178.295 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 169' ' ' GLU . . . . . 0.437 ' H ' ' CD ' ' A' ' 169' ' ' GLU . 0.7 OUTLIER -70.41 146.8 50.13 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.903 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -158.13 -178.39 7.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.713 0.292 . . . . 0.0 110.99 -173.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -74.03 142.75 45.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.408 -177.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 16.0 m170 -95.42 141.29 29.14 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -177.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -109.6 85.42 2.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.943 0.401 . . . . 0.0 110.901 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -175.62 165.29 3.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.165 177.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 18.1 p80 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.147 -0.93 . . . . 0.0 109.975 -179.789 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.481 1.104 0 CA-C-O 120.806 0.336 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.3 -156.0 0.62 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.135 -179.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -76.12 159.02 31.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.865 0.364 . . . . 0.0 110.094 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -66.82 -37.98 85.56 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.478 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -59.14 -34.29 71.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.339 176.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.426 ' O ' HG23 ' A' ' 10' ' ' VAL . 7.4 m -58.53 -50.38 73.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.979 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -72.92 -25.28 60.99 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.042 -0.263 . . . . 0.0 111.136 -177.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -69.98 -43.74 70.83 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 5' ' ' ALA . 73.8 t -58.37 -44.99 89.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.613 177.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 6' ' ' THR . 50.5 t -67.04 -24.21 31.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.183 0.516 . . . . 0.0 110.815 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t -80.01 -43.1 22.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.657 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.595 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 42.5 mt-10 -75.45 -27.27 58.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.844 0.354 . . . . 0.0 110.94 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 47.9 mt -104.92 89.19 2.73 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.235 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.595 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 33.1 Cg_exo -59.23 165.06 9.55 Favored 'Trans proline' 0 N--CA 1.475 0.385 0 C-N-CA 123.538 2.826 . . . . 0.0 113.811 -173.102 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.474 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 30.3 m -83.59 162.42 3.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.166 178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.569 HD21 ' HB2' ' A' ' 35' ' ' GLU . 7.0 mp -93.44 134.55 35.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.407 177.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -36.61 74.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.702 0.287 . . . . 0.0 111.293 -176.24 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.46 ' O ' ' HG3' ' A' ' 31' ' ' ARG . 6.2 p -107.61 139.67 41.8 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.725 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -132.56 77.11 1.73 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.409 0.623 . . . . 0.0 109.547 176.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -115.86 174.68 5.9 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.276 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.29 -179.69 23.15 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.331 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -69.29 2.39 3.31 Favored 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 123.015 2.477 . . . . 0.0 112.847 -178.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.403 ' HD2' HG23 ' A' ' 88' ' ' ILE . 26.3 mtp-105 -74.76 -44.68 48.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.617 0.722 . . . . 0.0 109.775 176.272 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.54 ' HB3' HD23 ' A' ' 27' ' ' LEU . 11.8 m-20 -94.62 101.54 13.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.653 -1.158 . . . . 0.0 109.925 -174.461 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.565 ' O ' HG23 ' A' ' 29' ' ' VAL . 60.2 mtm180 -57.63 -52.84 63.76 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -170.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.6 -41.6 92.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.049 0.452 . . . . 0.0 110.902 -175.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.54 HD23 ' HB3' ' A' ' 24' ' ' ASP . 3.3 mm? -67.63 -34.46 77.02 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.976 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.588 ' CH2' HG21 ' A' ' 86' ' ' ILE . 76.4 t-105 -67.66 -43.35 80.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.406 177.049 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 25' ' ' ARG . 84.1 t -61.09 -47.21 94.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 O-C-N 123.186 0.304 . . . . 0.0 111.501 -178.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.491 ' HA ' ' HG2' ' A' ' 33' ' ' LYS . 3.8 pt20 -72.03 -32.49 67.17 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.72 -178.584 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 18' ' ' THR . 18.8 ttp85 -66.22 -39.8 89.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.55 0.691 . . . . 0.0 109.301 174.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -63.69 -47.69 80.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.192 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.491 ' HG2' ' HA ' ' A' ' 30' ' ' GLN . 19.4 ptpt -64.38 -38.42 90.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.672 0.272 . . . . 0.0 111.204 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 12.7 mm-40 -69.54 -32.52 71.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.018 0.437 . . . . 0.0 110.366 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.569 ' HB2' HD21 ' A' ' 16' ' ' LEU . 37.6 tt0 -70.59 -35.98 73.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.435 176.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.42 ' O ' HG13 ' A' ' 40' ' ' ILE . 4.5 m-30 -59.71 -49.14 78.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.74 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -59.4 -41.46 89.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.943 0.401 . . . . 0.0 110.602 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.5 t -58.33 -44.8 88.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.346 177.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.453 ' O ' HG23 ' A' ' 43' ' ' VAL . 88.1 mt -64.16 -52.64 58.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.274 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 36' ' ' TYR . 86.3 mt -54.58 -41.45 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.473 -176.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -56.8 -45.98 81.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.938 0.399 . . . . 0.0 110.85 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -73.56 -35.71 65.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.672 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 39' ' ' LEU . 80.9 t -62.68 -45.95 97.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.993 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -34.27 75.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.193 -179.276 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -60.88 -44.43 97.09 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 174.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.527 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 62.0 m-20 -63.55 -36.97 85.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.837 177.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -60.97 -49.68 76.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.727 0.299 . . . . 0.0 110.712 177.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -60.97 -41.06 95.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.264 -178.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -86.09 5.9 31.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.757 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 56.03 33.2 21.38 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 122.127 0.965 . . . . 0.0 109.816 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -117.66 24.85 10.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.068 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.527 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 29.9 t70 -67.5 100.14 0.83 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.973 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 58.5 p-90 -114.33 2.93 14.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.282 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -162.29 169.6 20.37 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.554 -178.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -160.99 124.33 3.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.3 168.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.536 HD13 ' HA3' ' A' ' 67' ' ' GLY . 3.4 mm? -90.24 123.99 34.5 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.304 -178.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -110.22 147.17 34.3 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 176.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.7 p -128.94 157.1 42.58 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 120.981 0.419 . . . . 0.0 111.31 -171.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -79.31 168.56 19.36 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 172.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -57.1 -49.33 76.23 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -174.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -68.76 -19.54 64.33 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.849 0.357 . . . . 0.0 111.551 178.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.43 16.49 80.32 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.774 -174.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.5 p -88.46 -39.55 14.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.171 0.51 . . . . 0.0 111.078 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -101.57 128.46 47.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.075 174.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 54.9 m95 -116.04 145.15 43.23 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.011 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -152.36 86.06 1.28 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.688 0.756 . . . . 0.0 109.674 -177.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.536 ' HA3' HD13 ' A' ' 56' ' ' LEU . . . -104.8 146.55 16.14 Favored Glycine 0 N--CA 1.439 -1.104 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.074 -176.007 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 81' ' ' ASP . 1.5 ptpp? -100.18 130.93 46.37 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 54.8 m -131.48 127.99 38.47 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.089 -177.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.726 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 8.2 p90 -119.32 138.51 52.99 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.07 0.462 . . . . 0.0 110.948 -177.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -117.54 120.45 38.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.786 -178.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.446 ' N ' HD12 ' A' ' 72' ' ' ILE . 4.1 mp -91.39 121.03 41.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.996 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -147.97 124.6 11.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.011 175.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.1 t70 59.95 50.13 7.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.034 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.4 mt 74.46 -33.43 0.25 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 114.767 -1.106 . . . . 0.0 112.642 178.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 51.1 mt -76.0 139.61 41.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.038 0.447 . . . . 0.0 111.548 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -121.38 106.86 11.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.966 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.419 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 79.9 m-85 -96.26 121.53 38.15 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.255 178.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.726 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 0.0 OUTLIER -108.38 135.83 49.03 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.418 0.628 . . . . 0.0 111.208 -179.903 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -128.41 120.25 26.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.158 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.42 ' HA ' ' HA ' ' A' ' 68' ' ' LYS . 2.4 m-20 -78.24 119.12 21.17 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 171.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.4 pt -114.46 130.31 69.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.337 0.589 . . . . 0.0 110.416 -179.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -120.06 149.4 42.24 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.538 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.608 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 45.7 p90 -158.14 162.8 37.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.338 0.589 . . . . 0.0 110.934 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -106.64 154.78 20.43 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.176 -177.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.588 HG21 ' CH2' ' A' ' 28' ' ' TRP . 43.7 mm -104.19 90.46 3.13 Favored Pre-proline 0 C--N 1.324 -0.517 0 C-N-CA 122.734 0.413 . . . . 0.0 110.676 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -70.99 175.9 8.46 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.797 2.332 . . . . 0.0 112.182 -177.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.403 HG23 ' HD2' ' A' ' 23' ' ' ARG . 51.6 mm -68.47 -22.66 27.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.147 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.63 -13.74 61.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.219 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.497 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 63.5 t80 -87.47 143.75 34.61 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.497 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 23.0 Cg_endo -96.34 26.17 20.36 Favored 'Cis proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.825 -0.906 . . . . 0.0 112.883 0.586 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.1 m -69.57 -34.99 74.95 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.528 0.68 . . . . 0.0 110.129 178.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -131.32 145.64 51.95 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.16 175.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.12 144.3 99.02 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.437 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -80.61 161.08 22.03 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.79 2.327 . . . . 0.0 112.342 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -93.17 101.56 13.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.24 0.543 . . . . 0.0 110.537 -177.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.608 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 63.2 mt -72.38 136.72 25.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.783 -177.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -102.28 116.66 33.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.788 0.328 . . . . 0.0 110.864 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.442 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 5.8 p -124.04 87.74 53.05 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-O 121.889 0.852 . . . . 0.0 110.659 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 99' ' ' VAL . 18.8 Cg_endo -59.97 -36.35 90.3 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 123.287 2.658 . . . . 0.0 114.056 -172.488 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -82.65 17.87 1.7 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -171.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.464 ' O ' HG22 ' A' ' 106' ' ' THR . 42.3 mt -106.09 -15.69 14.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.274 0.559 . . . . 0.0 109.751 169.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.68 144.01 54.57 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.101 -176.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 77.74 -8.64 34.5 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.601 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.9 mtmm -117.22 -48.92 2.61 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.71 -0.288 . . . . 0.0 111.473 -176.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 102' ' ' LEU . 14.1 t -94.98 166.05 12.14 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.022 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -148.0 168.8 21.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.827 -177.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 108' ' ' LYS . 39.3 tttm 65.71 8.9 5.54 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.788 0.68 . . . . 0.0 110.89 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.495 ' SD ' ' HA ' ' A' ' 115' ' ' ILE . 9.2 tmm? -113.77 3.55 15.58 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.865 -174.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 66.2 t80 64.17 95.55 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.557 0.694 . . . . 0.0 110.109 -174.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.1 24.26 1.36 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.873 -172.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -83.89 41.51 2.97 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.901 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 68.77 26.87 74.28 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 121.174 -0.536 . . . . 0.0 112.767 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -141.44 -171.9 3.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.495 ' HA ' ' SD ' ' A' ' 109' ' ' MET . 46.3 pt -123.7 152.36 28.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.891 0.377 . . . . 0.0 111.115 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.8 t -112.09 111.06 21.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.473 173.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.35 165.32 20.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.604 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.402 ' HB ' ' CB ' ' A' ' 121' ' ' PHE . 2.7 m -55.1 133.67 48.96 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.856 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -56.91 -49.42 75.62 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -172.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -79.03 -15.43 58.25 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.991 -0.284 . . . . 0.0 111.703 -177.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.402 ' CB ' ' HB ' ' A' ' 118' ' ' THR . 85.9 t80 -71.37 -33.69 69.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.134 0.493 . . . . 0.0 110.145 179.047 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.614 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 54.0 mtpt -59.88 -51.22 82.28 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.427 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.614 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 25.9 Cg_exo -64.63 -35.62 46.33 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.761 1.641 . . . . 0.0 111.862 171.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.5 tp -59.6 -37.34 78.3 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.881 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.508 ' O ' HG23 ' A' ' 129' ' ' VAL . 48.0 t-105 -54.83 -50.44 68.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.417 176.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.21 -18.31 65.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.708 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -83.78 -20.4 33.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.005 0.431 . . . . 0.0 110.894 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -104.07 10.1 36.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.797 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 125' ' ' TRP . 94.9 t -93.79 139.69 22.79 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 174.044 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.414 ' HA ' HG13 ' A' ' 129' ' ' VAL . 69.5 Cg_endo -95.98 -154.7 0.35 Allowed 'Cis proline' 0 N--CA 1.456 -0.677 0 C-N-CA 124.165 -1.181 . . . . 0.0 113.49 1.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.474 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 54.8 mtmt 71.99 12.06 6.07 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.834 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -90.51 177.44 6.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.073 176.028 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -169.35 172.56 43.52 Favored Glycine 0 C--O 1.236 0.236 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.243 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 45.1 tp -60.41 -36.15 77.46 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.815 0.446 . . . . 0.0 111.66 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.52 -41.78 73.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.29 0.567 . . . . 0.0 111.124 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -71.84 -34.86 69.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.536 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 69.3 tp -67.3 -41.14 85.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.19 -178.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 24.7 mmt -69.05 -40.68 78.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.82 0.343 . . . . 0.0 111.017 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.07 -47.37 62.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.766 -177.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 86.9 mt -84.34 -29.1 26.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.005 0.431 . . . . 0.0 111.419 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.432 ' O ' ' HB2' ' A' ' 145' ' ' TRP . . . -96.41 -77.93 1.38 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.852 -0.689 . . . . 0.0 113.092 -176.212 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.8 tp -55.07 -47.92 74.22 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -170.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.6 -63.15 5.48 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.995 -0.621 . . . . 0.0 113.522 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.6 -27.31 53.4 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.42 2.08 . . . . 0.0 112.085 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' TRP . . . . . 0.466 ' HZ2' ' SD ' ' A' ' 109' ' ' MET . 56.6 t90 -62.2 -45.05 95.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.74 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 96.4 mt -67.37 -34.18 76.75 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.132 0.492 . . . . 0.0 110.549 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.97 -5.05 36.08 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.954 -176.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 84.7 t -70.26 -55.13 15.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.489 ' O ' HD23 ' A' ' 153' ' ' LEU . 0.0 OUTLIER -135.08 -12.82 2.16 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.709 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.552 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 32.1 mm -55.76 -50.66 85.83 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-N 118.059 0.39 . . . . 0.0 111.836 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.3 Cg_endo -53.58 -34.75 74.36 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 122.203 1.935 . . . . 0.0 112.533 177.088 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -78.22 -39.31 40.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.771 -177.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.489 HD23 ' O ' ' A' ' 149' ' ' GLU . 4.0 mm? -58.35 -37.78 75.87 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.705 177.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 71.7 mt -63.02 -47.19 93.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.685 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.45 ' HG3' ' O ' ' A' ' 151' ' ' PRO . 68.9 mt-30 -68.46 -27.92 66.58 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.774 -178.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -63.85 -27.43 69.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.432 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 87.13 6.24 79.06 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.846 176.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.9 p -78.45 -26.61 14.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.294 0.569 . . . . 0.0 110.386 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 54.7 mt -83.49 138.52 19.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.0 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -59.72 113.31 2.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.173 0.511 . . . . 0.0 110.34 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -125.0 131.03 53.48 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.028 -172.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -165.72 171.52 12.85 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.694 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 65.18 41.96 4.25 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.851 0.719 . . . . 0.0 112.913 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 36.9 mtmt -96.53 -53.45 3.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.513 0.673 . . . . 0.0 109.473 172.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 62.2 m -95.39 50.74 1.26 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.385 -173.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -72.28 -51.04 22.67 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 173.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -178.9 135.91 0.14 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.057 -1.429 . . . . 0.0 108.018 178.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.87 91.84 3.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.623 0.725 . . . . 0.0 110.234 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.47 160.02 29.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.966 -175.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -139.45 122.84 17.15 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.904 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -82.05 130.35 35.06 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.239 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 69.6 t60 -64.75 125.01 23.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.504 -175.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 43.0 t-80 -84.26 116.86 23.19 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.954 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 33.6 p80 -83.21 165.32 19.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.071 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 24.5 p80 . . . . . 0 C--O 1.247 0.927 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.006 177.388 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tmt? . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 120.669 0.271 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.09 -29.38 61.82 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -173.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.454 ' O ' ' HG3' ' A' ' 7' ' ' ARG . 33.6 t70 -88.84 7.46 34.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.005 0.431 . . . . 0.0 110.775 -174.372 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.455 ' OE2' ' HD2' ' A' ' 8' ' ' ARG . 7.4 tm-20 -53.9 -48.7 69.87 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.816 -178.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.446 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -59.55 -45.93 90.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.768 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.2 m -59.78 -55.44 34.21 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.095 0.474 . . . . 0.0 111.297 -175.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -68.99 -22.04 64.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.292 -177.354 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.455 ' HD2' ' OE2' ' A' ' 4' ' ' GLU . 21.6 ttt180 -71.16 -39.23 72.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.377 178.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 5' ' ' ALA . 99.4 t -63.73 -43.37 97.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.196 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.9 t -60.32 -39.13 79.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.398 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.3 m -61.86 -37.78 85.78 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -177.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -88.11 8.58 26.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.836 0.351 . . . . 0.0 111.475 -177.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 54.1 mt -121.87 86.93 46.35 Favored Pre-proline 0 C--O 1.237 0.404 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 172.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -48.85 146.29 11.88 Favored 'Trans proline' 0 C--O 1.238 0.484 0 C-N-CA 123.674 2.916 . . . . 0.0 114.047 -173.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.431 ' HB ' ' O ' ' A' ' 131' ' ' LYS . 33.0 m -81.04 162.79 3.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.611 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' A' ' 35' ' ' GLU . 10.0 mp -96.19 146.15 24.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.814 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -75.03 -39.54 60.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.41 -176.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.606 HG21 HD12 ' A' ' 27' ' ' LEU . 62.8 m -124.02 128.48 49.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.735 -173.196 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -91.71 118.36 30.59 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 173.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -161.2 156.75 24.67 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.578 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.29 -164.55 15.85 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.65 177.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.91 5.69 2.86 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.78 2.32 . . . . 0.0 113.232 -176.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 51.6 mtm180 -70.74 -62.67 1.3 Allowed 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -84.33 97.87 9.7 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.666 HH22 ' HG2' ' A' ' 61' ' ' GLU . 15.1 mtp180 -63.26 -33.2 74.99 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.213 -173.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -70.93 -50.73 31.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.558 0.218 . . . . 0.0 111.034 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.606 HD12 HG21 ' A' ' 18' ' ' THR . 4.3 mm? -66.91 -28.74 68.55 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.218 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.575 ' CH2' HG21 ' A' ' 86' ' ' ILE . 72.0 t-105 -60.53 -45.48 93.7 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.889 172.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 25' ' ' ARG . 70.2 t -61.07 -42.9 94.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.231 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.423 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 52.5 mt-30 -58.19 -53.92 52.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.388 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -67.34 -28.75 68.23 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.737 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.4 tp -62.59 -46.56 87.76 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 8.4 mtpm? -56.46 -58.81 6.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.056 176.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 18.3 mm-40 -62.13 -39.31 92.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.523 -174.272 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.775 ' HB2' HD21 ' A' ' 16' ' ' LEU . 39.6 tt0 -67.36 -38.29 84.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.389 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.548 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.1 m-85 -64.17 -30.45 71.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.527 176.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 90.2 mm-40 -68.3 -42.59 79.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.141 176.549 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.3 m -61.23 -39.72 91.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.984 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.511 HD12 ' HA ' ' A' ' 36' ' ' TYR . 76.6 mt -60.66 -49.35 77.85 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.884 177.019 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 36' ' ' TYR . 84.3 mt -51.98 -44.7 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 120.79 0.329 . . . . 0.0 110.603 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.516 ' O ' ' HB2' ' A' ' 45' ' ' ASN . 18.6 tpt180 -58.71 -51.18 71.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.222 177.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -66.62 -42.93 86.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.648 0.261 . . . . 0.0 111.066 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 39' ' ' LEU . 94.8 t -61.83 -47.85 91.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.548 179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -63.57 -42.86 98.29 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.528 0.68 . . . . 0.0 109.705 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' A' ' 41' ' ' ARG . 1.0 OUTLIER -53.77 -49.29 68.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.398 178.202 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -69.7 -43.25 72.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.439 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -66.49 -43.84 84.28 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -177.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.401 ' ND2' ' HA ' ' A' ' 45' ' ' ASN . 2.9 p30 -70.98 -23.85 62.29 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.987 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.52 8.41 7.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.732 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.533 ' HB3' ' CD2' ' A' ' 172' ' ' HIS . 27.4 t0 62.77 41.39 9.03 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.597 0.713 . . . . 0.0 110.515 177.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -141.52 87.44 2.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.508 174.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -101.46 101.81 12.48 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.55 ' HA ' ' CD1' ' A' ' 70' ' ' TRP . 52.6 p-90 -123.72 -1.37 8.46 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -173.623 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -154.21 158.16 39.88 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.96 -172.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.89 130.34 2.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.977 168.151 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.3 tp -124.53 131.47 53.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.427 -173.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -126.26 175.95 7.44 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.949 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.0 m -154.46 166.96 31.62 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.729 0.299 . . . . 0.0 110.826 -178.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.431 HD21 ' HB2' ' A' ' 64' ' ' ARG . 6.9 p30 -79.54 172.37 13.88 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 169.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -64.31 -26.04 68.31 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -174.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.666 ' HG2' HH22 ' A' ' 25' ' ' ARG . 37.4 mt-10 -80.25 -23.53 40.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.87 0.367 . . . . 0.0 110.834 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.69 17.91 73.48 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.962 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -86.11 -6.54 58.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.227 0.536 . . . . 0.0 110.969 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.431 ' HB2' HD21 ' A' ' 59' ' ' ASN . 50.5 mtm180 -142.0 120.77 12.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.469 176.019 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 24.9 m95 -106.11 130.06 54.08 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -146.45 137.76 24.45 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.274 0.559 . . . . 0.0 110.527 -175.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.93 -152.63 6.77 Favored Glycine 0 N--CA 1.442 -0.933 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.158 -178.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.691 ' HD3' ' CZ3' ' A' ' 70' ' ' TRP . 34.9 tttp -143.02 143.16 31.78 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -177.206 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.6 p -144.84 148.42 33.96 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.691 ' CZ3' ' HD3' ' A' ' 68' ' ' LYS . 0.7 OUTLIER -138.29 151.38 47.54 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.939 0.4 . . . . 0.0 110.902 179.119 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -117.71 138.09 52.25 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.383 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.2 mm -107.22 123.99 62.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.186 -176.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -159.5 123.17 3.73 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.393 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 57.26 55.55 5.79 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.809 0.693 . . . . 0.0 112.057 177.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.643 HD13 ' HA ' ' A' ' 168' ' ' LEU . 3.7 mm? 69.46 1.64 3.4 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.789 175.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 76.8 mt -107.18 138.14 43.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.085 0.469 . . . . 0.0 111.509 -174.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.1 ttmm -119.57 109.0 15.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.246 175.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -107.04 116.0 31.16 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.608 ' HB2' ' HE3' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -105.29 144.97 31.33 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.253 0.549 . . . . 0.0 111.519 -177.215 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -135.04 151.09 50.46 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.335 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.71 118.66 37.12 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.0 pt -113.31 147.04 17.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.63 0 CA-C-O 121.109 0.481 . . . . 0.0 111.187 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -150.69 153.06 34.9 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.242 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.601 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 39.1 p90 -158.27 155.46 28.92 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.406 176.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.474 ' O ' ' HB3' ' A' ' 95' ' ' PRO . 7.8 p-10 -95.06 156.86 16.14 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.015 -176.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.575 HG21 ' CH2' ' A' ' 28' ' ' TRP . 46.8 mm -109.76 90.43 9.07 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.988 175.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 11.7 Cg_endo -53.62 155.31 13.8 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.932 2.421 . . . . 0.0 112.751 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 39.6 mm -67.75 -21.12 26.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.515 0.674 . . . . 0.0 110.031 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.1 p -85.71 10.55 13.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.89 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.533 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 51.6 t80 -72.64 145.54 87.37 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.533 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 95.3 Cg_endo -94.75 11.99 46.46 Favored 'Cis proline' 0 C--N 1.35 0.608 0 C-N-CA 124.318 -1.117 . . . . 0.0 113.328 -0.134 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 23.7 m -62.75 -31.22 72.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.488 0.661 . . . . 0.0 110.304 178.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 32.0 m -114.01 134.18 55.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.016 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.407 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -75.49 145.05 78.65 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.454 -178.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.474 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 19.3 Cg_exo -66.7 151.79 81.92 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.156 2.57 . . . . 0.0 112.395 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -93.34 100.48 12.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.353 -178.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.601 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.4 mt -71.97 121.67 22.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.815 -178.574 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -118.71 125.47 49.74 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.106 0.479 . . . . 0.0 111.114 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 24.3 t -118.32 87.2 29.44 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.428 175.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.74 -25.21 74.9 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 123.288 2.659 . . . . 0.0 113.761 -172.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.03 -17.86 60.92 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.88 -43.59 95.61 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 38.6 t70 55.06 26.35 8.04 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.825 0.703 . . . . 0.0 112.127 170.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 68.56 16.1 69.28 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.961 -0.637 . . . . 0.0 113.045 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.503 ' NZ ' ' HB2' ' A' ' 105' ' ' LYS . 4.6 ttmp? -76.16 -18.03 59.29 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.001 0.429 . . . . 0.0 110.783 -178.059 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.426 ' OG1' HD11 ' A' ' 153' ' ' LEU . 2.9 t -86.21 -165.22 1.19 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.982 -177.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -66.99 -154.8 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.74 0.305 . . . . 0.0 111.738 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -54.99 112.16 0.99 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 121.582 0.706 . . . . 0.0 111.562 -177.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 24.9 ttt -126.13 170.02 12.22 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.376 -173.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -96.1 -170.86 2.19 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? -60.13 135.93 57.87 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.042 0.448 . . . . 0.0 111.638 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 62.43 -126.6 38.16 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.493 -0.776 . . . . 0.0 113.122 175.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -112.33 16.74 24.42 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.215 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.1 mtpp -76.73 120.81 22.42 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.6 pt -75.64 155.15 6.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.959 0.409 . . . . 0.0 110.811 -178.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 7.9 p -97.54 114.85 26.83 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.009 -178.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.8 mt -100.12 142.56 31.43 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 174.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.5 t -71.1 156.31 39.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.075 0.464 . . . . 0.0 111.261 -176.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -66.48 -42.93 86.76 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -172.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.445 ' C ' ' HD2' ' A' ' 123' ' ' PRO . 12.6 m-70 -62.25 -14.68 40.92 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -178.224 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -66.87 -33.92 76.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.952 0.406 . . . . 0.0 110.141 176.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.641 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 37.9 mtpt -62.7 -52.39 65.04 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.073 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.641 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 31.2 Cg_exo -59.74 -35.56 94.17 Favored 'Trans proline' 0 C--N 1.359 1.096 0 C-N-CA 121.697 1.598 . . . . 0.0 112.028 173.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 59.1 tp -63.55 -44.54 93.89 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.551 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.406 ' O ' HG23 ' A' ' 129' ' ' VAL . 47.3 t-105 -57.94 -57.46 12.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.894 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.72 -29.96 71.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.719 -176.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 13.3 ttm180 -64.53 -30.94 71.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.221 -178.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -102.14 16.48 25.98 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.336 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 125' ' ' TRP . 93.9 t -106.49 134.46 19.79 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 172.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -83.27 -162.77 2.93 Favored 'Cis proline' 0 C--N 1.347 0.45 0 C-N-CA 124.208 -1.164 . . . . 0.0 114.001 3.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.431 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 68.1 mttm 74.67 7.73 4.39 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.441 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -89.99 175.47 7.17 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 177.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -164.9 155.37 26.73 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.107 -177.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.42 HD21 ' CE2' ' A' ' 84' ' ' PHE . 43.3 tp -65.4 -30.98 71.85 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 122.78 0.432 . . . . 0.0 111.068 -175.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.45 ' O ' ' HG2' ' A' ' 138' ' ' MET . . . -56.81 -33.02 66.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.411 0.624 . . . . 0.0 110.936 176.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -71.46 -32.25 68.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.367 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.6 tp -67.44 -40.13 85.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.258 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' A' ' 135' ' ' ALA . 23.5 ptp -72.09 -36.54 69.52 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.866 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -75.07 -45.69 39.71 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 88.6 mt -93.97 -23.72 17.94 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -174.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -101.17 -65.83 0.79 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.851 -177.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.6 tp -59.26 -57.14 14.33 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -173.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.82 -61.98 6.32 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-N 116.156 -0.475 . . . . 0.0 113.819 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' PRO . . . . . 0.43 ' O ' HG23 ' A' ' 148' ' ' VAL . 53.2 Cg_exo -57.29 -35.07 98.85 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.717 2.278 . . . . 0.0 113.137 -179.011 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 45.9 t90 -64.31 -49.58 71.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.058 0.456 . . . . 0.0 109.917 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.39 -32.31 73.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.8 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.22 -12.57 60.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.993 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 144' ' ' PRO . 67.2 t -88.57 -56.14 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.672 0.272 . . . . 0.0 110.916 178.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' GLU . . . . . 0.529 ' O ' ' HG ' ' A' ' 153' ' ' LEU . 7.7 mm-40 -80.49 -52.79 7.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -173.24 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.614 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 48.9 mm -55.21 -54.46 50.34 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -170.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.614 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 31.6 Cg_exo -60.4 -33.76 93.89 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.99 1.793 . . . . 0.0 112.314 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -75.03 -43.49 53.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.331 -177.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 149' ' ' GLU . 23.3 mt -56.98 -34.58 68.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.247 178.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 150' ' ' ILE . 73.0 mt -62.59 -49.59 83.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.552 177.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -68.96 -34.43 75.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.489 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -73.83 -16.95 61.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.879 0.371 . . . . 0.0 111.054 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.14 24.62 47.45 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.215 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 51.4 t -83.17 -33.29 10.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.557 0.694 . . . . 0.0 109.294 178.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 72.8 mt -93.21 122.59 44.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.241 174.021 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -59.88 105.1 0.35 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 123.57 0.544 . . . . 0.0 111.085 -176.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -108.28 84.05 1.88 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.316 0.579 . . . . 0.0 111.024 -179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm -86.22 18.45 3.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.62 -178.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 61.88 60.95 1.47 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.527 176.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -75.91 -34.21 59.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.825 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 61.1 m 59.61 102.14 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.348 0.594 . . . . 0.0 112.304 175.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -102.62 -62.93 1.21 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.826 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -140.5 157.87 44.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.559 -178.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.643 ' HA ' HD13 ' A' ' 75' ' ' LEU . 7.1 mp -90.71 166.25 13.24 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.189 -174.191 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -72.63 121.18 19.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.558 178.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 20.1 p-80 -125.96 119.38 27.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.131 0.491 . . . . 0.0 110.584 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -89.35 144.12 26.31 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.79 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 172' ' ' HIS . . . . . 0.533 ' CD2' ' HB3' ' A' ' 50' ' ' ASP . 25.1 m80 -87.32 153.64 21.31 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.531 -176.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 10.3 p-80 -56.57 136.23 54.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.071 0.463 . . . . 0.0 110.618 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -102.15 164.9 11.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.948 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 6.3 p80 . . . . . 0 C--O 1.245 0.839 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.189 177.619 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptp . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.435 0.159 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.27 158.95 26.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.64 0.257 . . . . 0.0 110.691 178.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -86.02 -16.38 38.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.301 0.572 . . . . 0.0 110.786 -176.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.443 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 45.0 mt-10 -69.88 -44.86 68.91 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.84 -177.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -65.01 -41.31 95.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.059 0.457 . . . . 0.0 110.179 175.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.438 ' O ' HG23 ' A' ' 10' ' ' VAL . 22.6 m -62.76 -46.25 88.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.182 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 4' ' ' GLU . 11.6 ptp180 -66.77 -29.68 69.69 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.117 -176.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.5 ttm180 -62.6 -47.98 81.41 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.42 ' O ' HG13 ' A' ' 13' ' ' ILE . 58.5 t -57.34 -46.36 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.721 178.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 6' ' ' THR . 67.5 t -60.16 -36.9 70.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.183 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.4 m -76.08 -37.99 57.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.73 -176.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -82.37 8.58 11.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.201 0.524 . . . . 0.0 110.593 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.457 HG12 ' HB2' ' A' ' 42' ' ' TYR . 71.1 mt -114.2 89.56 17.66 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.387 171.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -40.04 143.04 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.268 3.312 . . . . 0.0 114.202 -175.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 m -83.23 162.85 3.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.732 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.827 HD21 ' HB3' ' A' ' 35' ' ' GLU . 6.8 mp -95.96 134.77 38.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.68 -177.602 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -86.32 -30.84 21.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.275 0.559 . . . . 0.0 109.868 174.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 27.5 m -96.83 125.89 41.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.29 -176.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -132.04 104.2 6.69 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.129 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -149.76 173.65 13.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.019 -178.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.94 166.16 17.75 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.112 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -66.86 -1.87 6.77 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 123.322 2.682 . . . . 0.0 113.327 -177.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -72.48 -18.23 61.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.583 0.23 . . . . 0.0 111.471 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -116.6 112.19 20.94 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 175.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 29' ' ' VAL . 48.8 mtt180 -58.57 -51.48 69.71 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -173.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -72.62 -35.89 67.94 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.379 -0.528 . . . . 0.0 111.667 -173.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.05 -34.32 75.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.991 0.424 . . . . 0.0 110.207 174.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.415 ' O ' HD23 ' A' ' 32' ' ' LEU . 44.9 t-105 -66.01 -48.08 72.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.878 176.246 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 25' ' ' ARG . 80.0 t -63.2 -35.95 74.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 178.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.528 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 40.7 tt0 -66.94 -39.05 87.21 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.925 178.028 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.508 HH12 ' HG3' ' A' ' 91' ' ' PRO . 25.2 ttt85 -68.61 -38.28 80.45 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.17 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.585 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 1.7 mm? -52.68 -51.97 57.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.476 176.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 18.7 ptpt -67.52 -25.53 65.88 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.621 0.248 . . . . 0.0 111.132 -179.123 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.528 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 28.3 mm-40 -64.47 -62.53 1.54 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.766 175.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.827 ' HB3' HD21 ' A' ' 16' ' ' LEU . 12.1 pt-20 -73.1 -26.02 61.09 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.332 -177.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.585 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -52.42 -45.81 66.1 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 169.092 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.3 mm-40 -61.01 -42.4 98.37 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.524 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.8 m -59.03 -45.04 91.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.445 176.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.428 ' O ' HG23 ' A' ' 43' ' ' VAL . 77.7 mt -60.47 -55.45 33.36 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.798 178.269 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 79.9 mt -60.26 -39.24 80.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.049 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' A' ' 41' ' ' ARG . 6.9 tpp85 -66.69 -41.22 88.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.647 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.457 ' HB2' HG12 ' A' ' 13' ' ' ILE . 86.5 t80 -66.27 -44.77 82.66 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.091 177.425 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 39' ' ' LEU . 92.3 t -59.76 -38.62 76.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.329 176.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -57.13 -59.87 4.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.263 0.554 . . . . 0.0 110.061 176.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -58.8 -35.49 72.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.356 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -68.45 -46.1 70.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.461 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -67.29 -28.52 68.08 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.148 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -67.64 -14.28 62.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.89 0.376 . . . . 0.0 110.89 177.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -101.34 14.88 30.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.216 174.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.6 t70 70.54 5.83 5.55 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.504 0.721 . . . . 0.0 111.487 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.507 ' OD1' ' HD1' ' A' ' 53' ' ' TRP . 23.7 t-20 -102.28 142.37 33.62 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.862 -0.524 . . . . 0.0 110.984 -176.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -158.09 111.43 2.44 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.507 ' HD1' ' OD1' ' A' ' 51' ' ' ASN . 56.1 p-90 -130.04 -3.03 4.55 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -172.044 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.4 ' HZ ' ' HD2' ' A' ' 42' ' ' TYR . 10.8 p90 -152.42 156.52 39.67 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.072 -0.651 . . . . 0.0 111.67 -174.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -161.92 126.79 3.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.565 171.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.543 HD13 ' HA3' ' A' ' 67' ' ' GLY . 3.8 mm? -100.54 130.38 46.6 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.242 -174.5 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -120.83 160.41 23.47 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 172.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 p -154.34 174.9 14.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 120.964 0.411 . . . . 0.0 111.163 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -83.04 170.73 14.54 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 172.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -65.65 -24.89 67.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.681 0.276 . . . . 0.0 111.544 -176.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -71.4 -24.72 62.11 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.805 0.336 . . . . 0.0 110.686 176.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.67 23.53 77.91 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.539 -0.625 . . . . 0.0 111.539 -176.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.2 p -95.2 -39.23 10.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.139 0.495 . . . . 0.0 111.397 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.1 mmt-85 -110.12 116.82 32.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.25 177.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 39.1 m95 -110.34 133.93 52.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.346 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -129.84 128.56 42.53 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.072 176.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.543 ' HA3' HD13 ' A' ' 56' ' ' LEU . . . -126.62 138.4 10.62 Favored Glycine 0 N--CA 1.441 -0.978 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.255 -175.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -101.25 131.98 47.0 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 177.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 38.0 m -120.14 136.45 54.61 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.733 -176.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 24.8 m-90 -126.35 122.74 36.27 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.331 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.432 ' HD2' ' HH ' ' A' ' 78' ' ' TYR . 3.8 t80 -128.24 119.11 24.52 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.24 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.498 HD13 ' HA ' ' A' ' 77' ' ' LYS . 31.7 mm -101.76 113.92 39.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.96 175.343 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 23.4 t60 -154.18 140.58 18.71 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -176.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.3 t70 62.73 27.26 16.03 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.34 0.591 . . . . 0.0 109.898 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 66.42 12.4 8.64 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.837 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.8 mt -105.93 135.73 46.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.122 0.487 . . . . 0.0 110.956 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.498 ' HA ' HD13 ' A' ' 72' ' ' ILE . 63.4 tttp -97.98 119.25 36.28 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.742 177.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.432 ' HH ' ' HD2' ' A' ' 71' ' ' TYR . 15.0 p90 -141.1 143.45 34.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.098 0.475 . . . . 0.0 110.53 174.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -135.69 148.7 49.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.994 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -138.63 144.16 39.6 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -108.57 128.38 54.77 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 121.106 0.479 . . . . 0.0 109.73 174.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 29.2 pt -117.7 151.04 19.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.583 -175.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -139.21 153.82 47.94 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 174.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.585 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 31.2 p90 -156.38 151.35 26.22 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.481 177.508 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.562 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 29.5 t70 -98.73 145.29 27.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.998 -177.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.0 mm -107.7 89.97 5.74 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.627 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.562 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 22.4 Cg_exo -64.49 164.04 24.89 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.554 2.169 . . . . 0.0 111.982 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 57.2 mt -69.2 -18.5 22.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.38 0.61 . . . . 0.0 110.322 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -79.95 9.02 5.85 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.392 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.558 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 78.2 t80 -77.94 139.46 61.65 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.558 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 44.2 Cg_endo -95.82 13.09 41.28 Favored 'Cis proline' 0 C--N 1.349 0.573 0 C-N-CA 124.314 -1.119 . . . . 0.0 113.856 1.532 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 38.1 m -58.5 -31.91 68.31 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.356 0.598 . . . . 0.0 110.496 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 35.6 m -123.63 124.4 42.7 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.785 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.498 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -69.0 143.93 95.04 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.518 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 17.2 Cg_exo -68.22 155.53 69.05 Favored 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 123.31 2.673 . . . . 0.0 112.687 179.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -102.3 116.87 33.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.926 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.585 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 4.2 mp -88.46 117.95 33.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.23 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -90.24 -44.0 10.02 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.816 -175.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.421 ' CG1' ' HG ' ' A' ' 102' ' ' LEU . 17.9 t 63.52 86.58 0.14 Allowed Pre-proline 0 CA--C 1.535 0.399 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.889 -176.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -61.15 -28.14 85.02 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.957 2.438 . . . . 0.0 112.969 -175.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.92 -37.08 83.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.855 0.36 . . . . 0.0 110.876 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.472 ' HA ' ' HB3' ' A' ' 105' ' ' LYS . 60.8 mt -82.33 -10.78 58.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.741 -173.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -61.84 112.45 2.3 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 81.02 -12.29 37.71 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.34 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.472 ' HB3' ' HA ' ' A' ' 102' ' ' LEU . 3.6 tppp? -86.33 -60.7 1.93 Allowed 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.508 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.638 HG23 HD11 ' A' ' 153' ' ' LEU . 66.4 m -75.1 119.94 19.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.707 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -77.7 72.28 4.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.465 0.65 . . . . 0.0 110.285 176.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.595 ' HG2' ' H ' ' A' ' 109' ' ' MET . 31.1 ttmt -166.15 -168.49 1.25 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.595 ' H ' ' HG2' ' A' ' 108' ' ' LYS . 65.6 mtt 69.51 100.1 0.06 Allowed 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.419 0.45 . . . . 0.0 110.322 -178.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -57.62 -47.99 80.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.632 -176.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' A' ' 111' ' ' ARG . 44.1 mtm105 -152.57 176.34 11.81 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 82.61 -54.58 4.93 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.391 175.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 83.34 70.47 1.35 Allowed Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 98' ' ' ALA . 16.5 ptpt -164.61 164.47 21.54 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -175.395 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.5 pt -73.46 135.24 28.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 120.966 0.412 . . . . 0.0 110.419 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.6 t -96.83 117.92 32.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.34 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.7 mt -98.21 164.19 12.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.337 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 3.5 t -72.14 152.09 42.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.078 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -68.41 -26.93 65.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.101 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -70.43 -18.51 63.01 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.64 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -67.12 -33.62 75.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.054 0.454 . . . . 0.0 110.035 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.411 ' HB2' ' CD ' ' A' ' 123' ' ' PRO . 41.8 mtpt -58.6 -58.94 15.47 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.842 -178.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.411 ' CD ' ' HB2' ' A' ' 122' ' ' LYS . 27.9 Cg_endo -63.94 -26.76 66.6 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 121.874 1.716 . . . . 0.0 112.451 178.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 64.5 tp -66.31 -47.24 74.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.968 0.414 . . . . 0.0 110.24 175.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -67.19 -51.42 53.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.624 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.05 -15.37 59.35 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.19 -176.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -78.55 -40.91 33.59 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.95 0.405 . . . . 0.0 110.786 177.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -105.16 70.53 0.9 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.105 0.479 . . . . 0.0 110.949 -173.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 68.2 t -130.9 128.69 22.43 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.267 176.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.454 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 78.0 Cg_endo -87.92 -139.83 0.15 OUTLIER 'Cis proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.728 -1.363 . . . . 0.0 112.91 1.034 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 50.6 mtmt 75.54 -7.62 1.75 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.496 0.718 . . . . 0.0 111.533 -178.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.7 m-30 -95.65 141.17 29.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.29 171.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -145.98 -174.06 17.79 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 42.7 tp -57.14 -38.31 73.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.78 0.29 . . . . 0.0 111.415 -176.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.56 -43.63 89.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.005 0.431 . . . . 0.0 111.173 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 20.2 m80 -70.99 -36.66 72.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.313 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.8 tp -60.31 -47.89 84.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.249 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' MET . . . . . 0.429 ' CE ' ' HA ' ' A' ' 138' ' ' MET . 18.2 mmt -63.96 -43.17 96.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.034 -178.035 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.14 75.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.951 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.8 mt -86.86 -33.31 19.84 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -176.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -98.6 -64.89 0.86 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.4 -0.905 . . . . 0.0 113.109 -176.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.7 tp -66.21 -44.26 84.34 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -173.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -51.8 -61.59 6.32 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.371 -0.442 . . . . 0.0 113.566 -178.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -62.42 -31.46 80.98 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.571 2.18 . . . . 0.0 112.37 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 52.3 t90 -62.66 -46.17 89.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.022 0.439 . . . . 0.0 110.097 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 86.8 mt -63.94 -33.11 74.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.784 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.6 -18.1 64.86 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.476 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 64.7 t -104.36 -54.5 6.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.493 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -77.21 -35.18 55.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -171.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.572 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 31.9 mm -59.62 -51.84 78.25 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 111.79 0.292 . . . . 0.0 111.79 -178.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.572 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 50.6 Cg_exo -55.12 -34.53 87.87 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.974 1.783 . . . . 0.0 112.129 175.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.87 -45.04 87.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.725 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.638 HD11 HG23 ' A' ' 106' ' ' THR . 4.2 mm? -67.94 -30.25 69.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.231 178.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 150' ' ' ILE . 65.5 mt -70.93 -42.1 77.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.139 0.495 . . . . 0.0 110.172 175.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -63.42 -42.61 98.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.904 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 43.0 tttp -67.98 -31.83 71.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.125 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 79.99 33.67 32.5 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.904 174.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.2 t -97.37 -14.76 7.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.021 0.439 . . . . 0.0 110.934 -177.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.7 mt -75.16 87.56 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.389 0.614 . . . . 0.0 109.658 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -86.09 119.31 26.25 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.96 -174.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 33.4 p80 -153.35 153.93 33.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.802 -1.09 . . . . 0.0 108.259 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -66.52 151.48 47.18 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 178.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 67.62 89.67 0.1 Allowed 'General case' 0 C--N 1.33 -0.247 0 O-C-N 123.91 0.756 . . . . 0.0 110.648 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -126.96 -35.47 2.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.93 176.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 8.9 p -137.15 133.54 35.37 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.85 -178.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -91.84 172.62 8.34 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 173.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.4 100.54 0.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 173.118 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.51 137.91 50.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.338 0.59 . . . . 0.0 111.978 -170.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -109.18 147.62 32.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.401 175.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -74.33 100.76 3.85 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 165.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -35.98 108.83 0.08 Allowed 'General case' 0 N--CA 1.47 0.56 0 O-C-N 124.469 1.106 . . . . 0.0 113.801 -160.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 20.7 p80 -136.69 -37.27 0.68 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.404 176.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -87.33 -40.11 14.75 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -98.75 165.83 11.6 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.528 -1.214 . . . . 0.0 108.297 170.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 26.3 p80 . . . . . 0 C--O 1.246 0.904 0 CA-C-O 118.169 -0.92 . . . . 0.0 109.476 177.634 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.43 ' O ' ' HB2' ' A' ' 2' ' ' ALA . 18.4 mmt . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 120.825 0.345 . . . . 0.0 111.103 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.43 ' HB2' ' O ' ' A' ' 1' ' ' MET . . . 147.03 -20.2 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.499 1.52 . . . . 0.0 107.71 -169.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -107.99 -2.45 19.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.34 -1.3 . . . . 0.0 111.148 -174.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.512 ' H ' ' CD ' ' A' ' 4' ' ' GLU . 0.8 OUTLIER -63.49 -35.18 79.59 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.507 -174.1 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.417 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -67.46 -44.25 79.08 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.279 0.562 . . . . 0.0 109.965 175.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.2 m -64.68 -45.7 85.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.488 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 0.3 OUTLIER -65.52 -30.0 70.71 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.282 -178.741 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -66.64 -41.65 87.93 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 5' ' ' ALA . 71.9 t -58.74 -46.1 90.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.319 177.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.1 t -66.42 -28.85 44.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.752 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.8 t -76.87 -36.27 56.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.946 -178.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -86.13 -4.31 59.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.429 . . . . 0.0 110.879 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 61.6 mt -119.06 86.36 31.69 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 173.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.15 149.51 27.67 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.665 2.91 . . . . 0.0 113.768 -172.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.8 m -76.23 175.1 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.037 178.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.422 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 6.3 mp -100.27 163.59 12.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.485 -179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.63 -39.7 5.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 172.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.624 ' HB ' ' HG3' ' A' ' 34' ' ' GLU . 23.0 m -88.92 135.86 33.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.148 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -150.02 121.44 7.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.51 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.669 ' H ' ' HD2' ' A' ' 31' ' ' ARG . . . -156.28 -178.99 7.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.277 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.5 168.56 19.76 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.058 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.74 -7.48 18.37 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 123.2 2.6 . . . . 0.0 113.2 -177.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.407 ' HE ' ' HB2' ' A' ' 23' ' ' ARG . 11.0 mtm180 -70.28 -51.26 31.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.638 0.732 . . . . 0.0 109.723 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.6 93.77 3.65 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.133 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.415 ' O ' HG23 ' A' ' 29' ' ' VAL . 97.9 mtt180 -55.75 -52.17 64.85 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -168.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.553 ' HG3' HD22 ' A' ' 27' ' ' LEU . 10.0 pt-20 -71.37 -33.93 69.99 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -174.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.553 HD22 ' HG3' ' A' ' 26' ' ' GLU . 4.2 mm? -75.48 -33.31 60.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.967 0.413 . . . . 0.0 110.341 178.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.51 ' CH2' HG21 ' A' ' 86' ' ' ILE . 64.1 t-105 -65.32 -50.67 64.76 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.126 177.293 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 25' ' ' ARG . 84.3 t -60.17 -32.68 51.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 121.123 0.487 . . . . 0.0 110.49 177.15 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.517 ' HB3' HG21 ' A' ' 18' ' ' THR . 24.2 tt0 -67.32 -49.21 65.06 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.249 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.669 ' HD2' ' H ' ' A' ' 20' ' ' ALA . 2.9 ptm180 -70.31 -27.58 64.5 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.374 -0.53 . . . . 0.0 110.066 178.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.437 ' HA ' HD22 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -62.84 -44.77 95.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.231 -0.441 . . . . 0.0 109.866 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.499 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 18.5 ptpt -73.38 -31.09 63.71 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.349 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.624 ' HG3' ' HB ' ' A' ' 18' ' ' THR . 6.1 mm-40 -57.35 -51.51 69.11 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.381 0.61 . . . . 0.0 109.69 172.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.552 ' OE1' ' HA3' ' A' ' 133' ' ' GLY . 5.3 tp10 -64.66 -39.64 94.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.075 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.426 ' O ' HG13 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -61.85 -42.18 98.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.798 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 15.4 mm100 -64.43 -39.2 93.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.899 0.38 . . . . 0.0 110.314 177.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.7 t -61.74 -43.14 99.43 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.884 175.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.418 ' O ' HG23 ' A' ' 43' ' ' VAL . 61.9 mt -59.86 -52.29 66.09 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.84 175.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 36' ' ' TYR . 77.7 mt -59.06 -33.28 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.87 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 41' ' ' ARG . 6.8 tpp180 -61.1 -44.6 97.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.275 177.226 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -68.6 -43.17 77.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.422 177.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.497 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 86.6 t -59.42 -42.02 86.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.655 178.012 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.44 -47.26 86.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.756 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -54.57 -41.51 69.94 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.371 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.479 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 89.3 m-20 -67.5 -41.28 84.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.141 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 74.0 mmtt -68.09 -27.57 66.59 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.244 -0.182 . . . . 0.0 110.808 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.18 -41.65 79.7 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.946 178.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -107.83 3.88 24.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.81 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.6 t70 59.14 31.46 21.29 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.5 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -97.17 16.04 20.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.469 -177.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.479 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 20.7 t0 -57.75 138.93 55.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.202 -178.081 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 59.7 p-90 -143.33 -0.25 1.11 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.167 -0.47 . . . . 0.0 112.104 -172.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -140.44 135.26 31.84 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 119.893 -0.723 . . . . 0.0 112.019 -170.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -130.33 125.04 33.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.056 174.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.1 126.91 49.43 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.873 0.368 . . . . 0.0 110.274 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -118.08 160.35 21.67 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.633 177.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.4 p -158.67 168.74 26.07 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.766 0.317 . . . . 0.0 110.834 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -75.72 172.88 11.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.025 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -71.93 -14.85 62.04 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -175.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.25 -18.22 29.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.853 0.358 . . . . 0.0 110.239 176.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.22 23.94 70.2 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 116.042 -0.527 . . . . 0.0 112.244 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.8 p -90.97 -4.35 56.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.025 0.441 . . . . 0.0 111.436 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -152.47 128.42 10.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -120.59 136.97 54.65 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.865 0.364 . . . . 0.0 110.69 -176.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.4 p90 -141.01 139.25 34.14 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.326 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -165.1 -177.73 37.81 Favored Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 119.427 -1.368 . . . . 0.0 113.128 -177.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.51 ' HD2' ' CZ2' ' A' ' 70' ' ' TRP . 22.7 ttmm -130.65 133.05 45.8 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 -177.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.426 ' O ' ' HA ' ' A' ' 79' ' ' GLU . 6.9 p -112.6 130.13 56.13 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.321 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.683 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 16.6 m-90 -103.64 131.11 51.09 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.57 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -118.22 119.51 34.89 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 175.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 15.7 mm -101.89 119.78 50.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.221 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -140.36 107.32 5.42 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.254 177.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.5 t70 55.07 64.75 1.69 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.548 173.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.679 HD12 ' HB3' ' A' ' 165' ' ' CYS . 3.6 mm? 67.12 2.08 2.62 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.658 175.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -107.4 137.45 45.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.762 0.315 . . . . 0.0 110.401 177.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.402 ' H ' ' HG3' ' A' ' 164' ' ' LYS . 21.4 ttpt -118.0 113.87 22.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.263 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -112.4 122.19 47.0 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.683 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 8.2 pt-20 -115.26 140.13 49.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.988 0.423 . . . . 0.0 110.904 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -127.8 126.18 41.22 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.153 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -87.23 126.06 34.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.862 177.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.475 HG22 HG22 ' A' ' 99' ' ' VAL . 41.1 pt -125.25 153.42 32.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.92 -175.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -147.82 155.12 41.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.798 0.333 . . . . 0.0 110.502 176.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.434 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 44.2 p90 -165.21 159.28 17.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.288 177.093 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -104.28 170.15 8.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.259 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.51 HG21 ' CH2' ' A' ' 28' ' ' TRP . 47.7 mm -114.91 90.89 24.27 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.936 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 11.0 Cg_endo -53.52 159.74 6.02 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.249 2.633 . . . . 0.0 112.89 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.1 mm -71.66 -18.5 19.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.509 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 m -88.52 9.31 24.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.05 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.473 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 47.7 t80 -81.37 146.05 56.9 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.31 -0.404 . . . . 0.0 109.914 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.473 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 10.9 Cg_endo -92.99 12.81 51.03 Favored 'Cis proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.48 -1.05 . . . . 0.0 112.696 -2.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.4 m -59.38 -28.83 67.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.389 0.614 . . . . 0.0 110.61 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 74.0 m -128.51 132.52 48.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.557 173.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.62 144.67 69.87 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.214 -178.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -85.82 173.98 6.81 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.826 2.351 . . . . 0.0 112.332 178.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.646 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 45.1 mt-10 -109.09 116.99 33.01 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.296 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.434 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.8 mt -76.24 132.43 33.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.457 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.739 ' HA ' ' HA3' ' A' ' 113' ' ' GLY . . . -107.15 128.88 54.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.926 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.475 HG22 HG22 ' A' ' 82' ' ' ILE . 10.6 t -122.83 86.06 50.12 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -63.13 -17.94 62.61 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.855 2.37 . . . . 0.0 112.829 -175.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -81.09 -27.54 35.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.96 0.41 . . . . 0.0 111.006 -178.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 72.9 mt -88.42 -17.82 29.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.978 0.418 . . . . 0.0 110.13 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -57.54 112.59 1.48 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.031 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 82.93 -11.84 52.05 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.092 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.416 ' NZ ' ' HB2' ' A' ' 105' ' ' LYS . 4.9 ttmp? -93.47 -44.51 8.21 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 120.802 0.334 . . . . 0.0 110.789 -177.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.737 ' HB ' ' HB2' ' A' ' 109' ' ' MET . 20.0 m -71.19 145.27 49.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.194 178.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -47.03 -50.89 18.6 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 123.559 0.537 . . . . 0.0 111.086 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -128.53 112.96 14.88 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.737 ' HB2' ' HB ' ' A' ' 106' ' ' THR . 15.1 tpt -143.29 141.97 31.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.231 -175.195 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -73.15 157.67 36.76 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -73.71 119.1 17.46 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.423 -172.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 82.1 -60.11 4.83 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.802 -178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLY . . . . . 0.739 ' HA3' ' HA ' ' A' ' 98' ' ' ALA . . . -178.23 -107.53 0.22 Allowed Glycine 0 N--CA 1.437 -1.257 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 176.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.646 ' HA ' ' HB3' ' A' ' 96' ' ' GLU . 7.4 mtpm? 49.03 39.55 15.1 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 122.782 0.433 . . . . 0.0 111.389 178.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.6 pt -72.15 135.51 27.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.295 0.569 . . . . 0.0 110.957 -177.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 2.8 p -108.58 153.2 23.71 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.004 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.428 ' HB2' ' CD1' ' A' ' 121' ' ' PHE . 64.7 mt -91.37 -171.39 2.93 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.008 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.7 t -61.1 145.68 50.07 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -58.41 -30.69 67.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.492 -173.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -54.77 -30.98 58.1 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.169 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.428 ' CD1' ' HB2' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -69.19 -33.04 72.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.469 -175.561 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.464 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 10.0 tmtt? -58.77 -57.08 29.49 Favored Pre-proline 0 CA--C 1.541 0.618 0 CA-C-O 119.714 -0.184 . . . . 0.0 111.393 -173.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.464 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 35.6 Cg_endo -66.95 -34.95 27.91 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 121.672 1.581 . . . . 0.0 111.982 175.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 43.9 tp -60.98 -37.91 84.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.927 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.482 ' CZ3' HD13 ' A' ' 137' ' ' LEU . 63.7 t-105 -61.21 -54.71 40.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.484 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.48 -33.27 74.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.303 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 31.6 mtt180 -63.7 -37.12 86.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.465 177.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -83.47 -61.24 1.89 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -175.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.47 HG13 ' HA ' ' A' ' 130' ' ' PRO . 94.6 t -47.49 132.93 10.35 Favored Pre-proline 0 N--CA 1.471 0.602 0 O-C-N 123.627 0.579 . . . . 0.0 111.407 -175.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.481 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 91.7 Cg_endo -77.61 -164.65 4.04 Favored 'Cis proline' 0 C--N 1.35 0.643 0 C-N-CA 124.259 -1.142 . . . . 0.0 114.298 7.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 30.8 mttm 73.66 -9.87 1.15 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.867 -178.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' PHE . . . . . 0.506 ' HZ ' HD12 ' A' ' 140' ' ' LEU . 6.0 t80 -106.68 151.36 25.21 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.552 ' HA3' ' OE1' ' A' ' 35' ' ' GLU . . . -166.96 -158.18 11.13 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 119.629 -1.272 . . . . 0.0 113.759 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 48.6 tp -63.22 -44.93 93.89 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.746 0.646 . . . . 0.0 112.746 -169.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.04 87.51 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.944 0.878 . . . . 0.0 110.002 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -72.7 -32.48 65.79 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.533 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.482 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 65.8 tp -66.66 -48.74 68.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.308 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 20.3 ptm -65.34 -34.83 79.24 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 121.071 -0.252 . . . . 0.0 111.073 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.18 -45.66 72.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.708 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.506 HD12 ' HZ ' ' A' ' 132' ' ' PHE . 76.2 mt -91.0 -16.06 28.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.825 -174.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -110.43 -67.34 0.56 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.259 -176.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.5 tp -60.97 -46.11 92.03 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 -174.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.5 -62.18 6.47 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.061 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.61 -33.84 96.71 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.705 2.27 . . . . 0.0 112.962 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 18.7 t90 -57.66 -52.67 64.48 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.241 0.543 . . . . 0.0 109.772 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.405 ' HA ' HG12 ' A' ' 150' ' ' ILE . 88.9 mt -67.47 -36.13 80.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.892 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.21 -24.15 67.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.362 -174.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 57.7 t -104.23 -54.72 6.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.78 -0.368 . . . . 0.0 111.905 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -73.99 -34.08 64.07 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -170.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.493 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.0 mm -66.52 -49.77 50.21 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -176.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.493 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 79.1 Cg_exo -50.21 -39.52 52.09 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 122.225 1.95 . . . . 0.0 112.95 177.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -70.6 -42.27 71.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.71 0.291 . . . . 0.0 110.491 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 23.2 tp -59.51 -35.71 74.67 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.071 0.462 . . . . 0.0 110.438 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 150' ' ' ILE . 69.2 mt -70.34 -53.69 21.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.692 177.298 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -64.47 -26.65 68.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.854 -175.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -70.77 -14.32 62.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.721 -178.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 90.92 16.66 54.01 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.764 176.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 59.9 t -80.95 -62.74 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.944 0.402 . . . . 0.0 110.284 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 13.2 pt -100.66 100.25 10.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.356 0.598 . . . . 0.0 111.261 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 62.6 mm-40 -128.97 106.86 9.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.64 177.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 37.6 m170 -98.03 176.01 5.91 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.17 175.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -89.61 177.23 6.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.918 0.39 . . . . 0.0 111.503 -176.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -50.5 109.08 0.27 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.198 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.875 ' HE2' ' HA ' ' A' ' 164' ' ' LYS . 10.2 mmpt? -88.2 -28.48 21.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.046 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 165' ' ' CYS . . . . . 0.679 ' HB3' HD12 ' A' ' 75' ' ' LEU . 38.6 t -136.22 151.06 49.3 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.223 -178.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -72.91 159.26 33.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.643 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -80.56 49.44 1.17 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.531 0.681 . . . . 0.0 110.104 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 96.0 mt -132.24 162.29 31.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.792 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.81 172.43 13.02 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 121.168 -0.213 . . . . 0.0 110.684 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -155.02 97.24 1.92 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.948 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 38.7 t60 -80.75 105.1 11.72 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.833 0.349 . . . . 0.0 110.357 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 7.3 p80 -93.38 126.7 38.65 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 175.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -65.95 120.79 13.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.335 -175.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 61.9 t-80 -104.96 128.89 53.42 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 174.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 56.9 p-80 . . . . . 0 C--O 1.245 0.827 0 CA-C-O 118.09 -0.957 . . . . 0.0 110.343 178.451 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.099 0 CA-C-O 121.053 0.454 . . . . 0.0 110.661 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.98 118.46 31.86 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.516 174.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.497 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 5.5 m-20 -65.01 141.43 58.77 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.544 -177.358 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -61.25 -29.53 69.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.066 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -58.64 -51.21 70.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.818 174.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.5 m -57.98 -44.17 86.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.424 177.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 51.3 mmm-85 -59.4 -48.17 82.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.952 -178.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.3 -46.16 77.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.065 -177.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 5' ' ' ALA . 79.5 t -59.45 -48.07 88.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.304 -178.395 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 92.5 t -66.74 -26.99 38.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.966 0.412 . . . . 0.0 110.803 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -77.26 -54.22 6.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.424 -177.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -80.56 0.49 33.68 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.976 0.417 . . . . 0.0 111.708 -173.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.642 HG12 ' HB2' ' A' ' 42' ' ' TYR . 60.9 mt -108.97 87.96 5.1 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 169.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.533 ' HG2' ' HG3' ' A' ' 41' ' ' ARG . 80.7 Cg_exo -48.48 140.46 21.31 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 123.978 3.119 . . . . 0.0 114.006 -170.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.513 ' HB ' ' HG2' ' A' ' 131' ' ' LYS . 35.6 m -73.43 163.4 4.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.942 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mp -106.94 154.8 20.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.092 -175.058 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.412 ' NZ ' ' HB2' ' A' ' 17' ' ' LYS . 9.0 mtmp? -99.91 -47.27 5.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.905 177.132 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.561 HG23 HD12 ' A' ' 27' ' ' LEU . 72.7 m -82.97 116.59 22.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.424 -177.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.479 ' OD1' ' HG3' ' A' ' 91' ' ' PRO . 38.4 t-20 -148.16 99.06 3.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.182 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.08 -58.08 0.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.508 -174.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 151.68 170.16 18.11 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.961 176.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.73 -13.36 17.96 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 123.042 2.494 . . . . 0.0 112.294 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.44 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 1.7 mmp_? -65.76 -33.85 76.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.758 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -93.43 107.34 19.2 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 mmp_? -58.22 -43.41 87.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.876 -176.085 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.43 -45.2 66.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.846 0.355 . . . . 0.0 110.681 -174.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.561 HD12 HG23 ' A' ' 18' ' ' THR . 4.5 mm? -73.18 -23.56 60.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.774 178.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 51.7 t-105 -70.66 -45.66 64.7 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 25' ' ' ARG . 99.5 t -60.78 -38.66 79.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.094 0.473 . . . . 0.0 110.029 175.244 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.583 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 0.7 OUTLIER -61.33 -37.27 82.67 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.459 174.813 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.573 HH22 ' HA2' ' A' ' 133' ' ' GLY . 2.4 mtp180 -64.5 -37.4 87.41 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.119 177.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 32' ' ' LEU . 4.1 mm? -56.7 -42.69 79.57 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 175.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -60.12 -47.84 84.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.468 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 11.0 mm-40 -59.57 -49.77 76.46 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.836 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -62.07 -44.73 96.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.802 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.42 ' O ' HG13 ' A' ' 40' ' ' ILE . 8.4 m-30 -57.67 -46.66 83.97 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.452 0.168 . . . . 0.0 111.308 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -58.56 -46.78 86.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 0.0 110.684 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.8 t -66.84 -44.42 81.08 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.468 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.427 ' O ' HG23 ' A' ' 43' ' ' VAL . 58.5 mt -60.52 -53.88 52.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.216 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 36' ' ' TYR . 79.9 mt -57.71 -39.8 72.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.48 0.181 . . . . 0.0 110.702 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.533 ' HG3' ' HG2' ' A' ' 14' ' ' PRO . 5.9 mmp_? -59.63 -56.88 16.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.911 176.262 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.642 ' HB2' HG12 ' A' ' 13' ' ' ILE . 36.4 t80 -57.44 -50.07 74.2 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.355 -179.539 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.513 HG12 ' HE2' ' A' ' 47' ' ' LYS . 91.1 t -63.56 -37.52 79.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.162 -176.401 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 40' ' ' ILE . 2.7 tp10 -63.22 -49.82 72.66 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.342 0.591 . . . . 0.0 109.99 179.193 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -59.29 -36.59 75.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.568 177.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.449 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 65.6 t30 -73.2 -40.06 65.05 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.411 -177.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.513 ' HE2' HG12 ' A' ' 43' ' ' VAL . 66.5 mttm -63.04 -46.38 87.83 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.802 -178.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -71.8 -14.71 62.06 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.853 -175.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -89.81 -2.82 58.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.825 0.345 . . . . 0.0 110.452 175.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.2 t0 60.78 40.25 16.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.277 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -122.99 17.83 10.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.923 0.868 . . . . 0.0 109.505 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.449 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 22.4 t70 -62.3 101.47 0.23 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.827 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.442 ' HB2' ' O ' ' A' ' 70' ' ' TRP . 15.9 p-90 -111.13 -40.98 4.3 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -167.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.586 ' H ' ' HD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -124.1 162.34 23.75 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 121.776 -0.577 . . . . 0.0 111.762 -174.235 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -156.28 129.03 7.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.848 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -112.61 144.14 42.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.252 0.549 . . . . 0.0 111.759 -173.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -109.25 162.99 13.77 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 173.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.1 m -153.19 155.4 36.59 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.808 0.337 . . . . 0.0 110.904 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -81.49 168.73 17.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 169.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -73.87 -6.5 47.56 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.805 -174.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -84.8 -25.58 28.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.98 0.419 . . . . 0.0 110.258 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.04 18.23 74.43 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.2 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.0 p -90.38 -4.35 57.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -176.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 64' ' ' ARG . 12.8 ttp180 -151.99 128.37 10.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.788 0.328 . . . . 0.0 110.17 172.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -111.54 126.56 55.11 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.36 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -137.25 138.04 39.68 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.212 -175.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -172.66 -155.94 12.0 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.676 -0.774 . . . . 0.0 112.051 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -138.66 153.61 48.58 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.771 0.319 . . . . 0.0 110.406 -178.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.8 p -128.19 123.97 35.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.841 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.6 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 17.0 m-90 -102.11 121.56 42.43 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 175.619 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.427 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 11.1 t80 -118.99 124.5 47.14 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.175 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 41.6 mm -97.9 114.8 36.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -177.473 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -146.57 118.42 8.15 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.403 177.448 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.6 t0 62.1 41.95 10.32 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.333 0.587 . . . . 0.0 110.828 175.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mm? 70.44 5.04 5.19 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.693 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.635 HD21 ' HB2' ' A' ' 164' ' ' LYS . 83.2 mt -88.48 106.12 18.06 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.998 0.427 . . . . 0.0 110.199 176.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -94.28 93.61 7.84 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.427 ' CE1' ' HB3' ' A' ' 71' ' ' TYR . 30.1 p90 -118.22 138.85 52.05 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.067 0.46 . . . . 0.0 111.087 -177.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.6 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 0.7 OUTLIER -115.21 141.87 47.43 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.74 179.734 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -123.85 136.95 54.69 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.174 174.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -85.48 110.91 19.52 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.403 ' HA ' HG22 ' A' ' 99' ' ' VAL . 32.0 pt -115.16 155.62 16.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.016 -172.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -166.08 159.64 15.61 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.631 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 52.3 p90 -159.39 147.73 17.71 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.55 178.242 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -98.98 159.45 14.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.307 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.7 mm -106.6 90.32 4.91 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.328 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.18 148.5 18.09 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 123.102 2.535 . . . . 0.0 112.591 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 38.8 mm -71.66 -14.31 17.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.559 0.695 . . . . 0.0 110.091 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 2.9 p -84.21 7.65 18.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.423 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.698 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 63.5 t80 -69.63 144.65 94.2 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.698 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 37.8 Cg_endo -92.7 3.01 60.17 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 124.186 -1.173 . . . . 0.0 114.133 1.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.9 m -58.02 -41.71 83.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.459 0.647 . . . . 0.0 110.09 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.5 m -103.93 120.92 42.04 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.206 172.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.61 145.07 95.61 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.479 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.441 ' HD2' HD22 ' A' ' 137' ' ' LEU . 25.7 Cg_exo -62.63 115.38 2.87 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.64 2.227 . . . . 0.0 111.221 175.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.575 ' CB ' ' HD2' ' A' ' 114' ' ' LYS . 30.6 mt-10 -74.44 117.33 16.13 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.83 -175.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.631 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.5 mt -66.6 127.76 28.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 175.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.98 -78.0 0.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.142 -170.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.403 HG22 ' HA ' ' A' ' 82' ' ' ILE . 8.1 t 51.69 75.79 0.61 Allowed Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.598 -175.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.88 -21.16 56.14 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 123.096 2.531 . . . . 0.0 112.798 -175.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 10.6 tp10 -63.61 -28.49 69.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.368 -178.688 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 97.8 mt -77.62 -22.53 50.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.288 -177.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -68.67 -16.38 63.81 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.557 0.694 . . . . 0.0 110.726 -178.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -108.5 10.37 35.74 Favored Glycine 0 C--N 1.316 -0.535 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.891 176.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 48.5 mmtm -115.49 -68.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.679 0.276 . . . . 0.0 111.497 -177.421 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.9 t -77.72 -27.61 50.65 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.486 -173.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 71.7 -35.23 0.32 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.52 0.728 . . . . 0.0 111.751 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -81.67 83.29 7.13 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 172.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 9.3 tpt -149.38 157.1 43.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.528 -1.215 . . . . 0.0 109.338 -167.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.549 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 41.7 m-85 -70.04 122.41 19.32 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 172.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 59.6 mtt180 -74.9 6.4 4.1 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.369 -167.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -103.43 7.96 51.6 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 172.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 89.54 51.31 2.93 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.117 -0.563 . . . . 0.0 112.018 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.575 ' HD2' ' CB ' ' A' ' 96' ' ' GLU . 38.6 mmtt -138.89 143.49 38.75 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -178.208 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.407 ' CD1' ' HB ' ' A' ' 97' ' ' ILE . 39.4 pt -76.34 152.9 5.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.825 179.204 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.401 ' HA ' ' HE2' ' A' ' 110' ' ' TYR . 39.0 t -88.71 106.54 18.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.461 -179.188 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.9 mt -92.68 -175.49 3.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.7 t -84.36 155.52 22.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.716 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -73.53 -24.58 60.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.701 -178.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -82.64 -2.73 54.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.088 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -69.83 -40.94 75.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.023 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.432 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 31.6 mmtp -63.77 -53.7 48.0 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.792 -177.414 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.432 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 16.1 Cg_endo -59.46 -32.08 95.79 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 121.738 1.626 . . . . 0.0 112.419 176.519 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.6 tp -69.43 -47.97 62.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.993 0.425 . . . . 0.0 110.312 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -61.12 -51.88 67.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.878 -177.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.24 -28.97 70.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.459 -177.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -68.88 -38.73 79.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.089 0.471 . . . . 0.0 110.241 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -66.78 -54.97 17.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.71 -176.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 59.3 t -42.22 125.29 2.76 Favored Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 124.188 0.93 . . . . 0.0 111.983 -173.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.453 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 85.4 Cg_endo -81.92 -132.45 0.09 OUTLIER 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.079 -1.217 . . . . 0.0 113.027 4.143 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.513 ' HG2' ' HB ' ' A' ' 15' ' ' VAL . 7.1 ttmm 70.34 -45.0 0.58 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 176.048 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -74.12 155.82 38.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.949 0.405 . . . . 0.0 110.837 -177.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.573 ' HA2' HH22 ' A' ' 31' ' ' ARG . . . -144.97 174.17 25.15 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.435 -175.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.445 HD11 ' CE2' ' A' ' 84' ' ' PHE . 47.8 tp -69.59 -37.17 76.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.781 0.324 . . . . 0.0 110.913 -175.47 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.09 -37.88 64.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.429 0.633 . . . . 0.0 110.695 174.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -71.23 -32.73 69.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.419 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.441 HD22 ' HD2' ' A' ' 95' ' ' PRO . 61.7 tp -65.6 -48.91 70.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.197 -178.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 22.9 ptp -67.25 -34.78 78.17 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.992 -177.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -75.47 -53.47 8.61 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.91 -17.31 44.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.821 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -95.49 -71.59 1.11 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.434 -0.889 . . . . 0.0 112.897 -177.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.488 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 44.5 tp -67.6 -36.51 81.0 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -172.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.88 -62.22 6.31 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.093 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -65.53 -26.63 54.38 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.601 2.201 . . . . 0.0 112.6 177.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -65.47 -39.37 91.89 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.921 0.391 . . . . 0.0 110.651 -178.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 96.3 mt -59.03 -32.88 70.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.828 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.78 1.68 14.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.785 -177.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 61.4 t -101.18 -55.86 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.854 0.359 . . . . 0.0 111.187 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -84.57 -46.63 11.37 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -174.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.478 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 48.0 mm -58.69 -54.46 56.01 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -169.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 12.2 Cg_endo -54.93 -38.98 92.66 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 122.299 1.999 . . . . 0.0 113.202 -175.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.5 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 38.6 t70 -81.68 -34.29 30.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.725 0.298 . . . . 0.0 110.275 -178.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.429 ' HG ' ' HB ' ' A' ' 158' ' ' VAL . 20.2 tp -59.95 -39.15 84.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.032 0.444 . . . . 0.0 110.481 178.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 150' ' ' ILE . 60.5 mt -64.37 -44.02 97.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.223 0.535 . . . . 0.0 110.06 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -68.32 -28.82 67.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.127 -177.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 30.7 mtpp -71.86 -9.51 58.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.729 0.299 . . . . 0.0 110.959 176.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.45 26.2 40.28 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.379 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' VAL . . . . . 0.429 ' HB ' ' HG ' ' A' ' 153' ' ' LEU . 40.8 t -94.69 -28.91 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 0.0 110.23 179.016 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.42 HD11 HD23 ' A' ' 153' ' ' LEU . 58.8 mt -107.48 141.93 21.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.707 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -64.77 161.58 17.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.015 -177.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 40.7 m80 -83.87 -14.38 51.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.652 -174.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.506 ' HB2' HD22 ' A' ' 76' ' ' LEU . 73.6 mmtt 48.46 31.49 2.85 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 171.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 59.82 54.01 4.54 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.784 0.802 . . . . 0.0 111.162 -179.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.635 ' HB2' HD21 ' A' ' 76' ' ' LEU . 28.2 tttp -65.28 -39.11 92.15 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.42 173.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 2.2 p -68.47 152.95 44.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.344 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -54.85 126.87 26.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.592 174.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -69.83 90.27 0.6 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.393 0.616 . . . . 0.0 111.67 -173.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 77.5 mt -121.72 93.14 3.91 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 170.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 169' ' ' GLU . . . . . 0.402 ' H ' ' CD ' ' A' ' 169' ' ' GLU . 0.0 OUTLIER -93.75 -168.27 1.85 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.968 -171.704 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -60.8 138.05 58.15 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.553 176.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 63.0 m170 -65.53 -26.29 67.83 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.682 -172.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -84.07 87.06 7.13 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -61.55 -68.2 0.34 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.495 -171.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -162.89 130.4 3.67 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.288 -177.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 . . . . . 0 C--O 1.247 0.946 0 CA-C-O 118.657 -0.687 . . . . 0.0 109.693 173.721 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.6 ttp . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 120.948 0.404 . . . . 0.0 110.296 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.17 110.04 22.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.538 176.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -104.04 126.96 51.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.242 0.544 . . . . 0.0 111.681 -175.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -68.8 -32.27 71.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.844 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -70.8 -45.87 63.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.787 0.327 . . . . 0.0 110.495 -178.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.451 ' O ' HG23 ' A' ' 10' ' ' VAL . 89.7 m -55.82 -52.94 62.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.261 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -61.74 -32.53 72.77 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.864 0.364 . . . . 0.0 110.873 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -63.89 -41.23 97.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.649 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.2 t -78.61 -42.48 25.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.128 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 6' ' ' THR . 82.5 t -59.62 -36.96 68.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.592 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.1 m -64.42 -25.15 67.89 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.029 0.442 . . . . 0.0 111.022 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.564 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 37.7 mt-10 -91.99 -13.99 30.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.429 -177.632 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 52.4 mt -107.69 89.91 5.68 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.616 0.246 . . . . 0.0 110.752 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.564 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 38.9 Cg_exo -55.73 158.34 13.8 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.545 2.83 . . . . 0.0 113.373 -174.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.555 ' HB ' ' O ' ' A' ' 131' ' ' LYS . 28.4 m -100.24 170.98 1.42 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.181 -178.128 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.562 ' HG ' ' HB3' ' A' ' 34' ' ' GLU . 9.4 mp -91.58 -177.71 4.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.538 -178.194 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -137.04 6.75 2.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.705 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.566 HG21 HD12 ' A' ' 27' ' ' LEU . 27.0 m -154.21 96.33 1.93 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.869 0.366 . . . . 0.0 110.834 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -111.24 110.08 20.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.942 0.401 . . . . 0.0 110.901 -177.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.467 ' O ' ' HD3' ' A' ' 91' ' ' PRO . . . -143.91 -178.37 5.89 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.345 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.15 165.5 54.05 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.988 -175.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 88' ' ' ILE . 16.2 Cg_exo -69.3 -15.94 39.14 Favored 'Trans proline' 0 CA--C 1.529 0.259 0 C-N-CA 123.368 2.712 . . . . 0.0 112.526 178.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 23' ' ' ARG . 36.0 mtp-105 -83.32 -14.01 53.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.185 0.517 . . . . 0.0 110.072 178.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -80.48 64.35 5.25 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 170.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.402 ' O ' HG23 ' A' ' 29' ' ' VAL . 12.4 mtm-85 -54.23 -43.35 70.79 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.876 -167.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.413 ' HG3' HD22 ' A' ' 27' ' ' LEU . 7.4 pt-20 -60.13 -45.27 93.59 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.651 0.263 . . . . 0.0 111.614 -178.632 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.566 HD12 HG21 ' A' ' 18' ' ' THR . 4.1 mm? -81.94 -19.92 39.73 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.949 0.404 . . . . 0.0 110.978 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.449 ' HE3' HH21 ' A' ' 31' ' ' ARG . 62.3 t-105 -65.76 -39.81 91.43 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.772 177.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 25' ' ' ARG . 88.0 t -61.3 -42.37 93.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.091 176.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.515 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 34.4 tt0 -67.09 -42.56 84.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.367 0.603 . . . . 0.0 110.187 176.053 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.456 ' HD3' ' O ' ' A' ' 18' ' ' THR . 15.9 ttp-105 -63.56 -32.69 74.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.07 -179.392 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -59.7 -47.33 86.07 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.344 178.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 10.3 ptmm? -65.52 -33.63 76.37 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.462 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.562 ' HB3' ' HG ' ' A' ' 16' ' ' LEU . 29.8 mm-40 -64.56 -48.98 73.0 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.837 0.351 . . . . 0.0 110.23 177.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -59.88 -44.47 94.18 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.458 ' O ' HG13 ' A' ' 40' ' ' ILE . 11.0 m-85 -59.38 -46.54 88.37 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.213 178.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -65.25 -37.79 88.32 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.468 0.173 . . . . 0.0 111.468 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.7 t -61.58 -43.39 98.95 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.746 -0.465 . . . . 0.0 109.746 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.488 ' O ' HG23 ' A' ' 43' ' ' VAL . 92.4 mt -64.84 -52.53 56.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.998 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.5 mt -55.84 -37.63 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.177 -177.47 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -57.27 -47.71 80.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.857 0.361 . . . . 0.0 110.96 177.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -68.62 -38.57 80.66 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.5 t -60.31 -43.27 93.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.865 178.686 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -57.42 -53.41 58.43 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 120.737 0.303 . . . . 0.0 110.437 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -54.22 -45.7 72.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.34 0.59 . . . . 0.0 111.07 176.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.558 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 26.3 t30 -71.62 -45.95 60.56 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.012 -0.994 . . . . 0.0 112.045 -170.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -72.9 -31.19 64.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.481 0.182 . . . . 0.0 111.297 -175.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -71.67 -26.99 62.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.904 0.383 . . . . 0.0 110.497 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -89.18 -5.23 57.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.882 0.372 . . . . 0.0 110.494 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 t70 67.44 16.26 9.97 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.438 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -91.96 8.79 35.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.718 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.558 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 24.5 t70 -51.44 110.87 0.5 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.006 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 67.7 p-90 -123.97 8.22 8.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.22 -170.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -158.02 143.55 16.94 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.063 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.43 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -125.44 124.37 41.28 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 173.889 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.493 HD23 ' HA3' ' A' ' 67' ' ' GLY . 65.5 mt -135.69 133.65 38.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.0 111.621 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -138.31 157.18 46.75 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 171.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.536 ' HB3' ' CE2' ' A' ' 65' ' ' TRP . 30.9 p -103.67 164.78 11.45 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 120.661 0.267 . . . . 0.0 110.41 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -79.88 -179.14 6.8 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 171.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -68.83 -21.05 64.32 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.818 -171.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -88.25 -21.81 24.29 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.795 0.331 . . . . 0.0 110.818 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.63 2.09 84.5 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.127 -0.558 . . . . 0.0 112.407 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.49 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . 20.8 p -90.45 -7.25 53.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.756 0.312 . . . . 0.0 111.493 -177.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -136.41 129.63 31.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.039 0.447 . . . . 0.0 110.891 173.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.536 ' CE2' ' HB3' ' A' ' 58' ' ' SER . 38.3 m95 -112.87 138.03 50.33 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.747 176.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -137.87 145.06 41.74 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.01 -178.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.493 ' HA3' HD23 ' A' ' 56' ' ' LEU . . . -177.8 -150.69 8.72 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.183 -1.008 . . . . 0.0 112.651 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -147.1 139.21 24.5 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -174.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 23.2 p -125.84 138.31 53.81 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 175.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 13.9 p90 -157.4 135.74 11.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.812 0.339 . . . . 0.0 110.378 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -145.76 151.42 37.94 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.1 mm -88.24 121.4 38.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.019 0.438 . . . . 0.0 110.759 -175.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -129.69 112.52 13.74 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.031 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 0.8 OUTLIER 59.11 38.36 23.84 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.546 0.528 . . . . 0.0 111.229 179.508 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.4 mm? 75.4 -6.95 1.87 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.238 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.8 mt -79.98 107.49 12.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.914 0.388 . . . . 0.0 110.018 177.078 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -89.73 108.34 19.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.823 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -130.99 151.22 51.64 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.686 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -134.58 150.61 50.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.335 -178.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -131.99 119.84 21.62 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.032 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -72.16 119.06 15.81 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 172.099 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.488 HG22 HG22 ' A' ' 99' ' ' VAL . 30.7 pt -118.06 143.52 28.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 121.12 0.486 . . . . 0.0 111.819 -172.381 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -135.14 166.39 23.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.442 172.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.574 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 49.1 p90 -166.18 145.24 5.88 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.023 173.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -103.18 152.66 21.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.159 0.504 . . . . 0.0 110.664 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.49 ' HB ' ' HA ' ' A' ' 63' ' ' THR . 49.1 mm -104.37 90.82 3.47 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.855 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -62.54 166.63 13.0 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.671 2.247 . . . . 0.0 112.319 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.417 ' HA ' ' HD2' ' A' ' 22' ' ' PRO . 34.1 mt -70.1 -9.94 13.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.66 0.743 . . . . 0.0 110.582 -178.306 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.8 p -86.43 -13.62 45.68 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.332 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.533 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 72.2 t80 -73.51 143.5 82.48 Favored Pre-proline 0 C--N 1.326 -0.42 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.533 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 10.9 Cg_endo -94.1 14.96 44.12 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 124.703 -0.957 . . . . 0.0 113.172 0.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.5 m -65.81 -30.34 70.95 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.583 0.706 . . . . 0.0 109.738 177.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.3 m -122.06 150.64 41.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.521 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.24 144.68 92.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.427 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -77.61 156.23 31.82 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.66 2.24 . . . . 0.0 111.872 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -93.06 109.82 21.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.097 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.574 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 52.9 mt -76.01 128.82 37.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 177.032 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.38 -62.72 1.25 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.991 -173.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.488 HG22 HG22 ' A' ' 82' ' ' ILE . 21.2 t 60.39 83.15 0.21 Allowed Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.151 -173.107 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.17 -20.93 71.56 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.015 2.477 . . . . 0.0 113.462 -173.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -71.79 -25.32 61.96 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.858 0.361 . . . . 0.0 111.19 -178.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 86.8 mt -97.3 16.41 20.07 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.246 -0.284 . . . . 0.0 110.895 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -59.89 92.62 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.476 -177.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 68.44 21.86 74.57 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.939 -0.573 . . . . 0.0 113.346 174.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -98.56 -45.69 6.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.94 0.37 . . . . 0.0 110.821 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.438 HG23 HD11 ' A' ' 153' ' ' LEU . 33.6 m -66.94 -51.35 56.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.502 0.668 . . . . 0.0 110.524 178.297 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -160.47 -164.08 1.19 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.822 -178.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -71.46 106.17 3.85 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 176.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 6.1 tpt -66.32 132.88 49.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.499 -174.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -90.2 145.49 24.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.091 -173.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.21 32.34 17.28 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.018 174.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 90.39 -55.11 3.53 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.868 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -170.03 52.94 0.2 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.363 -179.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -124.24 142.49 51.2 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.2 pt -80.48 159.15 4.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.917 0.389 . . . . 0.0 111.221 -177.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 20.8 p -99.94 118.81 37.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.501 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.4 mt -86.74 176.35 7.78 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.552 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.448 HG23 ' HB2' ' A' ' 121' ' ' PHE . 8.7 t -71.59 149.67 45.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.398 179.082 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -64.5 -38.33 90.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.362 -175.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -71.75 -9.35 58.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.457 -177.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.448 ' HB2' HG23 ' A' ' 118' ' ' THR . 70.6 t80 -69.72 -34.69 74.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.736 0.303 . . . . 0.0 111.036 -178.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.41 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 14.5 mmmm -61.94 -53.58 58.59 Favored Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -177.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.53 ' O ' ' HG3' ' A' ' 127' ' ' ARG . 19.7 Cg_endo -61.61 -37.09 71.95 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 121.701 1.601 . . . . 0.0 111.8 174.568 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 63.9 tp -57.2 -47.03 82.32 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.921 0.391 . . . . 0.0 110.589 178.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.549 ' O ' HG23 ' A' ' 129' ' ' VAL . 29.5 t-105 -60.29 -53.06 62.17 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.001 177.438 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -58.06 -38.87 77.12 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.319 -175.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.53 ' HG3' ' O ' ' A' ' 123' ' ' PRO . 98.1 mtt180 -63.24 -26.69 68.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.685 0.278 . . . . 0.0 111.581 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -108.85 21.71 16.87 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.121 0.486 . . . . 0.0 111.053 -174.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.549 HG23 ' O ' ' A' ' 125' ' ' TRP . 68.8 t -107.77 136.43 19.69 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.959 175.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.432 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 1.4 Cg_endo -86.35 -158.3 1.36 Allowed 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 124.193 -1.169 . . . . 0.0 112.948 0.188 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.555 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 55.5 mttp 75.77 -0.55 3.17 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.168 0.987 . . . . 0.0 111.956 -177.264 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' PHE . . . . . 0.441 ' HZ ' HD12 ' A' ' 140' ' ' LEU . 4.3 t80 -72.53 163.95 27.2 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.158 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -151.67 165.38 30.54 Favored Glycine 0 C--O 1.236 0.265 0 C-N-CA 120.209 -0.996 . . . . 0.0 112.801 -174.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.44 HD23 HD11 ' A' ' 39' ' ' LEU . 48.2 tp -58.01 -46.74 84.76 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.52 0.728 . . . . 0.0 112.595 -172.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.46 -30.02 51.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.323 0.583 . . . . 0.0 111.8 -177.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -71.13 -31.23 67.47 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.566 -178.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 35.7 tp -58.79 -47.48 84.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.026 0.441 . . . . 0.0 110.815 178.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' MET . . . . . 0.471 ' HA ' ' HB3' ' A' ' 142' ' ' LEU . 1.3 mpt? -67.01 -39.35 87.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.903 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -69.86 -42.08 73.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.176 -177.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.441 HD12 ' HZ ' ' A' ' 132' ' ' PHE . 84.0 mt -95.01 -24.29 16.99 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -173.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -119.66 -63.69 0.27 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.098 -1.048 . . . . 0.0 113.755 -174.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.471 ' HB3' ' HA ' ' A' ' 138' ' ' MET . 1.4 tm? -57.99 -51.94 67.57 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -172.22 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.84 -61.17 7.75 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 121.312 -0.471 . . . . 0.0 113.134 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' PRO . . . . . 0.501 ' O ' HG23 ' A' ' 148' ' ' VAL . 77.3 Cg_exo -52.36 -36.58 69.31 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.884 2.389 . . . . 0.0 113.14 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -62.99 -49.0 76.42 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.788 0.328 . . . . 0.0 110.344 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 91.6 mt -60.1 -41.79 93.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.537 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.04 -8.61 46.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.316 -176.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 144' ' ' PRO . 94.7 t -106.44 -55.59 5.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.651 0.263 . . . . 0.0 111.362 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -79.84 -42.83 23.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.907 -170.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.564 ' O ' HG13 ' A' ' 154' ' ' ILE . 49.0 mm -59.66 -52.67 72.34 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -172.129 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.535 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 70.3 Cg_exo -53.45 -34.56 72.23 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.349 2.033 . . . . 0.0 113.488 -178.068 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.6 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 9.2 m-20 -86.26 -27.07 24.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.947 0.403 . . . . 0.0 110.875 178.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.652 ' HG ' ' HB ' ' A' ' 158' ' ' VAL . 15.7 tp -70.5 -26.79 63.76 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.146 0.498 . . . . 0.0 110.193 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 150' ' ' ILE . 69.1 mt -66.05 -49.56 75.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.736 175.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 1.4 pp0? -69.92 -20.17 63.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.188 -176.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 156' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 67.6 mttm -77.11 -16.64 59.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.077 0.465 . . . . 0.0 110.269 174.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 90.45 17.15 53.72 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.851 177.405 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' VAL . . . . . 0.652 ' HB ' ' HG ' ' A' ' 153' ' ' LEU . 58.7 t -88.71 -40.46 13.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.797 0.332 . . . . 0.0 110.705 -178.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.549 HD11 HD23 ' A' ' 153' ' ' LEU . 48.1 mm -67.09 127.32 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.325 178.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -83.36 117.55 23.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.197 0.522 . . . . 0.0 111.956 -176.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -171.8 127.51 0.61 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 172.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.504 ' HB3' ' OE2' ' A' ' 163' ' ' GLU . 6.8 ttpm? -58.05 -46.16 85.83 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 123.296 0.373 . . . . 0.0 111.378 -173.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.504 ' OE2' ' HB3' ' A' ' 162' ' ' LYS . 2.7 mp0 -78.25 101.12 6.97 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.25 177.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -104.06 -13.93 16.1 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.203 0.525 . . . . 0.0 109.674 174.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 79.5 m -124.15 159.0 31.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.236 173.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -68.58 149.77 48.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.827 0.346 . . . . 0.0 111.505 -175.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.454 ' HA ' ' OE1' ' A' ' 167' ' ' GLN . 5.5 tp60 -88.06 118.69 27.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.728 -178.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 45.9 tp -80.62 144.76 32.1 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.961 -177.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -79.88 120.46 24.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.108 0.48 . . . . 0.0 109.943 173.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -94.81 126.58 40.22 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.467 -173.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 75.5 t60 55.37 53.39 9.96 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 123.86 0.725 . . . . 0.0 111.093 173.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 22.3 t-160 -85.51 113.23 21.61 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.145 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -61.28 123.56 18.08 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.4 0.619 . . . . 0.0 110.741 -176.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -94.94 147.48 23.34 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.386 -174.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 33.4 p-80 . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.301 177.498 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -122.6 89.29 3.08 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.778 -178.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 52.09 79.46 0.11 Allowed 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.93 0.768 . . . . 0.0 112.531 176.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.9 mp0 -61.19 -35.37 76.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.656 177.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -64.91 -43.51 92.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.782 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.437 ' O ' HG23 ' A' ' 10' ' ' VAL . 25.7 m -64.13 -35.63 81.41 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.576 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -62.42 -39.88 94.74 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 120.855 0.359 . . . . 0.0 110.285 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.427 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 44.0 ttt85 -65.7 -38.17 88.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.686 178.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 5' ' ' ALA . 97.5 t -60.48 -41.03 86.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.937 0.399 . . . . 0.0 110.546 177.138 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 6' ' ' THR . 59.7 t -69.16 -27.17 33.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 121.099 0.476 . . . . 0.0 110.354 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.3 t -73.55 -32.47 64.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.231 177.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 8' ' ' ARG . 44.3 mt-10 -81.49 -28.26 34.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.877 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.401 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 51.0 mt -104.73 87.56 1.86 Allowed Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 174.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.8 Cg_endo -50.18 141.71 30.22 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.884 3.056 . . . . 0.0 113.636 -169.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.4 m -69.33 149.53 10.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.369 177.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.556 HD21 ' HA ' ' A' ' 35' ' ' GLU . 6.4 mp -99.98 153.95 18.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.196 0.522 . . . . 0.0 111.571 -175.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.2 mttt -98.22 -49.67 4.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.619 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.4 m -75.17 108.05 7.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.606 -170.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -105.7 90.41 3.39 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.404 ' O ' ' HD3' ' A' ' 91' ' ' PRO . . . -145.04 145.63 31.55 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.492 -177.199 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.1 167.49 41.75 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.149 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.28 -13.47 38.33 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 123.217 2.611 . . . . 0.0 113.088 -176.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -74.14 -24.6 59.44 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.801 0.334 . . . . 0.0 110.869 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -89.4 94.27 9.83 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 25' ' ' ARG . 43.3 mtm105 -60.11 -51.58 69.02 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -164.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -73.75 -29.94 62.51 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.496 -175.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -76.6 -26.52 55.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.904 0.383 . . . . 0.0 110.199 175.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.531 ' CH2' HG21 ' A' ' 86' ' ' ILE . 55.3 t-105 -64.2 -44.73 91.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.982 175.648 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.52 -41.35 81.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.353 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.698 ' HG3' ' HE3' ' A' ' 33' ' ' LYS . 53.5 tt0 -64.63 -44.0 91.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.308 177.681 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.537 HH22 HD22 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -54.52 -45.08 73.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.721 177.16 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.6 mp -62.88 -46.24 88.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.592 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.698 ' HE3' ' HG3' ' A' ' 30' ' ' GLN . 20.7 pttp -68.26 -38.88 82.23 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.904 -176.12 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 6.6 mm-40 -68.26 -45.13 74.0 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.712 0.292 . . . . 0.0 110.634 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.556 ' HA ' HD21 ' A' ' 16' ' ' LEU . 10.0 tp10 -61.91 -42.51 99.17 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.084 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -63.84 -30.55 71.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.49 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.684 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 81.8 mm-40 -62.32 -49.51 75.33 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 m -63.72 -38.15 90.04 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.897 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.462 ' O ' HG23 ' A' ' 43' ' ' VAL . 92.8 mt -61.22 -55.92 26.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 177.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 87.2 mt -62.27 -36.22 73.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.78 -178.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -55.24 -47.17 75.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.991 175.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -72.45 -41.03 66.56 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.354 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.6 t -59.54 -39.05 78.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 120.736 0.303 . . . . 0.0 110.804 178.269 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -55.14 -54.83 38.31 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.4 -46.6 83.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.31 178.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -56.07 -51.41 67.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.623 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -63.16 -32.57 73.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.627 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -65.34 -36.73 84.9 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.006 0.431 . . . . 0.0 110.59 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -85.68 2.42 45.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.802 178.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.1 t70 64.51 23.02 12.83 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.844 0.831 . . . . 0.0 110.866 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -114.08 76.62 1.0 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.502 177.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -72.91 104.7 4.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.277 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.494 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -75.53 -61.22 1.99 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.458 -168.645 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.494 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 3.3 p90 -162.48 172.34 15.65 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.794 -173.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.506 ' NH2' ' HH2' ' A' ' 70' ' ' TRP . 4.5 ptp180 -141.79 133.32 26.82 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.5 tp -121.23 123.48 42.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.164 0.507 . . . . 0.0 110.545 -173.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -109.23 164.42 12.47 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.658 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.9 m -141.93 156.2 45.49 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 179.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -74.57 162.93 28.3 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 168.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -70.63 -4.8 25.16 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -171.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -98.57 -16.13 19.24 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.142 0.496 . . . . 0.0 110.471 173.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.69 15.61 75.75 Favored Glycine 0 CA--C 1.52 0.392 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.597 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.3 p -86.33 -3.37 58.97 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -158.76 120.31 3.44 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -105.22 145.59 30.43 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -178.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 83' ' ' GLU . 45.8 p90 -153.34 158.92 42.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.457 -176.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 166.83 -150.53 17.61 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.564 -0.826 . . . . 0.0 112.078 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.579 ' HD3' ' HB2' ' A' ' 79' ' ' GLU . 38.9 ttmt -133.21 140.95 47.82 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 -178.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.5 t -134.56 138.12 44.34 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.118 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.782 ' HB3' ' HA ' ' A' ' 79' ' ' GLU . 22.5 p90 -148.12 159.4 43.97 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.225 -0.59 . . . . 0.0 111.06 178.282 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 64.3 t80 -124.34 129.47 50.77 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.877 -176.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 49.9 mm -100.01 118.56 46.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 179.072 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 82.4 t60 -146.5 119.1 8.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.07 -0.513 . . . . 0.0 109.646 -178.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.465 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 0.9 OUTLIER 63.84 31.93 13.72 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.418 0.449 . . . . 0.0 110.151 -175.687 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.2 mm? 71.84 -3.75 2.11 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.43 -176.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.616 HD21 ' HE2' ' A' ' 164' ' ' LYS . 93.1 mt -65.12 123.75 20.34 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.726 0.298 . . . . 0.0 110.417 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -114.01 108.38 16.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.296 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.495 ' CE1' HG21 ' A' ' 150' ' ' ILE . 0.5 OUTLIER -129.94 109.83 11.19 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.22 177.368 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.782 ' HA ' ' HB3' ' A' ' 70' ' ' TRP . 11.4 pt-20 -96.64 143.71 27.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.091 -176.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -132.96 136.68 46.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.041 177.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -82.19 127.61 33.33 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 176.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 48.0 pt -126.52 158.38 36.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.121 0.486 . . . . 0.0 111.284 -175.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 66' ' ' PHE . 7.3 pt-20 -159.26 170.16 22.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.793 174.535 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.553 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 39.4 p90 -167.93 146.59 4.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.118 0.485 . . . . 0.0 110.411 173.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -89.76 167.11 13.13 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.342 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.531 HG21 ' CH2' ' A' ' 28' ' ' TRP . 47.2 mm -114.36 89.46 17.87 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.572 -177.091 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -63.2 163.46 22.97 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.802 2.335 . . . . 0.0 111.925 175.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.402 ' N ' HD12 ' A' ' 88' ' ' ILE . 2.0 mp -62.31 -23.79 33.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-O 121.145 0.498 . . . . 0.0 110.938 -178.269 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.534 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 1.3 p -72.79 -12.75 61.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -178.019 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -73.02 141.0 81.02 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.404 ' HD3' ' O ' ' A' ' 20' ' ' ALA . 63.6 Cg_endo -97.55 8.63 36.05 Favored 'Cis proline' 0 N--CA 1.458 -0.564 0 C-N-CA 124.437 -1.068 . . . . 0.0 112.895 -0.102 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 25.2 m -60.6 -32.92 72.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.409 0.623 . . . . 0.0 110.429 -178.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.534 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 29.6 m -126.3 132.58 51.61 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 172.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.3 144.74 97.43 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.693 0.282 . . . . 0.0 111.509 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -82.51 158.35 16.81 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.693 2.262 . . . . 0.0 112.24 177.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -83.31 115.83 22.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.223 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.553 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 5.0 mp -73.9 131.38 35.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.294 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.445 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -100.72 123.0 44.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.933 0.396 . . . . 0.0 110.904 -179.022 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.0 t -129.33 87.09 54.56 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.37 178.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.75 -19.37 45.94 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 123.273 2.648 . . . . 0.0 113.917 -173.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.457 ' O ' ' HD3' ' A' ' 105' ' ' LYS . 7.8 tp10 -84.53 3.86 34.6 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.971 0.415 . . . . 0.0 110.985 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.7 mt -123.38 22.01 9.37 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 122.161 -0.337 . . . . 0.0 111.005 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -69.29 89.32 0.47 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.113 0.483 . . . . 0.0 111.146 -177.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 60.49 25.44 63.05 Favored Glycine 0 CA--C 1.52 0.358 0 CA-C-N 115.395 -0.821 . . . . 0.0 113.915 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' ' 101' ' ' GLU . 19.8 ptmt -116.08 13.41 15.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.178 0.489 . . . . 0.0 111.835 -177.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.2 t -123.12 -16.92 6.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.095 0.474 . . . . 0.0 110.118 172.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -170.7 -168.13 0.65 Allowed 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -177.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -65.1 -39.86 93.73 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 8.3 tpt 65.63 98.69 0.04 OUTLIER 'General case' 0 N--CA 1.461 0.12 0 O-C-N 124.079 0.862 . . . . 0.0 110.946 175.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -78.77 4.94 12.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.958 -175.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.457 ' HG3' ' SG ' ' A' ' 116' ' ' CYS . 30.5 mmt180 -120.01 -81.5 0.63 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.828 0.347 . . . . 0.0 110.186 175.164 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 153.63 -111.09 0.47 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.875 -0.678 . . . . 0.0 111.773 178.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -80.19 -11.95 83.77 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.859 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 98' ' ' ALA . 17.5 ptpt -105.06 140.32 38.41 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 178.11 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.42 HD11 ' HB ' ' A' ' 97' ' ' ILE . 2.8 pp -101.03 161.58 3.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.516 -179.078 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.457 ' SG ' ' HG3' ' A' ' 111' ' ' ARG . 73.3 m -138.47 161.93 35.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.019 178.331 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.4 mt -103.75 167.74 9.59 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.795 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.0 t -57.81 156.52 8.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.143 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -50.8 -36.33 36.6 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.282 -178.012 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.427 ' O ' ' HD2' ' A' ' 123' ' ' PRO . 19.4 m170 -67.06 -21.58 65.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.591 -172.046 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -68.65 -36.55 78.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.217 -178.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.58 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 26.8 ttpp -60.97 -49.52 88.74 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -174.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.58 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 20.7 Cg_exo -66.82 -39.41 14.86 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 121.662 1.575 . . . . 0.0 112.19 174.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 51.4 tp -59.69 -49.28 78.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.129 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.42 ' O ' HG23 ' A' ' 129' ' ' VAL . 58.9 t-105 -57.62 -52.21 66.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.908 -176.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.09 -13.29 62.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.597 -176.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -91.82 -26.73 18.38 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.944 0.402 . . . . 0.0 110.376 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -85.35 -44.46 12.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.209 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.552 HG13 ' HA ' ' A' ' 130' ' ' PRO . 91.9 t -51.97 138.9 34.07 Favored Pre-proline 0 N--CA 1.471 0.577 0 O-C-N 123.704 0.627 . . . . 0.0 111.093 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.552 ' HA ' HG13 ' A' ' 129' ' ' VAL . 4.7 Cg_exo -81.48 -152.38 0.78 Allowed 'Cis proline' 0 C--N 1.353 0.814 0 C-N-CA 124.574 -1.011 . . . . 0.0 113.118 3.109 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm 76.02 -20.67 0.35 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.657 0.783 . . . . 0.0 111.322 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.8 -179.28 7.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.74 0.305 . . . . 0.0 110.546 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -179.86 -179.57 48.79 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.14 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.457 HD21 ' HZ ' ' A' ' 84' ' ' PHE . 55.5 tp -66.75 -37.21 84.19 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 122.625 0.37 . . . . 0.0 111.204 -176.449 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.31 -38.8 77.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.406 0.622 . . . . 0.0 110.404 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -71.67 -32.45 67.89 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.009 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 57.5 tp -66.55 -45.57 78.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.454 -179.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -35.94 74.77 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.119 -177.397 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -76.63 -50.47 13.69 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 86.9 mt -89.58 -14.06 35.89 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -173.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -108.16 -63.42 0.56 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.632 -179.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.505 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 60.9 tp -67.59 -40.83 84.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.471 0.177 . . . . 0.0 111.462 -175.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.08 -61.48 6.52 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.24 -0.505 . . . . 0.0 113.259 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' PRO . . . . . 0.439 ' O ' HG23 ' A' ' 148' ' ' VAL . 45.0 Cg_exo -59.17 -33.76 98.3 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.58 2.186 . . . . 0.0 112.568 177.105 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -62.7 -41.74 99.29 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.036 0.446 . . . . 0.0 110.424 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 97.9 mt -59.72 -36.14 75.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.628 177.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.79 -9.7 58.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.556 -178.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 144' ' ' PRO . 60.4 t -91.82 -56.04 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.668 0.271 . . . . 0.0 111.135 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -89.63 -41.59 11.88 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -172.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.563 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.9 mm -56.2 -52.86 69.53 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -172.481 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.563 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 51.0 Cg_exo -55.44 -40.87 83.13 Favored 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.04 1.827 . . . . 0.0 112.356 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -68.79 -39.99 79.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.234 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.561 HD12 ' HD2' ' A' ' 156' ' ' LYS . 21.7 tp -64.41 -28.93 70.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.983 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 150' ' ' ILE . 78.8 mt -63.92 -53.28 46.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.571 177.291 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -69.64 -14.43 62.81 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.175 0.512 . . . . 0.0 110.22 -178.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' LYS . . . . . 0.561 ' HD2' HD12 ' A' ' 153' ' ' LEU . 28.1 ttmt -69.03 -13.55 62.51 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.769 -178.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 91.6 -16.7 58.54 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.275 173.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.9 p -73.45 -31.58 33.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.701 0.286 . . . . 0.0 110.932 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.556 HD11 HD23 ' A' ' 153' ' ' LEU . 57.4 mt -88.39 120.81 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.496 178.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -77.76 96.33 4.88 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 175.636 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -57.31 113.04 1.58 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.421 -174.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 64.0 mmtt -87.3 179.1 6.67 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.613 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 60.42 16.25 6.18 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 165.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.616 ' HE2' HD21 ' A' ' 76' ' ' LEU . 69.8 mmtt -84.69 -14.64 47.85 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.324 175.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 73.6 m 61.85 86.2 0.11 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.418 175.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -98.64 144.97 27.33 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 172.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -80.66 85.56 6.02 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.124 0.488 . . . . 0.0 111.902 -174.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 6.5 mp -109.62 92.62 4.12 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 168.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -81.3 77.06 8.22 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.833 0.825 . . . . 0.0 110.428 -174.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -85.95 94.18 9.13 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 172.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 15.5 t60 -53.16 124.92 15.78 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.653 0.595 . . . . 0.0 111.237 -172.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -75.41 90.13 2.67 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.412 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -80.91 157.21 25.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.452 -176.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -61.27 130.69 47.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.757 178.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 29.2 t-80 . . . . . 0 C--O 1.245 0.816 0 CA-C-O 118.793 -0.622 . . . . 0.0 109.733 178.434 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.03 94.18 6.13 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.962 0.41 . . . . 0.0 109.915 176.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.519 ' HB2' ' OG1' ' A' ' 6' ' ' THR . 3.1 m-20 -67.88 139.99 56.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.302 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -60.04 -36.53 77.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.737 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.434 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -65.44 -47.17 77.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.354 176.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.519 ' OG1' ' HB2' ' A' ' 3' ' ' ASP . 22.2 m -57.78 -54.74 43.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.355 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -62.53 -36.41 82.5 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.496 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.2 tpm_? -61.34 -44.5 97.08 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.794 0.331 . . . . 0.0 110.435 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.464 ' O ' HG13 ' A' ' 13' ' ' ILE . 92.0 t -67.5 -46.58 82.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.818 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 6' ' ' THR . 88.7 t -58.01 -45.28 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.885 -177.315 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.2 m -65.7 -19.37 65.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -103.59 13.22 33.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.655 0.264 . . . . 0.0 111.266 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 9' ' ' VAL . 52.1 mt -122.4 89.53 49.3 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.04 161.06 5.34 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.549 2.833 . . . . 0.0 113.723 -175.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.433 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 35.6 m -97.56 179.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.983 -179.14 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.999 HD21 ' HB3' ' A' ' 35' ' ' GLU . 7.1 mp -108.1 154.08 22.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.271 -176.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.555 ' HG2' ' OE1' ' A' ' 34' ' ' GLU . 36.1 mmtm -78.85 -66.47 0.86 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.536 0.684 . . . . 0.0 109.176 171.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.4 m -75.68 126.64 31.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.686 -176.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -120.77 81.82 1.82 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.415 0.626 . . . . 0.0 109.887 171.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -125.83 -173.38 2.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.895 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -127.27 -177.19 14.75 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.204 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.473 ' HD2' ' O ' ' A' ' 88' ' ' ILE . 39.3 Cg_exo -61.94 -5.4 6.11 Favored 'Trans proline' 0 CA--C 1.533 0.45 0 C-N-CA 123.265 2.644 . . . . 0.0 113.254 -179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.3 mtm105 -67.22 -41.64 85.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.305 0.574 . . . . 0.0 110.015 175.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.546 ' HB3' HD23 ' A' ' 27' ' ' LEU . 5.6 m-20 -92.44 95.11 9.46 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.102 177.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -58.69 -47.17 85.44 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -170.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -72.33 -38.69 68.57 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.085 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.546 HD23 ' HB3' ' A' ' 24' ' ' ASP . 3.6 mm? -68.58 -29.19 67.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.003 0.43 . . . . 0.0 110.252 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.49 ' O ' HD23 ' A' ' 32' ' ' LEU . 63.3 t-105 -62.24 -47.69 83.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.978 175.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 50.7 t -57.26 -35.1 47.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.644 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -70.2 -39.01 75.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.911 176.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.691 ' NH2' ' HG3' ' A' ' 91' ' ' PRO . 27.5 ttt-85 -64.26 -39.78 94.65 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.054 -0.351 . . . . 0.0 110.054 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.49 HD23 ' O ' ' A' ' 28' ' ' TRP . 4.0 mm? -52.72 -58.48 6.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.002 177.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -61.7 -35.48 78.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 121.248 -0.181 . . . . 0.0 111.105 -177.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.555 ' OE1' ' HG2' ' A' ' 17' ' ' LYS . 46.0 mm-40 -62.34 -54.63 37.68 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.484 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.999 ' HB3' HD21 ' A' ' 16' ' ' LEU . 15.5 pt-20 -77.57 -27.08 51.33 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.515 -177.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.551 ' O ' HG13 ' A' ' 40' ' ' ILE . 2.0 m-85 -55.06 -45.0 75.26 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 169.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -59.98 -41.58 92.31 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.86 0.362 . . . . 0.0 110.598 176.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.3 t -60.81 -43.7 97.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.938 176.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.481 ' O ' HG23 ' A' ' 43' ' ' VAL . 79.2 mt -61.35 -49.97 74.81 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.878 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.0 mt -53.1 -43.36 48.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.58 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.87 -44.26 97.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.682 0.277 . . . . 0.0 110.49 -179.297 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -66.8 -41.3 87.79 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.854 0.359 . . . . 0.0 110.204 177.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.509 HG12 ' HE2' ' A' ' 47' ' ' LYS . 80.4 t -59.92 -42.93 91.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.731 178.385 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 44.0 mt-10 -55.83 -54.08 48.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.506 177.213 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -61.13 -50.26 73.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.662 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.5 ' OD1' ' HA ' ' A' ' 52' ' ' ASP . 18.1 t-20 -72.39 -32.46 66.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.285 -169.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.509 ' HE2' HG12 ' A' ' 43' ' ' VAL . 42.8 mtmt -71.33 -45.53 62.78 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.845 176.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -69.61 -18.73 63.63 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.236 0.541 . . . . 0.0 110.226 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.13 -2.3 47.88 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.806 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.5 t70 59.62 37.7 22.39 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.842 0.829 . . . . 0.0 109.329 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -133.44 29.29 3.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.135 -173.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.5 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 9.6 p-10 -69.16 105.34 2.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.691 0.758 . . . . 0.0 110.012 178.232 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 43.5 p-90 -108.94 10.43 26.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.309 -170.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 37.2 p90 -158.05 156.93 31.94 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.651 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.426 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 21.6 mmm180 -130.08 123.77 31.23 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.99 -1.004 . . . . 0.0 108.934 171.351 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 52.0 mt -123.56 124.62 43.22 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.149 0.5 . . . . 0.0 110.63 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -116.6 150.17 38.48 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.3 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.4 m -106.77 147.63 29.43 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.059 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -77.78 172.33 13.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 172.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -62.06 -23.45 66.5 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -175.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -91.99 -20.68 21.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.694 -177.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.66 16.9 80.01 Favored Glycine 0 C--O 1.228 -0.223 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.588 -175.164 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.0 p -98.79 -16.72 18.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.969 0.414 . . . . 0.0 111.367 -176.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -136.99 125.85 24.12 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.497 179.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 34.1 m95 -109.42 137.65 46.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.1 p90 -145.08 160.26 41.68 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.463 -176.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.426 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 162.75 -159.33 31.68 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.33 -0.938 . . . . 0.0 112.51 178.079 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -121.23 146.83 46.4 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.898 0.38 . . . . 0.0 110.972 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 51.1 t -112.34 123.96 51.42 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 168.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.456 ' HD1' ' HG2' ' A' ' 79' ' ' GLU . 6.9 m0 -106.02 122.07 45.41 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.788 -177.198 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -118.74 118.66 32.22 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 176.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 30.8 mm -99.88 119.95 48.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -127.62 115.34 18.62 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.04 -176.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.473 ' C ' HD22 ' A' ' 75' ' ' LEU . 39.7 m-20 67.65 -85.8 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 124.027 0.829 . . . . 0.0 110.432 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.473 HD22 ' C ' ' A' ' 74' ' ' ASP . 3.0 mm? -137.04 0.63 2.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.882 0.372 . . . . 0.0 110.108 178.129 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.551 ' CD2' ' HA ' ' A' ' 164' ' ' LYS . 61.8 mt -108.69 149.61 28.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.335 -170.474 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -110.19 119.64 39.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.784 179.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -110.06 115.13 29.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.456 ' HG2' ' HD1' ' A' ' 70' ' ' TRP . 30.5 mt-10 -100.63 136.56 40.32 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.635 -175.744 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -128.93 116.76 19.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.814 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.73 131.83 36.74 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 176.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.461 HG22 HG22 ' A' ' 99' ' ' VAL . 23.3 pt -126.21 147.9 30.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.909 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -155.09 141.6 18.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.761 178.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.605 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 44.7 p90 -156.25 147.29 22.18 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.362 0.601 . . . . 0.0 111.652 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.544 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 5.2 p-10 -92.26 156.29 17.39 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.433 178.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.7 mm -104.88 90.87 3.83 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.403 179.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.544 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 71.5 Cg_exo -48.53 148.78 7.7 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.3 2.667 . . . . 0.0 113.189 -178.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.473 ' O ' ' HD2' ' A' ' 22' ' ' PRO . 50.3 mm -58.43 -27.54 33.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.1 -178.74 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.758 HG22 ' HB ' ' A' ' 92' ' ' THR . 4.1 m -93.52 17.58 11.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.964 0.411 . . . . 0.0 111.588 -178.173 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 91' ' ' PRO . 87.4 t80 -68.56 138.24 91.07 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 174.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.691 ' HG3' ' NH2' ' A' ' 31' ' ' ARG . 35.7 Cg_endo -97.83 12.35 33.59 Favored 'Cis proline' 0 C--N 1.346 0.446 0 C-N-CA 124.377 -1.093 . . . . 0.0 113.096 -1.327 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.758 ' HB ' HG22 ' A' ' 89' ' ' THR . 24.3 m -56.38 -35.82 68.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.401 0.619 . . . . 0.0 109.805 177.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 52.5 m -117.86 125.31 50.27 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.368 -0.833 . . . . 0.0 108.761 171.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.402 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -67.76 144.75 97.67 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-O 120.779 0.323 . . . . 0.0 111.528 -174.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 9.4 Cg_exo -71.52 124.91 10.72 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.777 2.318 . . . . 0.0 111.8 177.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.713 ' HB3' ' HD2' ' A' ' 114' ' ' LYS . 36.9 mt-10 -75.94 103.42 6.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.792 178.678 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.605 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 58.3 mt -70.01 136.36 26.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.626 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -112.96 130.1 56.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.686 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.461 HG22 HG22 ' A' ' 82' ' ' ILE . 36.3 t -121.56 88.18 46.3 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.944 179.23 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -55.6 -29.53 70.54 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.999 2.466 . . . . 0.0 113.308 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -66.73 -36.25 82.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.777 0.322 . . . . 0.0 111.315 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 85.3 mt -90.96 1.06 57.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.972 0.415 . . . . 0.0 111.059 -177.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -65.24 109.58 2.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.821 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 98.58 -27.57 18.98 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.363 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -80.67 -12.41 59.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.888 0.375 . . . . 0.0 111.71 -175.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 t -137.81 148.2 45.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.923 0.392 . . . . 0.0 110.427 177.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -84.82 174.45 9.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.731 176.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' A' ' 108' ' ' LYS . 37.0 ttmt 66.87 12.13 8.73 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.57 0.7 . . . . 0.0 110.282 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 13.0 tpt -94.28 27.17 3.0 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.677 -173.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.687 ' O ' ' HG3' ' A' ' 111' ' ' ARG . 88.2 m-85 50.4 58.66 5.26 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.856 -177.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.687 ' HG3' ' O ' ' A' ' 110' ' ' TYR . 0.0 OUTLIER 50.32 16.02 0.24 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.372 1.069 . . . . 0.0 112.874 -176.601 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.48 123.21 5.16 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.974 -0.632 . . . . 0.0 112.741 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 129.09 -80.14 0.36 Allowed Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.437 175.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.713 ' HD2' ' HB3' ' A' ' 96' ' ' GLU . 71.3 mmtt -85.68 137.99 32.44 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.598 0.237 . . . . 0.0 110.625 -176.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.465 ' CD1' ' HB ' ' A' ' 97' ' ' ILE . 46.7 pt -76.83 157.61 5.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.428 0.633 . . . . 0.0 111.918 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 49.5 t -125.29 113.53 17.73 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.1 173.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 88.3 mt -81.9 -82.2 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.984 -176.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.6 t -163.39 154.42 16.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.368 -177.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -62.54 -30.03 71.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.504 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.6 t60 -73.4 -20.05 60.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.215 -175.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -68.54 -40.01 80.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.892 -174.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -61.35 -55.05 47.09 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -174.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.11 -32.77 83.35 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.702 1.601 . . . . 0.0 112.164 175.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.53 -43.51 76.58 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.892 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.534 ' O ' HG23 ' A' ' 129' ' ' VAL . 70.0 t-105 -61.56 -57.48 11.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.53 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.36 -30.06 68.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.929 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -77.7 -23.04 49.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.814 0.34 . . . . 0.0 111.529 -177.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.405 ' HB2' ' HE2' ' A' ' 132' ' ' PHE . 34.0 m-80 -106.0 10.29 32.29 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.185 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 125' ' ' TRP . 97.6 t -87.63 139.68 31.5 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.454 ' HA ' HG13 ' A' ' 129' ' ' VAL . 64.8 Cg_endo -95.6 -146.19 0.16 OUTLIER 'Cis proline' 0 C--N 1.353 0.77 0 C-N-CA 124.972 -0.845 . . . . 0.0 113.781 5.133 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.433 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 49.3 mtmt 75.07 11.06 3.63 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.698 -176.353 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' PHE . . . . . 0.405 ' HE2' ' HB2' ' A' ' 128' ' ' ASN . 0.2 OUTLIER -91.64 144.61 25.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.985 -179.863 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -146.57 167.42 28.09 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 178.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 43.6 tp -55.24 -33.13 62.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.143 0.471 . . . . 0.0 111.692 -177.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.87 -47.27 77.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.987 0.422 . . . . 0.0 111.43 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -71.29 -38.45 71.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.463 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.406 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 67.2 tp -65.33 -44.57 87.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.43 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 15.8 tpt -66.56 -47.97 71.12 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.927 0.394 . . . . 0.0 110.916 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.417 ' O ' ' HD3' ' A' ' 144' ' ' PRO . . . -71.2 -44.8 64.7 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.131 -175.024 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.8 mt -94.74 -0.24 54.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.796 0.331 . . . . 0.0 111.665 -174.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -113.24 -75.12 0.69 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.282 -0.961 . . . . 0.0 112.722 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.45 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 9.8 tt -67.49 -36.56 81.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.676 0.274 . . . . 0.0 110.832 -175.591 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.67 -61.85 6.86 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.177 -0.535 . . . . 0.0 113.274 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' PRO . . . . . 0.444 ' O ' HG23 ' A' ' 148' ' ' VAL . 32.9 Cg_exo -60.14 -33.04 95.32 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.549 2.166 . . . . 0.0 112.53 177.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 60.3 t90 -60.08 -39.55 86.48 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.903 0.383 . . . . 0.0 110.747 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 95.2 mt -58.04 -41.81 84.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.751 178.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.57 -15.06 63.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.819 -176.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 144' ' ' PRO . 56.3 t -88.06 -42.49 14.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.469 -177.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -104.02 -44.38 5.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -173.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.551 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.3 mm -55.99 -52.74 70.17 Favored Pre-proline 0 CA--C 1.54 0.562 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -170.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.551 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 51.8 Cg_exo -56.46 -31.62 86.47 Favored 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 122.01 1.807 . . . . 0.0 112.929 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -86.96 -26.72 23.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.833 0.349 . . . . 0.0 110.731 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.501 HD23 HD11 ' A' ' 159' ' ' ILE . 24.8 tp -70.21 -40.52 74.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.998 178.102 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 73.6 mt -63.19 -44.51 99.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.229 176.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.463 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . 6.3 tp60 -69.44 -22.94 63.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.06 -177.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -83.19 -2.21 54.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.169 0.509 . . . . 0.0 110.303 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 72.05 24.18 76.88 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 115.817 -0.629 . . . . 0.0 113.025 175.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 40.2 t -84.53 -31.34 7.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.216 0.531 . . . . 0.0 110.722 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.501 HD11 HD23 ' A' ' 153' ' ' LEU . 53.8 mt -94.83 125.79 47.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.53 -179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -64.79 143.23 58.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.301 176.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -89.5 104.84 17.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.107 0.48 . . . . 0.0 109.905 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.88 159.74 16.03 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.756 -178.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 60.82 33.22 20.09 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 123.813 0.696 . . . . 0.0 111.551 -177.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.551 ' HA ' ' CD2' ' A' ' 76' ' ' LEU . 34.5 mtmm -62.03 -55.93 24.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.932 0.396 . . . . 0.0 110.421 -179.422 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 67.7 m -95.84 85.94 4.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.129 0.49 . . . . 0.0 109.982 176.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -98.85 -48.29 4.97 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.866 -178.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.442 ' HA ' ' OE1' ' A' ' 167' ' ' GLN . 5.9 tp60 -136.83 135.62 38.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.39 -174.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 58.6 tp -74.78 -37.56 62.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.605 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -89.71 125.17 35.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.67 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -113.64 -2.83 13.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.986 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -72.93 104.33 4.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.079 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -153.83 154.82 34.64 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.101 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -137.05 135.45 37.55 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.264 -177.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 12.0 p-80 -115.59 163.49 15.7 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 177.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 . . . . . 0 C--O 1.242 0.7 0 CA-C-O 118.516 -0.754 . . . . 0.0 109.658 176.903 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.08 131.62 21.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.584 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -80.42 -15.43 56.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.201 0.524 . . . . 0.0 110.393 178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -60.6 -46.39 90.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.71 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.457 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -56.81 -47.38 80.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.395 -179.071 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.7 m -64.0 -36.67 84.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.054 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.17 -37.17 72.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.008 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -61.46 -38.84 88.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.894 0.378 . . . . 0.0 110.416 175.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 5' ' ' ALA . 88.5 t -57.28 -52.73 52.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.414 176.061 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 65.0 t -64.52 -35.32 74.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.504 -177.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.6 m -70.45 -36.28 73.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.801 -177.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.431 ' HB3' HD21 ' A' ' 45' ' ' ASN . 43.8 mt-10 -96.52 -16.93 20.84 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -176.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.446 HD12 HG13 ' A' ' 9' ' ' VAL . 25.6 mt -108.56 90.21 7.0 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 177.059 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -40.12 128.24 2.15 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.959 3.106 . . . . 0.0 113.872 -174.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.5 m -76.26 146.03 9.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.654 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mp -100.94 131.64 46.72 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.109 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -110.7 -29.38 8.03 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.16 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.6 m -68.32 97.17 0.71 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.455 175.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -134.76 128.41 32.82 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.809 0.337 . . . . 0.0 110.588 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -146.97 -37.39 0.22 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.514 178.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.47 161.36 10.89 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.935 -0.65 . . . . 0.0 111.599 178.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -69.47 -7.45 20.99 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.73 2.286 . . . . 0.0 112.303 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.43 ' CG ' HG23 ' A' ' 88' ' ' ILE . 22.8 mmm180 -88.6 -3.01 58.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.718 178.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -112.76 103.55 11.56 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.607 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -61.09 -52.18 66.01 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -170.28 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.607 ' HG3' HD22 ' A' ' 27' ' ' LEU . 11.0 pt-20 -72.87 -38.92 66.85 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.576 -0.45 . . . . 0.0 112.018 -171.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.607 HD22 ' HG3' ' A' ' 26' ' ' GLU . 4.0 mm? -71.98 -31.15 65.98 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.682 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 -68.21 -33.0 73.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.131 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 25' ' ' ARG . 67.0 t -58.2 -49.98 79.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.641 177.007 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -61.08 -47.25 87.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.784 0.326 . . . . 0.0 110.549 178.301 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.566 HH22 ' HA2' ' A' ' 133' ' ' GLY . 45.9 ttt-85 -64.44 -35.24 80.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -176.267 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.419 HD22 ' HA ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -60.59 -53.17 60.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.81 -177.929 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? -67.06 -41.14 86.96 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.046 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -64.71 -38.06 89.7 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.868 -179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -66.85 -36.32 82.07 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.442 ' O ' HG13 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -65.0 -46.94 79.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.25 178.731 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -63.03 -34.75 78.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.814 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -60.16 -46.64 88.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.866 174.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.524 ' O ' HG23 ' A' ' 43' ' ' VAL . 84.1 mt -61.02 -51.5 68.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.807 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.461 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 80.5 mt -56.81 -40.84 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.339 -178.339 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -45.6 87.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.037 0.446 . . . . 0.0 110.304 178.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -67.63 -34.97 78.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.341 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 39' ' ' LEU . 84.1 t -62.35 -40.78 89.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.319 175.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 49.3 mt-10 -58.78 -48.75 80.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.906 0.384 . . . . 0.0 110.198 175.125 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.431 HD21 ' HB3' ' A' ' 12' ' ' GLU . 6.5 m-20 -57.48 -40.25 78.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.837 177.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.52 -51.99 65.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.795 176.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.45 ' HE2' HG12 ' A' ' 43' ' ' VAL . 65.3 mttm -64.29 -28.86 70.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.384 -176.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -59.17 -41.03 87.44 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.638 175.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -90.56 -1.53 57.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.143 0.496 . . . . 0.0 110.49 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.0 t70 69.38 10.54 7.78 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.853 -178.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -95.76 68.17 2.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.521 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -81.67 86.6 6.38 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -97.85 -2.76 40.13 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -165.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -159.13 153.27 23.64 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.777 -0.769 . . . . 0.0 111.666 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -134.62 128.54 33.34 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 171.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.9 tp -131.08 125.13 32.38 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.58 -173.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -136.3 169.14 18.13 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.406 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 61.5 p -152.25 177.9 10.07 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.126 -179.025 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.466 ' OD1' ' HB2' ' A' ' 61' ' ' GLU . 4.2 p30 -71.52 163.89 26.88 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 168.569 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -73.38 -9.89 59.16 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.787 0.327 . . . . 0.0 111.737 -174.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.466 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 9.1 mm-40 -74.57 -36.43 63.06 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 171.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.99 20.97 69.11 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.509 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.3 p -90.74 -15.13 30.77 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.872 0.368 . . . . 0.0 111.556 -178.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 43.4 mtm180 -146.31 126.17 13.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.219 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.406 ' CD2' ' HB3' ' A' ' 58' ' ' SER . 50.0 m95 -114.26 158.27 21.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.693 -175.441 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -154.95 152.72 30.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.317 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.41 -162.61 29.47 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.336 178.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.413 ' HE3' ' HB2' ' A' ' 68' ' ' LYS . 35.6 ttmt -152.63 147.0 25.63 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.946 -0.391 . . . . 0.0 109.946 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 58.8 m -118.41 135.23 54.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.357 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 31.3 m-90 -114.52 121.69 44.28 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 176.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 47.8 t80 -120.66 122.95 41.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.195 0.521 . . . . 0.0 110.56 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 27.8 mm -102.87 114.14 41.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.557 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 14.5 t60 -130.21 105.23 7.78 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.137 179.677 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.3 t70 48.08 74.07 0.18 Allowed 'General case' 0 N--CA 1.465 0.297 0 O-C-N 124.307 1.004 . . . . 0.0 111.914 177.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 72.65 -33.52 0.27 Allowed 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.276 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.5 mt -74.87 123.56 25.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.032 0.444 . . . . 0.0 111.19 -178.052 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -115.66 119.01 34.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.213 177.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.417 ' CE1' ' HD2' ' A' ' 71' ' ' TYR . 7.1 p90 -140.03 144.96 37.17 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.503 177.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.04 148.8 50.12 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.333 -174.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -120.61 126.08 49.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.672 -177.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -88.2 114.85 25.23 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 99' ' ' VAL . 47.9 pt -124.89 150.07 29.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.282 0.563 . . . . 0.0 112.137 -172.049 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -156.18 159.58 39.1 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.649 175.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.506 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 43.7 p90 -165.13 163.61 20.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.92 0.39 . . . . 0.0 110.741 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -112.16 157.6 20.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.654 -178.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.438 ' HA ' ' HD2' ' A' ' 87' ' ' PRO . 49.5 mm -107.26 90.32 5.57 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.657 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.438 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 19.8 Cg_endo -56.37 157.86 17.06 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 122.996 2.464 . . . . 0.0 112.948 -177.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.43 HG23 ' CG ' ' A' ' 23' ' ' ARG . 70.1 mt -61.85 -26.41 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.289 -179.314 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.7 p -81.41 9.24 7.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.112 -0.494 . . . . 0.0 112.228 -176.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.418 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 67.5 t80 -72.93 141.18 81.48 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.418 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 97.0 Cg_endo -96.68 14.23 36.98 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.335 -1.111 . . . . 0.0 113.53 1.829 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.6 m -64.6 -35.53 81.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.372 0.606 . . . . 0.0 110.343 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.0 m -111.99 131.34 55.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 174.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.461 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -77.59 143.29 67.62 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 120.634 0.254 . . . . 0.0 111.166 -178.049 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 5.9 Cg_exo -79.97 123.51 5.19 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.208 2.606 . . . . 0.0 111.357 176.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 1.019 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 1.4 mp0 -84.59 126.16 33.09 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.178 -179.096 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.506 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 61.7 mt -72.86 134.6 29.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.459 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.436 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -105.89 128.93 54.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.721 0.296 . . . . 0.0 110.358 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.525 HG22 HG22 ' A' ' 82' ' ' ILE . 14.3 t -128.41 86.44 57.8 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.404 -178.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.8 -27.03 83.99 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 122.911 2.408 . . . . 0.0 112.814 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -65.11 -27.37 68.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.122 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 72.7 mt -96.87 2.94 52.31 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.689 -176.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -64.15 118.76 9.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.792 0.329 . . . . 0.0 110.746 178.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 85.78 -21.94 13.17 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.995 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -74.61 -45.87 42.19 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -179.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.7 t -107.5 155.55 19.95 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.628 176.331 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -85.36 -36.99 20.39 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.777 -177.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -82.18 50.5 1.6 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 121.141 0.496 . . . . 0.0 111.486 -174.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 54.7 ttm -125.49 124.22 40.87 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 172.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -85.36 159.57 19.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.216 0.531 . . . . 0.0 111.94 -172.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 60.1 mtm-85 -59.88 110.78 1.25 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.157 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 146.7 -27.06 1.64 Allowed Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 -174.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 102.13 -4.38 52.11 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.987 174.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 1.019 ' HD3' ' HB2' ' A' ' 96' ' ' GLU . 92.8 mttt -100.42 158.14 16.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.107 0.48 . . . . 0.0 111.211 -177.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 39.5 pt -78.96 176.57 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.846 -176.145 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 48.3 t -124.46 154.31 40.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.018 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 89.7 mt -124.97 -171.14 2.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.475 -176.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 7.1 t -89.91 158.48 17.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.919 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -62.93 -32.54 73.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.879 -177.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -73.95 -18.29 60.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.252 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -71.57 -38.27 70.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.344 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.465 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 73.4 mmtt -55.67 -58.76 13.97 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -176.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.465 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 38.2 Cg_endo -66.7 -34.61 31.22 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 121.744 1.629 . . . . 0.0 111.871 178.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.4 tp -60.83 -46.34 90.95 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.595 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.516 ' CZ3' HD13 ' A' ' 137' ' ' LEU . 40.8 t-105 -57.83 -57.08 14.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.698 178.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.87 -24.23 67.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.258 -174.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 -85.28 -20.52 29.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.714 0.292 . . . . 0.0 110.975 -177.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -105.81 36.53 2.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.125 0.488 . . . . 0.0 111.465 -177.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 98.2 t -116.77 130.96 24.18 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.469 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 89.6 Cg_endo -85.03 -149.64 0.49 Allowed 'Cis proline' 0 C--N 1.348 0.505 0 C-N-CA 123.973 -1.261 . . . . 0.0 113.267 1.693 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 99.3 mttt 75.98 9.16 3.41 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.862 0.865 . . . . 0.0 111.027 -174.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -114.94 165.6 12.69 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.566 ' HA2' HH22 ' A' ' 31' ' ' ARG . . . -163.15 175.17 39.49 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.957 -178.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 44.6 tp -67.61 -38.79 84.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.724 0.297 . . . . 0.0 110.606 -177.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.7 -35.94 77.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.399 0.618 . . . . 0.0 110.415 176.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -71.55 -33.5 69.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.305 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.516 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 54.8 tp -64.21 -35.62 81.39 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.844 177.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.1 mmt -69.8 -45.03 68.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.919 0.39 . . . . 0.0 110.873 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.59 -44.12 67.98 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.856 -177.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.3 mt -96.42 0.85 51.06 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -174.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.54 -68.78 0.22 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.812 -178.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 58.6 tp -65.38 -41.0 94.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.663 0.268 . . . . 0.0 111.104 -176.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.0 -61.9 6.46 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.413 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' PRO . . . . . 0.488 ' O ' HG23 ' A' ' 148' ' ' VAL . 24.0 Cg_endo -64.19 -30.37 64.71 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.492 2.128 . . . . 0.0 112.728 177.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 85.4 t90 -59.66 -45.93 90.56 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.016 0.436 . . . . 0.0 110.479 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 96.7 mt -58.53 -35.36 72.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.953 179.021 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.28 0.41 32.9 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -176.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 144' ' ' PRO . 89.6 t -95.0 -55.39 6.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.893 0.378 . . . . 0.0 111.098 178.208 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -96.26 -41.3 8.74 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -173.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.554 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 44.6 mm -55.96 -53.61 61.32 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -169.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.554 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 50.9 Cg_exo -54.88 -42.73 66.13 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.853 1.702 . . . . 0.0 112.302 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -74.44 -29.59 61.55 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.476 0.655 . . . . 0.0 110.441 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.54 ' HB3' HD11 ' A' ' 159' ' ' ILE . 13.9 tp -69.1 -34.15 74.63 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.642 178.72 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 150' ' ' ILE . 79.8 mt -63.98 -43.21 97.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.375 175.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -66.11 -28.05 68.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.187 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' LYS . . . . . 0.52 ' HE2' HD12 ' A' ' 153' ' ' LEU . 37.2 mtmm -76.72 -20.6 56.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.816 0.341 . . . . 0.0 110.73 177.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 92.86 -8.02 76.58 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.916 -0.659 . . . . 0.0 114.045 170.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.4 p -67.06 -30.61 50.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 117.012 0.406 . . . . 0.0 111.642 -175.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.54 HD11 ' HB3' ' A' ' 153' ' ' LEU . 36.3 mt -67.68 153.11 9.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.518 178.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -50.84 138.32 19.01 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.081 0.467 . . . . 0.0 111.246 178.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 17.5 m80 -140.49 99.19 3.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.988 -177.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -94.88 -59.61 1.87 Allowed 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -89.17 147.24 24.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.419 174.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -126.82 -76.1 0.58 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.618 175.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 26.2 t 68.75 2.4 3.46 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.003 178.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -122.15 107.59 12.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.351 0.596 . . . . 0.0 110.149 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -89.91 75.8 7.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.62 0.724 . . . . 0.0 110.782 -174.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 98.3 mt -115.39 135.95 53.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 172.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -112.85 118.29 34.5 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.244 0.545 . . . . 0.0 112.094 -172.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 56.7 m170 -94.8 174.35 7.14 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 169.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 18.2 m80 -70.03 136.29 50.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.148 0.499 . . . . 0.0 110.518 178.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -67.54 -46.14 73.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.949 -169.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -78.27 130.77 36.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.269 0.557 . . . . 0.0 111.712 -175.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 23.0 p80 -152.6 171.67 17.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.23 -0.896 . . . . 0.0 108.851 172.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 45.6 p-80 . . . . . 0 C--O 1.247 0.945 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 175.398 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.3 mtt . . . . . 0 N--CA 1.481 1.089 0 CA-C-O 120.958 0.408 . . . . 0.0 109.983 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.87 164.35 35.59 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.294 -179.307 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.454 ' HA ' ' OG1' ' A' ' 6' ' ' THR . 38.8 t70 70.71 1.47 3.72 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.808 0.692 . . . . 0.0 111.834 176.284 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.1 -52.65 64.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.71 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.473 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -66.73 -40.57 88.42 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.281 -177.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.508 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.7 OUTLIER -66.54 -46.89 74.63 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -175.938 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -66.27 -28.0 68.37 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.044 0.45 . . . . 0.0 110.203 -179.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -67.7 -43.54 79.85 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.154 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 5' ' ' ALA . 86.2 t -63.41 -40.72 90.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.462 177.037 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 6' ' ' THR . 91.6 t -64.12 -27.29 42.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.95 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.6 m -69.12 -26.68 65.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.737 0.303 . . . . 0.0 110.832 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -94.12 -7.82 41.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.772 0.32 . . . . 0.0 111.843 176.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.448 HG12 ' HB2' ' A' ' 42' ' ' TYR . 45.6 mt -118.55 86.75 29.68 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 175.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.656 ' HD2' ' HA ' ' A' ' 38' ' ' SER . 73.2 Cg_exo -49.3 151.99 6.04 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.71 2.94 . . . . 0.0 113.878 -172.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.605 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 30.2 m -85.15 151.83 3.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.414 178.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.506 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 7.1 mp -86.81 134.57 33.54 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.316 -179.221 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -91.41 -44.15 9.31 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.064 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 m -66.13 -74.8 0.1 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.627 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.459 ' OD1' ' HG3' ' A' ' 91' ' ' PRO . 38.8 t30 45.83 43.66 10.19 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.333 176.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.59 -84.49 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.378 -176.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 167.12 172.54 34.45 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.86 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -71.0 -11.34 29.09 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 123.184 2.589 . . . . 0.0 112.464 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 mtp-105 -66.94 -48.6 68.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.616 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.497 ' HB3' HD23 ' A' ' 27' ' ' LEU . 15.0 m-20 -84.31 104.9 14.72 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.567 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 72.5 mtm180 -58.12 -51.8 68.19 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.551 ' HG2' HD22 ' A' ' 27' ' ' LEU . 1.4 pm0 -72.83 -26.28 61.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.642 0.258 . . . . 0.0 111.405 -177.059 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.551 HD22 ' HG2' ' A' ' 26' ' ' GLU . 3.9 mm? -80.29 -30.95 38.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.709 0.29 . . . . 0.0 110.653 178.029 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.43 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 60.5 t-105 -67.35 -46.83 72.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.167 177.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 90.9 t -60.74 -38.36 78.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.943 0.402 . . . . 0.0 110.445 177.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -70.55 -32.89 70.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.901 0.382 . . . . 0.0 110.161 177.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 67.0 ttt-85 -69.21 -33.16 72.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.123 177.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 90.5 mt -58.39 -42.48 87.18 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.975 174.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -59.55 -47.52 85.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.282 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -54.94 -48.37 73.23 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.945 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -61.84 -48.2 81.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.084 178.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -65.11 -32.3 73.93 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -178.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -58.96 -45.3 90.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.228 0.537 . . . . 0.0 109.994 174.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.656 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 8.3 m -70.77 -44.22 67.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.57 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.448 ' O ' HG23 ' A' ' 43' ' ' VAL . 80.1 mt -60.17 -55.35 34.86 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.25 -179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 85.9 mt -58.05 -46.52 88.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.72 -176.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -58.81 -49.03 79.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.649 -0.25 . . . . 0.0 110.786 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.448 ' HB2' HG12 ' A' ' 13' ' ' ILE . 67.6 t80 -63.06 -49.85 72.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.711 0.291 . . . . 0.0 111.106 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.623 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 93.8 t -59.49 -45.69 93.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.904 -177.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -67.29 -35.0 78.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.667 0.27 . . . . 0.0 111.109 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -60.14 -39.9 87.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.749 0.309 . . . . 0.0 110.256 173.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.443 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 4.9 m-20 -71.65 -32.44 67.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.856 177.186 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.623 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 34.0 mmtp -57.79 -43.86 85.9 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.209 0.528 . . . . 0.0 110.047 174.132 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -72.76 -21.46 61.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.933 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -91.72 2.17 56.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.361 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.7 t70 63.43 23.76 13.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.583 0.706 . . . . 0.0 110.874 178.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.443 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 16.9 t30 -125.3 66.52 1.14 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.691 0.758 . . . . 0.0 110.48 -178.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -86.27 106.45 17.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.283 -0.871 . . . . 0.0 108.882 174.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 45.9 p-90 -120.61 6.85 10.52 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -168.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 69' ' ' CYS . 13.8 p90 -162.83 154.23 17.65 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.826 -0.75 . . . . 0.0 112.157 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -138.54 124.4 19.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.003 167.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.7 tp -117.13 124.54 49.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.709 -177.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -131.55 155.56 47.27 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.841 -174.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.6 t -149.12 176.99 10.01 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.105 0.479 . . . . 0.0 110.827 -177.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -86.11 176.73 7.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.463 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 60' ' ' LYS . 41.5 mmtm -66.53 -19.94 65.9 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -174.753 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -87.36 -17.58 32.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.714 0.292 . . . . 0.0 110.408 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.13 28.63 73.17 Favored Glycine 0 C--N 1.332 0.354 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.552 -179.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.5 p -85.83 -33.1 21.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.04 0.448 . . . . 0.0 111.812 -177.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -129.18 116.1 18.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.661 -179.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -102.33 128.19 49.0 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -136.5 159.46 41.72 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.978 -176.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 172.34 -165.75 38.39 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 119.867 -1.159 . . . . 0.0 112.372 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.5 pttm -142.38 139.74 31.82 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.041 0.448 . . . . 0.0 110.624 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 54' ' ' PHE . 45.7 m -112.49 153.31 27.63 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.263 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 26.0 m-90 -117.67 123.57 46.43 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.025 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -117.96 120.56 38.21 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 177.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.9 mm -88.21 114.71 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.892 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -148.35 110.63 4.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.401 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.7 t70 66.83 62.93 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.338 175.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.3 mt 68.57 -13.12 0.33 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.143 -0.935 . . . . 0.0 113.158 173.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 78.9 mt -109.06 136.67 48.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.259 0.552 . . . . 0.0 111.869 -175.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -93.44 112.22 24.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.287 174.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -97.86 130.26 44.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.715 -0.22 . . . . 0.0 111.043 -178.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -96.97 136.1 38.02 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -126.19 123.93 39.3 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -88.82 131.3 35.14 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.144 0.497 . . . . 0.0 110.054 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.52 HG22 HG22 ' A' ' 99' ' ' VAL . 46.5 pt -131.78 151.37 35.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.602 -178.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -153.22 155.33 36.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.83 174.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 35.3 p90 -159.05 152.73 23.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.4 176.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.54 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 2.2 p30 -97.94 155.24 17.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.673 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.6 mm -106.25 91.12 5.3 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.979 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.54 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 51.4 Cg_exo -54.75 153.89 22.81 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.882 2.388 . . . . 0.0 112.373 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 43.4 mt -61.25 -24.93 34.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.179 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.2 p -88.83 13.32 12.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.049 -178.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.542 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 61.4 t80 -77.59 145.65 71.78 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 176.491 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.542 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 50.2 Cg_endo -91.45 14.25 50.44 Favored 'Cis proline' 0 C--N 1.349 0.571 0 C-N-CA 124.305 -1.123 . . . . 0.0 114.072 0.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 86.4 m -62.02 -44.65 96.25 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.02 0.438 . . . . 0.0 110.128 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 39.2 m -102.64 119.39 38.75 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.036 174.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.71 144.48 91.05 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -78.81 172.73 14.6 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 122.9 2.4 . . . . 0.0 112.868 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.611 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 19.5 mt-10 -107.75 122.18 46.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.197 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.418 ' O ' HG12 ' A' ' 115' ' ' ILE . 34.8 mm -75.55 124.38 33.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.508 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.578 ' HB2' ' HG2' ' A' ' 114' ' ' LYS . . . -109.38 129.53 55.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.928 0.394 . . . . 0.0 111.162 179.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.52 HG22 HG22 ' A' ' 82' ' ' ILE . 21.9 t -123.52 86.58 52.39 Favored Pre-proline 0 C--O 1.237 0.401 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.832 178.141 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.69 -31.36 94.7 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.289 2.659 . . . . 0.0 113.753 -173.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -68.58 -28.8 67.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.842 0.353 . . . . 0.0 110.973 -177.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 82.4 mt -97.42 13.26 30.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.666 0.269 . . . . 0.0 111.175 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.75 106.39 0.4 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.715 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 88.8 -1.15 83.26 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.974 178.198 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -93.55 -16.0 24.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.887 0.375 . . . . 0.0 110.842 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.521 ' HB ' HD21 ' A' ' 153' ' ' LEU . 3.3 t -135.88 151.34 49.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.098 -178.033 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -84.32 0.97 47.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.964 179.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -86.96 16.48 4.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.507 ' HG2' HG23 ' A' ' 106' ' ' THR . 22.8 mmt -97.01 130.79 44.28 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.952 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 5.0 m-30 -109.22 -72.99 0.7 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.189 0.519 . . . . 0.0 110.426 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -94.19 85.89 4.79 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.566 -175.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 65.73 -102.47 0.7 Allowed Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.112 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -106.66 6.6 38.34 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.192 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.611 ' HD3' ' HB2' ' A' ' 96' ' ' GLU . 84.5 mttt -86.31 124.4 32.63 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.084 0.469 . . . . 0.0 110.419 177.245 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.418 HG12 ' O ' ' A' ' 97' ' ' ILE . 37.4 pt -76.73 158.01 5.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.227 -176.543 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 25.8 p -91.94 124.04 35.75 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.604 178.132 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 89.0 mt -86.71 161.1 18.61 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.3 173.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.405 ' O ' ' HB3' ' A' ' 121' ' ' PHE . 6.1 t -69.95 153.51 43.15 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.002 0.43 . . . . 0.0 111.268 -173.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -58.13 -49.62 76.32 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.883 -177.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -68.61 -4.07 14.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.69 -176.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.405 ' HB3' ' O ' ' A' ' 118' ' ' THR . 75.5 t80 -66.13 -47.39 74.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.863 -0.153 . . . . 0.0 110.96 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.535 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 39.6 mmtm -59.65 -51.97 77.29 Favored Pre-proline 0 CA--C 1.537 0.449 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.52 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.535 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 50.0 Cg_exo -56.44 -41.4 76.57 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 121.941 1.761 . . . . 0.0 112.193 174.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 45.4 tp -67.14 -38.04 84.83 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.01 0.433 . . . . 0.0 110.673 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.401 ' O ' HG23 ' A' ' 129' ' ' VAL . 66.8 t-105 -59.07 -57.44 13.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.294 178.05 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.21 -21.7 65.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.562 -178.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 123' ' ' PRO . 48.5 ttt180 -71.54 -29.34 64.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.482 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -98.61 -39.61 8.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.503 -177.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.644 HG13 ' HA ' ' A' ' 130' ' ' PRO . 70.5 t -57.52 142.84 76.35 Favored Pre-proline 0 CA--C 1.533 0.319 0 O-C-N 123.373 0.421 . . . . 0.0 110.261 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.644 ' HA ' HG13 ' A' ' 129' ' ' VAL . 5.0 Cg_exo -79.12 -163.07 3.21 Favored 'Cis proline' 0 C--N 1.355 0.872 0 C-N-CA 125.008 -0.83 . . . . 0.0 113.838 2.088 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.605 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 96.7 mttt 72.81 -18.53 0.35 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.545 0.738 . . . . 0.0 111.611 -178.106 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' PHE . . . . . 0.417 ' H ' ' C ' ' A' ' 130' ' ' PRO . 8.8 t80 -77.01 158.51 30.55 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.131 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -159.63 -179.59 34.54 Favored Glycine 0 C--O 1.236 0.235 0 C-N-CA 119.999 -1.096 . . . . 0.0 112.84 -174.297 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.427 HD12 HD23 ' A' ' 137' ' ' LEU . 58.8 tp -64.38 -37.48 87.67 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 122.999 0.52 . . . . 0.0 111.195 -175.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.63 -40.68 75.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.523 0.678 . . . . 0.0 110.66 177.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -71.32 -35.37 71.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.968 178.248 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.427 HD23 HD12 ' A' ' 134' ' ' LEU . 50.2 tp -66.07 -37.12 85.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.167 178.51 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' MET . . . . . 0.468 ' CE ' ' HA ' ' A' ' 138' ' ' MET . 17.9 mmt -62.21 -48.18 81.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.865 0.364 . . . . 0.0 110.441 177.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.89 -49.12 49.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.086 -177.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.4 10.18 37.3 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -172.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -124.23 -67.19 0.2 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.295 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.596 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 53.7 tp -65.79 -42.51 90.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.788 -0.206 . . . . 0.0 111.038 -177.664 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.43 -61.44 6.99 Favored Glycine 0 CA--C 1.525 0.662 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.627 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' PRO . . . . . 0.431 ' O ' HG23 ' A' ' 148' ' ' VAL . 17.0 Cg_endo -59.59 -37.38 88.75 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.555 2.17 . . . . 0.0 112.799 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 68.6 t90 -61.44 -44.38 97.21 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.963 0.411 . . . . 0.0 110.248 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 94.2 mt -59.04 -36.19 74.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.007 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.0 -15.64 61.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.85 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 144' ' ' PRO . 61.4 t -93.02 -53.96 7.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.282 -178.312 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -90.75 -43.53 10.04 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -171.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.479 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.3 mm -59.51 -49.91 89.82 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -169.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.511 ' HD3' ' O ' ' A' ' 146' ' ' LEU . 50.5 Cg_exo -56.06 -30.81 80.27 Favored 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 122.105 1.87 . . . . 0.0 112.879 -178.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -87.26 -37.87 16.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 109.994 177.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.611 HD22 ' HD3' ' A' ' 156' ' ' LYS . 0.2 OUTLIER -59.24 -42.76 91.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.554 -179.865 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 72.0 mt -64.47 -39.63 86.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.018 0.437 . . . . 0.0 110.353 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -66.09 -27.31 67.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.026 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' LYS . . . . . 0.611 ' HD3' HD22 ' A' ' 153' ' ' LEU . 59.6 mtpt -63.93 -22.25 66.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.788 175.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 72.74 16.45 77.95 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.409 178.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 17.0 m -92.46 -6.18 10.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.072 0.463 . . . . 0.0 111.308 -178.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.469 HD11 HD12 ' A' ' 153' ' ' LEU . 55.6 mt -94.74 101.48 12.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.125 175.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 160' ' ' GLN . . . . . 0.491 ' HA ' ' OE1' ' A' ' 160' ' ' GLN . 6.0 tp60 -79.17 123.31 27.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 176.599 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -142.57 147.48 35.97 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -175.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.46 ' HD2' ' N ' ' A' ' 162' ' ' LYS . 4.0 mptp? -69.76 167.49 17.03 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.02 -164.88 1.62 Allowed 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.838 -172.51 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.82 -18.82 53.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 -169.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 49.3 t -71.0 -33.12 70.09 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.056 -0.403 . . . . 0.0 110.746 -177.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -90.67 18.88 5.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.769 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -62.86 147.12 51.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.974 0.416 . . . . 0.0 110.773 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 58.6 tp -130.33 122.38 27.8 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.611 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -76.96 95.13 4.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.85 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 15.2 p80 -86.82 65.39 8.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.858 0.837 . . . . 0.0 111.083 -177.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -136.73 92.06 2.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.747 174.207 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 -87.81 -39.88 14.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.344 -172.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.59 147.7 26.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.415 -177.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -83.81 -38.44 21.25 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 174.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 24.5 m80 . . . . . 0 C--O 1.247 0.929 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.498 172.564 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ptm . . . . . 0 N--CA 1.482 1.174 0 CA-C-O 120.688 0.28 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.34 86.62 6.53 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -174.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 70.34 135.15 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 O-C-N 123.953 0.783 . . . . 0.0 113.112 173.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -72.88 -27.66 62.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.374 177.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.469 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -67.63 -42.83 81.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.969 -178.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.452 ' O ' HG23 ' A' ' 10' ' ' VAL . 6.0 m -56.5 -54.52 44.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.097 -178.076 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -64.91 -31.89 73.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.091 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -64.3 -44.36 91.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.606 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 5' ' ' ALA . 66.0 t -62.86 -38.51 82.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.469 179.307 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 6' ' ' THR . 61.6 t -62.66 -33.1 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.178 179.708 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -69.92 -25.66 63.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.479 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.428 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 42.6 mt-10 -93.63 -13.07 28.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.882 0.373 . . . . 0.0 111.227 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.7 mt -113.76 87.06 11.63 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.428 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 50.9 Cg_exo -54.58 147.04 50.44 Favored 'Trans proline' 0 C--O 1.237 0.463 0 C-N-CA 123.453 2.768 . . . . 0.0 113.175 -173.234 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.48 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.7 m -72.34 161.38 4.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.192 176.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.719 HD23 ' HG3' ' A' ' 31' ' ' ARG . 10.2 mp -79.97 134.7 36.27 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.114 0.483 . . . . 0.0 111.532 -173.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.477 ' HB3' ' HG3' ' A' ' 34' ' ' GLU . 59.6 tttm -60.25 -44.08 95.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.852 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.547 HG21 HD12 ' A' ' 27' ' ' LEU . 31.7 m -129.38 130.02 45.49 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.946 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.67 ' HA ' ' HD3' ' A' ' 31' ' ' ARG . 16.8 m120 -120.43 119.63 33.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.752 0.311 . . . . 0.0 110.519 174.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -153.75 170.7 20.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.084 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.45 167.19 42.64 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.291 -178.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -72.56 3.65 4.1 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.397 2.732 . . . . 0.0 113.027 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.613 ' HA ' ' HE ' ' A' ' 23' ' ' ARG . 1.1 mmp_? -94.17 -26.24 16.77 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.308 0.575 . . . . 0.0 109.903 174.256 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -83.43 75.87 9.96 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 172.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -53.98 -41.95 68.45 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -169.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -58.25 -52.1 67.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.212 0.53 . . . . 0.0 110.911 179.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.547 HD12 HG21 ' A' ' 18' ' ' THR . 3.1 mm? -76.7 -23.51 53.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.743 -177.587 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.559 ' CH2' HG21 ' A' ' 86' ' ' ILE . 28.5 t-105 -64.29 -52.1 60.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.462 175.235 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.5 t -63.5 -33.71 63.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.084 0.468 . . . . 0.0 110.054 178.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -70.28 -42.81 71.6 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.495 178.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.719 ' HG3' HD23 ' A' ' 16' ' ' LEU . 51.5 ttp85 -64.54 -42.96 95.38 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 176.32 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -54.53 -50.01 68.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.722 -177.74 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.04 -33.13 71.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.532 0.206 . . . . 0.0 111.143 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.477 ' HG3' ' HB3' ' A' ' 17' ' ' LYS . 71.0 mm-40 -70.23 -45.63 66.12 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.286 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.565 ' HB3' HD21 ' A' ' 16' ' ' LEU . 15.3 pt-20 -75.01 -27.46 60.13 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.161 177.341 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.524 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -55.28 -44.27 75.53 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 169.445 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -63.96 -38.81 92.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.691 176.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.9 t -61.44 -40.23 93.71 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.031 -0.532 . . . . 0.0 109.711 174.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.426 ' O ' HG23 ' A' ' 43' ' ' VAL . 52.7 mt -63.31 -40.51 97.54 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.659 174.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 36' ' ' TYR . 77.4 mt -61.43 -35.56 67.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.868 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' A' ' 44' ' ' GLU . 0.5 OUTLIER -66.75 -36.33 82.19 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.115 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -68.74 -47.74 65.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.928 176.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 39' ' ' LEU . 87.4 t -62.05 -32.6 54.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.328 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.448 ' HB3' ' O ' ' A' ' 41' ' ' ARG . 28.1 tt0 -52.89 -59.21 4.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.361 176.188 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -57.21 -36.77 71.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.289 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -64.02 -43.82 94.42 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.679 176.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.516 ' HE2' ' HA ' ' A' ' 47' ' ' LYS . 7.6 mmpt? -68.52 -37.01 79.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.78 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -57.9 -35.3 70.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.98 0.419 . . . . 0.0 110.47 177.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -96.23 -2.29 46.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.091 178.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.9 t70 60.36 20.93 10.49 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.907 0.861 . . . . 0.0 110.442 -177.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -112.87 60.15 0.64 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.59 -177.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -85.9 86.15 7.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 122.045 0.926 . . . . 0.0 109.902 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -83.22 -7.37 59.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.06 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.47 ' HZ ' HD22 ' A' ' 56' ' ' LEU . 60.6 t80 -115.49 122.39 45.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.829 -173.045 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.68 124.48 38.01 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 176.185 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.47 HD22 ' HZ ' ' A' ' 54' ' ' PHE . 19.3 tp -144.94 124.95 13.53 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.772 -175.176 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -109.09 159.6 16.74 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.031 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 m -132.88 161.74 33.41 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.636 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -93.53 171.74 8.71 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 173.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -62.0 -28.3 69.48 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 -175.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.0 -23.7 48.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.791 0.329 . . . . 0.0 110.607 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.21 7.88 84.96 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.954 -0.641 . . . . 0.0 111.584 -172.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.9 p -83.24 -14.85 52.34 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -174.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -134.11 130.54 37.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.064 0.459 . . . . 0.0 111.029 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 46.0 m95 -118.65 126.29 51.62 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.342 175.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -139.82 140.3 36.57 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.088 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -175.68 -160.35 23.16 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.216 -0.993 . . . . 0.0 112.554 -178.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.537 ' HG2' ' HA ' ' A' ' 81' ' ' ASP . 96.7 mttt -144.19 154.93 43.64 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.956 0.408 . . . . 0.0 110.769 -176.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 62.6 m -112.35 132.13 55.16 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.795 175.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.512 ' CD1' ' HG2' ' A' ' 79' ' ' GLU . 3.2 m-90 -107.58 122.59 46.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.213 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -130.45 120.03 23.57 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.058 0.456 . . . . 0.0 109.823 172.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.445 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.7 mp -98.53 117.29 43.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.639 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.441 ' HB3' ' HE2' ' A' ' 78' ' ' TYR . 39.3 t60 -139.06 117.97 12.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.99 -176.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 60.34 52.21 4.95 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.812 0.695 . . . . 0.0 111.037 176.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.0 mt 70.62 1.96 3.91 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.631 176.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.427 HD23 ' HG3' ' A' ' 164' ' ' LYS . 63.1 mt -111.08 128.71 55.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.088 0.471 . . . . 0.0 111.512 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -93.24 107.22 19.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.424 174.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.441 ' HE2' ' HB3' ' A' ' 73' ' ' HIS . 77.8 m-85 -89.93 123.37 33.8 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.512 ' HG2' ' CD1' ' A' ' 70' ' ' TRP . 33.1 mt-10 -111.08 134.92 52.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.809 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -132.93 117.72 18.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.537 ' HA ' ' HG2' ' A' ' 68' ' ' LYS . 5.7 p-10 -87.84 136.91 32.75 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.156 0.503 . . . . 0.0 111.031 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.499 HG22 ' HB ' ' A' ' 99' ' ' VAL . 37.0 pt -136.22 149.66 27.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.486 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.48 153.04 37.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.351 0.596 . . . . 0.0 110.938 173.488 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -161.7 158.2 25.58 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.109 177.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -107.16 173.29 6.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.143 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.559 HG21 ' CH2' ' A' ' 28' ' ' TRP . 50.4 mm -111.81 89.22 10.92 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.922 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 32.3 Cg_endo -63.89 162.61 28.18 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.446 2.097 . . . . 0.0 111.905 177.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.439 ' N ' HD12 ' A' ' 88' ' ' ILE . 3.0 mp -61.97 -23.41 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.271 -177.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.545 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 12.1 p -68.36 -18.74 64.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.873 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.597 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 62.8 t80 -77.02 141.32 67.46 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.597 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 83.7 Cg_endo -95.44 11.39 44.44 Favored 'Cis proline' 0 N--CA 1.458 -0.595 0 C-N-CA 124.454 -1.061 . . . . 0.0 113.749 2.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 33.3 m -60.77 -42.17 96.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.428 0.632 . . . . 0.0 110.18 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.545 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 31.9 m -121.7 125.98 47.88 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.464 175.251 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.68 144.0 98.75 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.605 -0.271 . . . . 0.0 110.713 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.414 ' HD3' ' CD1' ' A' ' 90' ' ' TYR . 82.6 Cg_endo -82.0 150.18 15.9 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.65 2.234 . . . . 0.0 112.135 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -79.94 100.35 8.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.911 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.541 ' HB ' HD11 ' A' ' 115' ' ' ILE . 56.6 mt -67.38 130.75 32.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.18 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -105.19 137.47 42.91 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.947 0.403 . . . . 0.0 110.711 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.499 ' HB ' HG22 ' A' ' 82' ' ' ILE . 3.8 p -128.8 88.09 52.91 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-O 121.478 0.656 . . . . 0.0 110.431 177.201 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 99' ' ' VAL . 16.1 Cg_endo -56.29 -30.47 80.69 Favored 'Trans proline' 0 CA--C 1.529 0.255 0 C-N-CA 123.258 2.638 . . . . 0.0 113.496 -174.201 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -67.79 -40.4 83.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.906 0.384 . . . . 0.0 111.183 -179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.486 HD23 ' HG3' ' A' ' 105' ' ' LYS . 87.7 mt -85.99 5.47 33.16 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -174.276 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.17 -17.12 62.55 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.081 0.467 . . . . 0.0 110.673 -176.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -128.43 11.54 6.39 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.125 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.486 ' HG3' HD23 ' A' ' 102' ' ' LEU . 75.3 mmtt -95.63 -53.16 3.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.261 0.553 . . . . 0.0 109.627 179.095 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.539 ' HB ' HD13 ' A' ' 153' ' ' LEU . 13.3 t -113.23 146.35 39.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.529 -176.41 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -95.44 14.42 22.68 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.217 0.532 . . . . 0.0 110.782 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.442 ' HD3' ' OG1' ' A' ' 106' ' ' THR . 26.2 mtpt -101.18 22.33 12.55 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.686 -177.589 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.425 ' HG2' HG23 ' A' ' 106' ' ' THR . 25.0 mmt -100.66 163.3 12.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.047 -179.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.692 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 45.2 m-85 -91.86 178.02 6.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.745 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 60.3 mtp85 -81.23 109.31 15.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.34 -177.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 116.7 -134.59 11.42 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -176.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -118.48 70.22 0.32 Allowed Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 177.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.692 ' HB2' ' HB2' ' A' ' 110' ' ' TYR . 42.1 mttm -131.89 122.76 26.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.823 -0.189 . . . . 0.0 111.197 -172.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.541 HD11 ' HB ' ' A' ' 97' ' ' ILE . 46.2 pt -113.65 143.71 22.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 172.364 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.541 ' HB2' ' HE2' ' A' ' 110' ' ' TYR . 49.4 t -119.44 125.86 49.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.777 0.322 . . . . 0.0 110.206 -179.594 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.565 HD13 ' HA3' ' A' ' 141' ' ' GLY . 47.5 mt -77.65 -80.4 0.11 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.198 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.554 ' OG1' ' HB2' ' A' ' 121' ' ' PHE . 24.0 p -141.85 156.75 45.53 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.67 -43.0 77.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.902 0.382 . . . . 0.0 110.613 -177.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.442 ' C ' ' HD2' ' A' ' 123' ' ' PRO . 5.9 p80 -76.63 -5.54 48.23 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.56 -176.493 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.554 ' HB2' ' OG1' ' A' ' 118' ' ' THR . 56.4 t80 -71.22 -34.61 70.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.077 0.465 . . . . 0.0 109.868 176.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.639 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 16.6 mtpp -60.56 -52.28 73.86 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.787 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.639 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 31.6 Cg_exo -60.2 -41.25 52.73 Favored 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 121.769 1.646 . . . . 0.0 112.113 172.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 52.1 tp -61.31 -44.0 97.93 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.97 -177.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.463 ' O ' HG23 ' A' ' 129' ' ' VAL . 50.4 t-105 -61.42 -57.16 13.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.319 179.274 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.01 -29.43 69.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.954 -0.567 . . . . 0.0 112.037 -176.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -66.01 -43.07 88.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.507 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.525 ' HB2' ' CE2' ' A' ' 132' ' ' PHE . 55.5 m-80 -97.41 -0.11 46.82 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -168.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 125' ' ' TRP . 97.7 t -55.67 136.19 71.37 Favored Pre-proline 0 N--CA 1.466 0.346 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 174.466 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.487 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 70.3 Cg_endo -97.11 -142.25 0.14 OUTLIER 'Cis proline' 0 C--N 1.352 0.712 0 C-N-CA 124.73 -0.946 . . . . 0.0 113.589 4.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.487 ' H ' ' HB2' ' A' ' 130' ' ' PRO . 35.8 mtmm 75.53 1.4 3.61 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.875 0.87 . . . . 0.0 111.119 -176.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' PHE . . . . . 0.525 ' CE2' ' HB2' ' A' ' 128' ' ' ASN . 11.3 m-85 -79.95 160.39 25.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.675 175.134 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -166.01 170.41 40.71 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 -178.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 33.4 tp -59.57 -35.23 73.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.952 0.376 . . . . 0.0 111.306 -174.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.05 -41.31 83.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.06 0.457 . . . . 0.0 110.969 177.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -71.75 -37.1 70.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.506 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 63.7 tp -65.53 -46.53 79.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.245 -178.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 24.2 mmt -67.45 -39.61 85.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.295 -178.137 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.49 -47.53 60.08 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -176.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.8 mt -83.45 -16.44 45.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.314 -175.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.565 ' HA3' HD13 ' A' ' 117' ' ' LEU . . . -112.32 -74.88 0.71 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.316 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 40.6 tp -61.02 -41.96 97.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.77 -62.87 5.77 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 121.074 -0.584 . . . . 0.0 113.423 -177.251 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -66.2 -27.42 48.74 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.285 1.99 . . . . 0.0 112.285 178.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 59.1 t90 -63.52 -52.56 60.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.284 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 91.2 mt -61.62 -32.8 72.96 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.623 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.13 -15.78 63.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.484 -178.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 92.5 t -106.58 -45.23 7.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.792 0.33 . . . . 0.0 110.727 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 23.1 tp10 -67.53 -52.57 37.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.74 -175.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.479 ' O ' HG13 ' A' ' 154' ' ' ILE . 46.3 mm -55.92 -54.35 53.12 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -172.573 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 17.4 Cg_endo -58.35 -39.56 83.15 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 121.84 1.694 . . . . 0.0 112.257 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -68.23 -38.3 81.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.272 0.558 . . . . 0.0 110.246 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.601 HD12 ' HD3' ' A' ' 156' ' ' LYS . 31.1 tp -70.14 -36.03 74.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.948 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 150' ' ' ILE . 77.2 mt -64.25 -41.93 93.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.991 0.424 . . . . 0.0 110.33 176.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -67.1 -13.93 62.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.545 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' LYS . . . . . 0.601 ' HD3' HD12 ' A' ' 153' ' ' LEU . 21.4 mtpp -69.17 -16.93 63.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.687 0.279 . . . . 0.0 110.939 174.098 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 81.0 7.49 88.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.366 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' VAL . . . . . 0.714 HG23 HG13 ' A' ' 159' ' ' ILE . 27.7 m -88.31 -15.39 9.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.155 0.502 . . . . 0.0 110.437 178.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.714 HG13 HG23 ' A' ' 158' ' ' VAL . 56.8 mt -127.2 152.11 34.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.562 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 75.32 80.26 0.1 Allowed 'General case' 0 N--CA 1.461 0.122 0 O-C-N 124.05 0.844 . . . . 0.0 111.092 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 34.0 p-80 -81.17 -38.91 26.33 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.537 175.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.659 ' HG2' ' OE1' ' A' ' 163' ' ' GLU . 16.6 ttpp 179.47 162.5 0.88 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.696 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.659 ' OE1' ' HG2' ' A' ' 162' ' ' LYS . 0.0 OUTLIER -75.86 -175.75 3.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.078 0.466 . . . . 0.0 111.596 -176.583 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.469 ' NZ ' ' HB3' ' A' ' 164' ' ' LYS . 7.7 mtpm? -79.45 -29.47 41.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.768 -174.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 2.3 p -89.17 -179.22 5.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.993 0.425 . . . . 0.0 111.926 -174.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -110.42 -41.4 4.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.097 -178.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -137.35 107.28 6.29 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.477 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 3.1 pp -97.06 -13.64 22.1 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.163 -179.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -78.13 166.65 22.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.484 0.659 . . . . 0.0 112.174 -176.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 -94.79 -179.36 4.83 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.377 -177.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -87.63 -48.54 7.81 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -90.08 95.61 10.29 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -79.35 85.64 5.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.384 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -81.68 -24.65 36.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.797 178.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 82.8 t60 . . . . . 0 C--O 1.247 0.923 0 CA-C-O 118.301 -0.857 . . . . 0.0 109.291 174.554 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 120.64 0.257 . . . . 0.0 111.471 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.0 107.74 18.88 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -170.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 53.78 34.71 19.72 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.681 171.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.448 ' HA ' ' HG3' ' A' ' 7' ' ' ARG . 11.0 pt-20 -64.55 -28.08 69.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.771 179.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.444 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -65.55 -48.36 72.72 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.988 176.153 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.7 m -59.18 -49.57 77.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.331 -179.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.45 ' HD3' ' N ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -68.9 -23.63 64.21 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.533 -177.875 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' A' ' 8' ' ' ARG . 10.2 ttp180 -71.92 -39.13 69.71 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.835 0.35 . . . . 0.0 110.188 177.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 5' ' ' ALA . 95.0 t -61.56 -45.2 99.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.591 177.745 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.9 t -67.17 -33.5 63.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.024 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -73.37 -41.76 63.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.39 -175.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -87.78 -0.76 57.37 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -175.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.427 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 57.8 mt -115.06 89.07 18.75 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 173.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.2 Cg_endo -49.99 151.22 8.92 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.951 3.101 . . . . 0.0 113.904 -172.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.7 m -83.39 157.83 3.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.744 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.428 ' N ' HD12 ' A' ' 16' ' ' LEU . 6.2 mp -100.48 147.63 25.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.509 -177.138 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -83.07 -39.61 20.96 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 175.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.9 m -87.59 121.4 29.97 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.738 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -145.72 120.65 9.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.784 172.335 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -159.07 -55.17 0.06 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.17 -178.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 121.82 -169.19 14.64 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.721 -0.752 . . . . 0.0 111.94 177.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -72.75 5.13 3.08 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.102 2.535 . . . . 0.0 112.04 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -74.23 -30.97 62.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.184 178.67 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.562 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 1.4 t0 -120.38 104.39 9.98 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.482 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 79.1 mtp180 -61.83 -40.92 96.98 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -170.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -66.09 -43.51 87.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.146 0.498 . . . . 0.0 110.244 179.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.562 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 3.8 mm? -74.05 -23.53 59.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.668 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 46.5 t-105 -63.65 -39.05 93.36 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.452 174.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.415 HG12 ' HE3' ' A' ' 33' ' ' LYS . 60.0 t -64.5 -41.99 93.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.008 175.267 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 64.4 mm-40 -59.17 -44.99 92.17 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.522 175.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.522 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 25.1 tpt180 -60.3 -44.71 95.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.546 178.752 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 1.4 mm? -58.41 -49.29 77.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.061 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 15.2 ptpt -70.76 -38.07 73.45 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.882 -175.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -66.95 -43.3 83.5 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.363 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.579 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 11.4 tp10 -68.88 -30.54 69.07 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.229 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.428 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.2 t80 -64.31 -43.48 94.54 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -60.14 -43.44 95.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.316 0.579 . . . . 0.0 109.858 174.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.424 ' HB3' ' O ' ' A' ' 35' ' ' GLU . 16.9 t -56.38 -46.57 80.04 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.848 175.493 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.651 HD23 ' HB2' ' A' ' 135' ' ' ALA . 82.2 mt -61.6 -55.34 31.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.913 178.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 36' ' ' TYR . 89.7 mt -52.22 -43.78 39.91 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.098 -178.022 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -45.28 91.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.86 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -71.3 -42.43 68.66 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.049 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.507 HG12 ' HE3' ' A' ' 47' ' ' LYS . 88.8 t -61.17 -44.31 98.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.767 0.317 . . . . 0.0 110.385 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.3 -38.6 85.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.626 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -57.65 -40.48 79.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.45 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.525 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 96.1 m-20 -62.24 -44.65 96.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.818 0.342 . . . . 0.0 110.487 177.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.507 ' HE3' HG12 ' A' ' 43' ' ' VAL . 89.4 mttt -64.64 -37.36 87.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.107 0.479 . . . . 0.0 110.647 178.39 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -70.68 -19.94 62.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.018 178.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -97.23 -1.38 44.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.287 175.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 65.27 30.69 11.1 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.994 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 8.2 t30 -131.52 93.52 3.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.925 0.393 . . . . 0.0 111.016 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -99.35 110.33 22.84 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 176.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 51.8 p-90 -124.24 -0.12 8.32 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -172.28 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.439 ' HA ' ' HA ' ' A' ' 69' ' ' CYS . 11.0 p90 -161.14 141.49 11.05 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.382 177.567 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -135.12 129.81 34.48 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 174.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.4 tp -147.23 126.52 13.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.931 -168.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -111.74 163.51 14.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.798 0.332 . . . . 0.0 110.28 176.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.458 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 10.9 p -125.41 157.34 37.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.109 -178.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -68.92 167.94 14.68 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.75 171.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -70.24 -19.15 63.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.393 0.616 . . . . 0.0 109.37 173.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -72.46 -32.94 66.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.16 173.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.8 8.85 84.91 Favored Glycine 0 C--N 1.333 0.411 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.079 -174.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.0 p -89.56 -30.21 18.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.028 0.442 . . . . 0.0 111.308 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 64' ' ' ARG . 65.9 mtt180 -114.77 133.8 55.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.58 179.066 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.458 ' CD2' ' HB3' ' A' ' 58' ' ' SER . 49.9 m95 -124.12 126.65 46.55 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.004 175.341 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -136.04 148.23 48.27 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.036 -174.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.89 -144.18 8.36 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.183 -0.767 . . . . 0.0 111.183 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.3 ptpp? -159.77 150.69 19.33 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 117.037 0.419 . . . . 0.0 110.959 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 54' ' ' PHE . 25.0 p -116.06 147.67 41.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.379 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.566 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 29.5 m-90 -115.15 129.16 56.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.351 179.202 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -118.53 124.21 46.98 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.3 mm -86.0 120.2 35.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.155 178.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -124.28 108.42 12.21 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.732 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.3 t0 64.44 -85.02 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.197 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 75' ' ' LEU . 2.3 mm? -132.64 6.61 4.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.751 0.31 . . . . 0.0 111.218 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.8 mp -112.38 147.25 36.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.17 0.51 . . . . 0.0 111.21 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -116.54 98.19 6.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.578 -177.416 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.527 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 74.8 m-85 -93.14 133.22 36.55 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.301 -175.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.566 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 0.8 OUTLIER -110.28 136.54 49.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.409 0.623 . . . . 0.0 110.861 175.567 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.485 ' O ' HG23 ' A' ' 82' ' ' ILE . 91.4 m-85 -122.12 117.02 25.27 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.347 175.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.85 117.65 9.25 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.485 HG23 ' O ' ' A' ' 80' ' ' PHE . 36.8 pt -118.51 161.64 17.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.475 0.655 . . . . 0.0 111.855 -171.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -165.42 161.83 19.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.007 175.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.597 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 55.6 p90 -162.64 167.16 23.62 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 123.182 0.301 . . . . 0.0 110.339 173.057 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -119.02 158.42 25.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.404 -178.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.1 mm -106.93 90.4 5.27 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.828 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -60.14 160.95 20.86 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.579 2.186 . . . . 0.0 112.087 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 27.2 mt -73.84 -5.2 6.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.475 0.655 . . . . 0.0 110.727 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.83 8.4 17.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.291 176.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 91' ' ' PRO . 76.3 t80 -77.64 142.0 65.58 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 174.751 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.404 ' HA ' ' HA ' ' A' ' 90' ' ' TYR . 98.1 Cg_endo -97.31 16.72 32.57 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.229 -1.155 . . . . 0.0 113.043 -1.134 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.2 m -59.56 -37.81 79.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.463 0.649 . . . . 0.0 110.453 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.9 m -122.66 142.26 50.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.606 176.259 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.81 144.8 96.32 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.823 178.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.0 144.7 99.44 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.87 2.38 . . . . 0.0 112.364 177.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.23 104.54 14.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.517 -176.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.597 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 58.8 mt -72.7 131.4 34.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.424 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.461 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -92.62 -74.81 0.51 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.103 -173.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.455 HG22 HG22 ' A' ' 82' ' ' ILE . 17.7 t 61.49 82.38 0.22 Allowed Pre-proline 0 N--CA 1.466 0.369 0 CA-C-O 121.249 0.547 . . . . 0.0 110.233 -174.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.71 -14.51 42.03 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 123.263 2.642 . . . . 0.0 113.74 -170.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -79.36 -31.41 42.94 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.718 0.294 . . . . 0.0 111.12 -177.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.7 mt -83.5 -7.67 59.49 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.726 -174.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -61.81 124.0 19.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.735 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 89.97 -8.3 80.08 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.552 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -101.08 -55.28 2.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.91 0.386 . . . . 0.0 110.259 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.1 t -87.88 150.75 23.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.84 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -98.34 4.08 48.61 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.853 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -95.07 20.61 8.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.514 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 54.1 mtt -111.6 142.52 43.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.211 175.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -126.54 154.55 43.68 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.618 ' HA ' ' HE ' ' A' ' 111' ' ' ARG . 2.5 tpm_? 72.38 -50.18 0.7 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.91 0.757 . . . . 0.0 111.059 -176.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 171.45 -109.24 0.31 Allowed Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 178.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLY . . . . . 0.461 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . -86.74 60.61 4.46 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.434 177.523 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -147.1 116.73 7.09 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 177.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 39.7 pt -75.92 153.86 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.002 0.43 . . . . 0.0 111.202 -177.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 27.4 t -105.1 123.76 48.37 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.044 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.9 mt -71.58 161.86 30.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.261 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.3 p -67.88 159.74 29.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.025 0.441 . . . . 0.0 111.568 -176.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -61.51 -24.94 66.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.335 -0.848 . . . . 0.0 112.125 -173.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -93.39 -37.29 12.06 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.989 -0.285 . . . . 0.0 111.18 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -71.94 -35.84 69.73 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 -173.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.423 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 63.2 tttm -57.97 -52.28 75.62 Favored Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -177.064 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.423 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 56.6 Cg_endo -72.23 -25.44 18.81 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 121.826 1.684 . . . . 0.0 112.396 175.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 53.1 tp -62.44 -38.18 88.77 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.686 178.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.467 ' O ' HG23 ' A' ' 129' ' ' VAL . 57.1 t-105 -54.53 -55.44 29.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.941 0.401 . . . . 0.0 110.557 177.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -71.52 -14.19 62.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.163 -177.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.436 ' HD3' ' O ' ' A' ' 127' ' ' ARG . 3.3 tmt_? -80.54 -28.24 37.37 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -88.14 -39.14 14.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.572 -177.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.482 HG13 ' HA ' ' A' ' 130' ' ' PRO . 95.6 t -49.67 135.53 19.12 Favored Pre-proline 0 N--CA 1.472 0.653 0 O-C-N 123.512 0.508 . . . . 0.0 111.198 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.482 ' HA ' HG13 ' A' ' 129' ' ' VAL . 59.7 Cg_endo -86.51 -146.61 0.32 Allowed 'Cis proline' 0 C--N 1.353 0.77 0 C-N-CA 124.425 -1.073 . . . . 0.0 113.48 5.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 42.9 mmtm 72.89 -37.61 0.39 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.32 0.648 . . . . 0.0 112.035 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.97 158.05 26.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.007 0.432 . . . . 0.0 111.215 -178.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.522 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -141.66 175.16 22.65 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.753 -175.18 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.42 ' H ' ' CD ' ' A' ' 35' ' ' GLU . 53.0 tp -72.29 -39.7 68.1 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.724 0.409 . . . . 0.0 111.33 -174.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.651 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -60.72 -30.82 70.21 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.481 0.657 . . . . 0.0 110.444 177.703 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -67.68 -32.98 74.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.055 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.422 ' HB2' ' CZ3' ' A' ' 125' ' ' TRP . 59.4 tp -68.6 -36.72 79.07 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.914 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 59.5 mtt -65.73 -42.01 91.52 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.309 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -77.82 -50.32 12.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.227 -177.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.7 mt -93.62 -6.14 47.16 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -171.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -117.02 -67.56 0.38 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.263 -0.97 . . . . 0.0 112.753 -177.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.421 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 58.8 tp -60.33 -48.93 79.63 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 122.154 0.182 . . . . 0.0 111.482 -175.43 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.74 -61.64 6.87 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 121.256 -0.497 . . . . 0.0 113.143 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' PRO . . . . . 0.422 ' O ' HG23 ' A' ' 148' ' ' VAL . 50.8 Cg_exo -56.08 -37.71 95.92 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.629 2.219 . . . . 0.0 112.797 177.683 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 64.8 t90 -61.99 -46.69 88.11 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.914 0.388 . . . . 0.0 110.569 -179.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 97.2 mt -61.7 -37.69 85.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.187 0.518 . . . . 0.0 110.647 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.13 -9.72 56.5 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.798 -178.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 144' ' ' PRO . 85.0 t -70.53 -55.98 12.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.648 -179.016 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -141.81 11.16 2.03 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -175.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.494 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 29.7 mm -69.3 -50.75 19.12 Favored Pre-proline 0 CA--C 1.535 0.404 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.502 174.018 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 15.0 Cg_endo -59.12 -31.23 95.09 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.763 1.642 . . . . 0.0 111.189 171.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 30.0 t70 -66.39 -45.0 81.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.402 178.444 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.598 ' HA ' ' HD3' ' A' ' 156' ' ' LYS . 41.0 tp -56.01 -38.81 71.0 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.518 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 62.7 mt -68.19 -44.41 84.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.669 177.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -69.98 -23.07 63.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.356 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' LYS . . . . . 0.598 ' HD3' ' HA ' ' A' ' 153' ' ' LEU . 28.8 mtpp -65.67 -18.19 65.14 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.849 176.335 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 85.8 26.1 36.08 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.67 -177.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 54.6 t -86.52 -43.85 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.976 0.417 . . . . 0.0 110.14 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 60.6 mt -107.73 114.53 46.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.48 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -113.61 122.17 46.4 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 177.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -133.16 132.72 41.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.802 0.334 . . . . 0.0 110.799 -173.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -77.21 -82.41 0.08 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.733 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 82.0 mm-40 -113.1 170.83 7.93 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.352 -175.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -93.9 -41.41 9.62 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 173.027 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 69.6 m 70.13 -13.21 0.45 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 114.619 -1.173 . . . . 0.0 112.526 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -101.43 143.79 31.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.179 0.514 . . . . 0.0 110.607 177.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -104.11 132.91 49.88 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.504 177.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 45.1 tp -71.7 103.16 2.99 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 173.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -61.46 144.88 53.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.254 -170.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -108.14 101.53 10.75 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.916 -174.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -122.49 121.54 36.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.475 -0.784 . . . . 0.0 108.97 177.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -85.66 149.0 25.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.535 0.683 . . . . 0.0 112.38 -172.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -84.44 123.08 29.85 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.369 171.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -54.11 -38.87 65.86 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 -171.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 44.7 t60 . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.463 -0.779 . . . . 0.0 109.442 175.769 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 121.009 0.433 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.83 40.55 1.0 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.523 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -64.06 124.91 22.84 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.724 -179.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -67.73 -30.92 70.53 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.707 -178.322 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.409 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -54.67 -48.91 71.79 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.85 0.357 . . . . 0.0 110.814 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.494 ' O ' HG23 ' A' ' 10' ' ' VAL . 28.1 m -60.54 -53.84 52.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.433 -179.297 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.419 ' HD3' ' N ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -64.65 -28.9 69.92 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.807 0.337 . . . . 0.0 111.325 -176.063 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.419 ' N ' ' HD3' ' A' ' 7' ' ' ARG . 54.3 mtp180 -70.5 -36.56 73.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.679 0.276 . . . . 0.0 110.912 178.133 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 5' ' ' ALA . 99.5 t -72.88 -44.08 58.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.389 176.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 6' ' ' THR . 44.4 t -68.0 -14.36 18.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.196 0.522 . . . . 0.0 110.711 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.2 t -69.09 -34.33 74.94 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.127 174.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -96.65 -21.29 17.71 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.985 0.421 . . . . 0.0 110.369 178.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.3 mt -117.42 81.81 14.4 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 174.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -76.81 174.25 13.16 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 123.142 2.561 . . . . 0.0 113.852 -168.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.1 m -79.66 152.3 4.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.308 176.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.45 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 9.4 mp -86.9 134.66 33.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.771 -177.189 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.528 ' N ' ' HD2' ' A' ' 17' ' ' LYS . 12.2 mptt -87.2 -31.61 20.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.049 0.452 . . . . 0.0 110.238 -178.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.453 ' O ' ' HG3' ' A' ' 31' ' ' ARG . 11.6 m -93.64 105.76 17.78 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.603 176.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -125.24 133.36 52.73 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.803 0.335 . . . . 0.0 111.27 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -165.63 167.62 17.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.088 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.76 170.67 23.18 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.685 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -61.85 -10.62 17.86 Favored 'Trans proline' 0 N--CA 1.476 0.465 0 C-N-CA 123.232 2.621 . . . . 0.0 112.999 -177.249 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.856 ' HA ' ' HE ' ' A' ' 23' ' ' ARG . 0.4 OUTLIER -69.24 -27.02 65.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.953 177.936 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -112.91 97.52 6.59 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 29' ' ' VAL . 37.3 mtt180 -66.8 -29.68 69.69 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -176.098 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -62.68 -53.36 55.58 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.086 0.47 . . . . 0.0 110.195 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 27' ' ' LEU . 4.3 mm? -75.62 -26.74 58.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.829 178.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.473 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 74.7 t-105 -64.42 -46.5 82.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.768 177.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 25' ' ' ARG . 68.1 t -60.03 -40.9 84.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 120.743 0.306 . . . . 0.0 110.455 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -67.42 -42.69 82.81 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.67 177.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 18' ' ' THR . 38.6 ttt-85 -65.18 -34.45 78.4 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.532 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -63.56 -43.92 95.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.567 -178.237 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.5 ' NZ ' ' HB3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -74.32 -26.92 60.46 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.933 179.778 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -71.57 -35.91 70.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.141 0.496 . . . . 0.0 109.858 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.427 ' CD ' ' H ' ' A' ' 134' ' ' LEU . 10.1 tp10 -64.42 -40.73 96.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.395 174.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.41 ' HD2' ' HA ' ' A' ' 33' ' ' LYS . 5.3 m-85 -55.03 -40.39 70.16 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.913 175.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 71.8 mm-40 -58.71 -49.26 78.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.208 0.528 . . . . 0.0 110.261 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.6 t -62.16 -39.56 93.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.656 179.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.536 HD23 ' HB2' ' A' ' 135' ' ' ALA . 94.4 mt -65.09 -54.94 22.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.155 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 83.6 mt -54.13 -45.32 65.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.061 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -43.99 97.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.035 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -65.12 -43.69 91.16 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.745 0.307 . . . . 0.0 110.906 -179.042 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 39' ' ' LEU . 55.3 t -73.39 -43.0 56.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.475 -176.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.63 -29.01 64.18 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -178.443 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -65.63 -31.38 72.38 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 174.465 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.585 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 13.1 m-80 -71.49 -39.34 70.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.319 175.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.401 ' NZ ' HG12 ' A' ' 43' ' ' VAL . 59.0 mttp -62.6 -33.28 74.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.049 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -66.82 -14.8 63.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 111.07 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -106.04 5.03 29.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.326 175.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.8 t70 63.33 27.7 15.44 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.99 0.9 . . . . 0.0 109.985 -176.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.585 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 11.9 t30 -122.07 72.06 1.02 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.692 -175.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -92.56 88.99 6.54 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 9.6 p-90 -99.89 -8.15 24.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.498 -0.773 . . . . 0.0 112.363 -170.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -161.43 144.88 12.68 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.707 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 55' ' ' ARG . 37.2 mtm180 -143.16 124.31 14.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.066 171.511 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.494 HD21 ' HB3' ' A' ' 65' ' ' TRP . 5.1 tt -131.05 127.81 39.0 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.439 -169.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -121.41 177.06 5.35 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.121 -175.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.448 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 78.6 p -146.26 174.72 11.09 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.518 ' OD1' ' HB2' ' A' ' 61' ' ' GLU . 4.8 p30 -73.12 166.57 22.86 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 167.659 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.681 ' HA ' ' HE3' ' A' ' 60' ' ' LYS . 0.3 OUTLIER -76.12 -5.57 47.25 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.026 0.441 . . . . 0.0 111.264 -175.31 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.518 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 6.7 mm-40 -78.89 -32.68 45.93 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 171.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.34 13.39 83.63 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.662 177.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -92.26 -5.53 52.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.861 0.363 . . . . 0.0 111.791 -177.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.473 ' HB3' HD21 ' A' ' 59' ' ' ASN . 15.3 ttm180 -151.2 128.01 10.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.016 177.61 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.494 ' HB3' HD21 ' A' ' 56' ' ' LEU . 46.6 m95 -115.37 149.57 37.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.368 -176.104 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -156.11 140.65 16.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.473 -178.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.488 ' HA3' ' HA ' ' A' ' 56' ' ' LEU . . . -175.41 -174.91 42.4 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 119.897 -1.144 . . . . 0.0 112.637 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.7 mttp -117.8 145.25 44.66 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.9 0.381 . . . . 0.0 110.735 -178.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 48.5 t -130.75 127.5 38.89 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.528 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' TRP . . . . . 0.565 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 7.8 p90 -130.28 132.77 46.07 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.66 -178.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -118.29 143.71 46.38 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 42.8 mm -105.24 116.15 48.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 120.842 0.353 . . . . 0.0 110.829 -175.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -127.47 106.6 9.3 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 5.1 m-20 52.22 58.49 5.37 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.918 0.761 . . . . 0.0 111.247 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.2 mm? 73.34 -22.46 0.23 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.44 176.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.22 118.07 14.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.713 0.292 . . . . 0.0 110.404 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -105.96 135.7 46.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.204 178.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.418 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 7.4 p90 -143.74 114.73 7.81 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.688 179.324 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.565 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 0.6 OUTLIER -106.09 136.43 45.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.559 177.914 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -117.04 139.19 51.0 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.469 178.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -93.15 115.62 28.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.175 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 pt -127.13 152.34 35.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.483 -178.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.11 161.71 42.22 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.992 0.425 . . . . 0.0 110.303 176.395 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.575 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 48.0 p90 -160.09 152.06 20.34 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.44 -179.47 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.524 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 7.2 p-10 -100.8 167.91 9.99 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.978 0.418 . . . . 0.0 110.14 178.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.1 mm -109.2 89.5 6.99 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.399 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.524 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 37.1 Cg_exo -56.55 164.11 6.05 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 123.095 2.53 . . . . 0.0 112.529 -178.513 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 35.0 mt -74.36 -10.96 14.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.365 0.603 . . . . 0.0 110.226 -178.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.1 p -80.91 -6.82 59.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.948 176.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.515 ' CG ' ' HA ' ' A' ' 91' ' ' PRO . 51.2 t80 -75.86 144.15 75.78 Favored Pre-proline 0 C--N 1.328 -0.352 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.515 ' HA ' ' CG ' ' A' ' 90' ' ' TYR . 24.2 Cg_endo -94.04 11.82 49.31 Favored 'Cis proline' 0 N--CA 1.458 -0.614 0 C-N-CA 124.244 -1.148 . . . . 0.0 113.937 2.545 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 19.1 m -65.04 -36.11 83.32 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.175 0.512 . . . . 0.0 110.355 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 49.9 m -113.43 140.56 47.97 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.739 175.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.52 146.24 95.99 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.752 179.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.53 153.91 76.27 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.646 2.231 . . . . 0.0 112.5 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -81.66 90.74 6.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.956 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.575 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 65.3 mt -74.9 119.84 23.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.263 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -107.06 130.75 54.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.787 0.327 . . . . 0.0 111.505 -176.465 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 19.7 t -130.55 77.27 76.16 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 173.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -66.25 -21.79 54.34 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 123.073 2.515 . . . . 0.0 112.538 -176.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -57.88 -33.33 68.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.894 0.378 . . . . 0.0 111.272 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 87.5 mt -86.72 1.97 50.23 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -173.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.18 -16.14 63.87 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.39 0.614 . . . . 0.0 110.772 -176.622 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -131.21 26.3 3.96 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.631 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -117.88 -59.33 1.92 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.123 0.487 . . . . 0.0 109.876 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.3 t -108.27 -164.74 0.98 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.438 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -55.43 148.64 14.85 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.14 0.275 . . . . 0.0 110.308 178.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.451 ' HB2' ' HE3' ' A' ' 108' ' ' LYS . 18.9 ptmt -69.35 150.75 46.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.348 0.594 . . . . 0.0 111.312 -173.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 25.3 mmt -88.83 163.55 15.61 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.275 176.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -70.5 -54.46 12.13 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.283 -176.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -161.93 129.19 3.91 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.203 -177.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 85.0 8.14 82.75 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.791 -0.719 . . . . 0.0 113.802 169.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 63.14 24.35 67.06 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.126 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -86.99 149.49 24.73 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 42.9 pt -73.05 146.23 10.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.489 . . . . 0.0 111.362 -175.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 33.8 m -100.02 128.4 46.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.53 -179.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 91.9 mt -120.61 159.8 24.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.535 -178.095 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.0 t -65.0 150.13 48.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.632 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.16 -21.39 59.31 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.25 176.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -66.54 -30.26 70.53 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.945 0.402 . . . . 0.0 110.802 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -68.96 -34.7 75.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.331 -175.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.523 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 50.1 mtpt -58.66 -58.65 17.64 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.752 -174.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.523 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 43.2 Cg_endo -69.06 -31.09 24.39 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.796 1.664 . . . . 0.0 112.075 176.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 55.6 tp -60.42 -49.38 77.79 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.479 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.539 ' O ' HG23 ' A' ' 129' ' ' VAL . 51.2 t-105 -60.03 -56.38 22.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.687 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.05 -24.73 68.05 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -174.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -78.77 -26.11 44.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.961 0.41 . . . . 0.0 110.759 -179.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -96.07 5.4 51.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.042 -177.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 125' ' ' TRP . 86.3 t -96.15 138.11 21.64 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 174.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.473 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 63.0 Cg_endo -90.8 -160.92 1.28 Allowed 'Cis proline' 0 C--N 1.347 0.463 0 C-N-CA 124.302 -1.124 . . . . 0.0 113.49 4.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 53.8 mttp 75.09 5.14 4.27 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.999 0.812 . . . . 0.0 111.861 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -90.82 134.66 34.27 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -108.21 155.42 16.2 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.402 -177.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.427 ' H ' ' CD ' ' A' ' 35' ' ' GLU . 52.7 tp -64.34 -37.85 88.97 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 122.824 0.45 . . . . 0.0 111.39 -174.497 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.536 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -54.66 -30.32 55.04 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.393 0.616 . . . . 0.0 111.337 179.652 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -67.66 -31.26 71.12 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.385 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 58.7 tp -65.15 -35.38 80.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.715 178.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -65.61 -44.8 85.46 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.97 0.414 . . . . 0.0 110.522 176.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -73.61 -41.12 63.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.254 -176.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.0 mt -98.1 -6.94 30.6 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -173.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -129.29 -63.69 0.11 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.174 -1.012 . . . . 0.0 113.203 -177.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.6 tp -57.82 -50.97 71.51 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -175.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.55 -62.0 6.79 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.16 -0.543 . . . . 0.0 113.598 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' PRO . . . . . 0.405 ' O ' HG23 ' A' ' 148' ' ' VAL . 12.3 Cg_endo -58.47 -31.69 94.77 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.498 2.132 . . . . 0.0 113.107 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 51.1 t90 -65.9 -50.08 65.75 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.044 0.45 . . . . 0.0 110.033 179.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.11 -37.92 89.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.668 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.25 -14.25 60.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.185 -176.221 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 144' ' ' PRO . 96.1 t -105.45 -50.54 8.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.8 0.333 . . . . 0.0 111.689 -179.069 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -81.68 -32.76 31.62 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -171.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.498 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 38.7 mm -67.2 -54.32 20.23 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -175.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.4 Cg_endo -52.45 -41.02 70.04 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 122.446 2.097 . . . . 0.0 112.8 -178.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 152' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 156' ' ' LYS . 32.2 t70 -67.89 -37.16 81.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.577 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.476 ' HG ' HG13 ' A' ' 159' ' ' ILE . 30.9 tp -69.62 -31.41 69.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.696 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 150' ' ' ILE . 72.2 mt -67.19 -53.82 29.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.41 176.408 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -70.42 -15.98 62.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.4 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 152' ' ' ASP . 20.3 ttmm -68.64 -18.18 64.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.921 175.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 87.83 21.32 47.25 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.281 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 51.7 t -99.96 -44.95 11.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.731 0.301 . . . . 0.0 111.115 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ILE . . . . . 0.476 HG13 ' HG ' ' A' ' 153' ' ' LEU . 52.2 mt -79.53 93.06 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.378 0.608 . . . . 0.0 110.458 -179.373 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -120.14 86.34 2.55 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.811 178.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -84.99 -34.0 22.46 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.168 -176.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -156.38 152.61 27.76 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.411 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.13 163.19 5.06 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 172.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -48.25 -56.65 7.44 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 123.326 0.391 . . . . 0.0 111.666 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' CYS . . . . . 0.4 ' C ' ' H ' ' A' ' 167' ' ' GLN . 33.7 m 54.64 43.73 29.73 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.031 0.443 . . . . 0.0 110.607 178.02 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -75.85 29.25 0.11 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.035 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.4 ' H ' ' C ' ' A' ' 165' ' ' CYS . 1.1 tm0? -74.81 93.04 2.56 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 173.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 83.9 mt -84.96 130.29 34.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.823 -174.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -82.0 135.07 35.4 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.091 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -81.44 112.96 19.17 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.672 177.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -88.11 115.18 25.41 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 35.9 m80 -48.77 -58.01 5.46 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.556 0.535 . . . . 0.0 111.508 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -141.78 125.8 17.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.886 0.375 . . . . 0.0 111.104 176.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 32.4 p-80 -99.88 -30.85 11.8 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 170.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 . . . . . 0 C--O 1.243 0.734 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.827 173.293 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.7 tpp . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 121.079 0.466 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.14 140.14 27.78 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.192 177.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -71.92 125.5 27.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.685 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -64.61 -32.6 74.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.615 -176.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.466 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -69.02 -45.4 70.61 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.875 0.369 . . . . 0.0 110.495 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.471 ' O ' HG23 ' A' ' 10' ' ' VAL . 88.8 m -58.77 -48.39 81.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.384 179.318 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.0 ppt_? -70.08 -20.22 63.22 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.104 -178.134 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -71.23 -46.09 61.84 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 171.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 5' ' ' ALA . 83.7 t -57.21 -45.05 84.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.419 176.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 6' ' ' THR . 85.6 t -57.73 -43.18 83.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.643 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.4 p -70.29 -20.64 63.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.795 0.331 . . . . 0.0 111.542 -178.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -97.55 0.72 47.94 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.118 0.485 . . . . 0.0 110.584 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 9' ' ' VAL . 60.3 mt -113.74 88.57 14.12 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 115.409 -0.814 . . . . 0.0 108.82 173.207 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.437 ' HD2' ' HA ' ' A' ' 38' ' ' SER . 78.0 Cg_exo -47.16 141.96 12.37 Favored 'Trans proline' 0 C--O 1.237 0.431 0 C-N-CA 123.605 2.87 . . . . 0.0 113.798 -171.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.7 m -82.61 165.71 2.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.735 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.847 HD21 ' HB3' ' A' ' 35' ' ' GLU . 7.6 mp -101.76 134.89 44.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.97 -176.032 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -87.81 -34.01 18.42 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.584 0.707 . . . . 0.0 109.64 174.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.547 HG21 ' HB3' ' A' ' 30' ' ' GLN . 19.7 m -110.82 118.78 37.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.233 -177.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.437 ' HA ' ' CG ' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -152.89 136.81 16.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.27 0.557 . . . . 0.0 111.674 176.382 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -157.13 173.15 17.43 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.154 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.0 161.31 52.06 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.211 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.15 3.32 1.68 Allowed 'Trans proline' 0 N--CA 1.473 0.273 0 C-N-CA 123.074 2.516 . . . . 0.0 112.554 -178.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -72.61 -23.83 60.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.864 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -112.24 108.91 18.3 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.514 ' O ' HG23 ' A' ' 29' ' ' VAL . 64.0 mtt180 -69.66 -36.24 75.87 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -173.412 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -71.96 -46.09 58.68 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.091 -175.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 27' ' ' LEU . 4.5 mm? -69.42 -25.88 64.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 177.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 64.0 t-105 -69.3 -45.3 69.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.385 176.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 25' ' ' ARG . 73.1 t -60.75 -42.47 92.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 110.718 177.53 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.547 ' HB3' HG21 ' A' ' 18' ' ' THR . 9.8 tt0 -70.12 -31.82 69.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.135 0.493 . . . . 0.0 110.032 178.566 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.598 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 2.9 tmt_? -61.44 -40.07 93.13 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 174.706 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 6.5 mp -62.43 -41.74 98.93 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.894 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 7.7 ptmm? -66.31 -33.3 75.41 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.597 -178.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 21.6 mm-40 -64.6 -51.83 60.65 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.166 0.508 . . . . 0.0 110.385 177.748 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.847 ' HB3' HD21 ' A' ' 16' ' ' LEU . 17.2 pt-20 -75.34 -29.19 59.89 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.503 -176.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.436 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -60.36 -43.58 96.39 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 176.481 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -62.04 -38.13 87.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.403 175.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.437 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 8.8 t -62.71 -46.76 86.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.202 176.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.476 HD22 ' HZ ' ' A' ' 54' ' ' PHE . 66.2 mt -60.12 -55.61 31.71 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.083 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 77.9 mt -59.19 -39.21 78.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.15 -176.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.0 tpp180 -63.12 -45.53 91.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.479 -178.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -67.22 -44.55 79.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.956 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 39' ' ' LEU . 93.5 t -61.89 -42.45 94.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.254 178.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -57.67 -49.31 76.92 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.57 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -54.11 -45.36 71.85 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.322 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -77.33 -28.47 53.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.879 0.371 . . . . 0.0 110.67 -177.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -61.66 -26.58 68.1 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.657 174.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -65.8 -17.62 64.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.932 177.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -99.95 11.0 40.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.211 176.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.4 t70 68.83 15.54 8.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.115 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -120.24 99.75 6.77 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.408 179.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -76.49 124.6 27.82 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 175.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.522 ' HE3' ' HB3' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -63.56 -58.66 6.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.269 -171.433 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.522 ' HB3' ' HE3' ' A' ' 53' ' ' TRP . 35.7 p90 -154.57 161.21 41.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.019 0.438 . . . . 0.0 110.914 -174.019 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.0 mtt180 -134.0 121.78 22.09 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.62 HD21 ' HB3' ' A' ' 65' ' ' TRP . 5.7 tt -157.3 137.73 12.92 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -167.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.427 ' N ' HD23 ' A' ' 56' ' ' LEU . 17.6 mm-40 -126.16 168.99 13.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.853 0.359 . . . . 0.0 110.391 -175.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.0 t -143.67 172.46 12.79 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.197 -178.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -68.04 173.71 4.38 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.468 174.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -72.91 -27.01 61.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.114 0.483 . . . . 0.0 109.732 177.171 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -79.64 -14.02 59.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.396 172.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.74 32.59 84.69 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.739 -179.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.4 p -89.28 -29.15 19.4 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -176.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 -130.46 123.49 29.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.62 ' HB3' HD21 ' A' ' 56' ' ' LEU . 47.3 m95 -109.61 132.91 53.7 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.129 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -143.39 139.12 29.84 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.445 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.431 ' HA3' ' HA ' ' A' ' 56' ' ' LEU . . . 172.17 -166.98 39.89 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.118 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.483 ' HZ1' ' HB2' ' A' ' 81' ' ' ASP . 23.0 mtpp -133.65 156.28 48.17 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -178.499 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.663 ' SG ' ' HB2' ' A' ' 80' ' ' PHE . 5.1 p -118.65 149.64 41.06 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.214 175.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 11.8 m-90 -120.97 138.59 54.07 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -176.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -146.23 120.09 9.31 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.008 0.432 . . . . 0.0 110.332 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.415 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.6 mp -95.62 127.84 47.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 175.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -130.07 108.35 10.01 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -179.101 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 64.53 -85.95 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.639 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -123.57 -11.63 7.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.192 -176.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.8 mt -103.27 145.84 29.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.17 0.51 . . . . 0.0 111.64 -174.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.421 ' HB3' ' HE3' ' A' ' 77' ' ' LYS . 1.1 tmmt? -128.52 120.99 27.82 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.395 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -132.42 153.12 51.14 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.958 0.409 . . . . 0.0 111.152 -176.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -116.79 139.21 50.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.698 -176.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.663 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . 46.7 m-85 -121.51 117.37 26.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.855 0.36 . . . . 0.0 110.477 175.663 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.486 ' H ' ' CB ' ' A' ' 101' ' ' GLU . 9.6 t70 -83.18 130.86 35.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.082 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.507 HG22 HG22 ' A' ' 99' ' ' VAL . 23.2 pt -133.92 147.47 30.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.946 -177.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -154.75 151.84 29.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.61 176.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.436 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 50.3 p90 -167.93 170.31 10.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.186 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -114.15 166.4 11.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.415 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 46.2 mm -107.12 90.23 5.31 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.696 178.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.33 164.47 17.54 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.86 2.374 . . . . 0.0 112.697 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.1 mm -63.74 -27.35 42.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.892 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.46 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 3.7 p -75.69 -14.02 60.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.998 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.488 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 73.3 t80 -78.11 143.58 65.78 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.488 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.4 Cg_endo -95.63 9.73 45.03 Favored 'Cis proline' 0 C--N 1.35 0.641 0 C-N-CA 124.488 -1.047 . . . . 0.0 113.509 1.146 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.411 ' HA ' HG11 ' A' ' 129' ' ' VAL . 21.5 m -61.03 -31.02 70.66 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.392 0.615 . . . . 0.0 110.201 178.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.46 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 22.9 m -126.33 144.3 50.86 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.195 173.815 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.83 143.95 82.09 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 120.54 0.21 . . . . 0.0 111.2 -178.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -86.73 171.88 6.91 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.993 2.462 . . . . 0.0 112.421 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.806 ' HB3' ' HD3' ' A' ' 114' ' ' LYS . 40.6 mt-10 -101.5 113.53 26.73 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.625 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.436 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 57.7 mt -92.79 141.42 14.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.726 -177.451 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -118.27 140.31 50.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.733 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.507 HG22 HG22 ' A' ' 82' ' ' ILE . 27.6 t -119.57 86.43 34.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.851 0.357 . . . . 0.0 110.288 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.65 -18.51 48.26 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 123.184 2.589 . . . . 0.0 113.138 -175.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.486 ' CB ' ' H ' ' A' ' 81' ' ' ASP . 4.7 tp10 -74.83 -19.0 60.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.036 0.446 . . . . 0.0 110.9 -177.064 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.8 mt -97.66 14.47 26.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.239 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -58.89 131.52 51.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.178 -176.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 61.5 23.73 63.03 Favored Glycine 0 C--N 1.334 0.435 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.51 176.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -133.85 -38.0 0.9 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.984 0.421 . . . . 0.0 110.436 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.7 t -80.65 172.85 13.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.837 176.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -74.1 -154.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.025 0.44 . . . . 0.0 111.054 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.34 119.93 15.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.011 0.434 . . . . 0.0 110.994 -177.362 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 6.9 mmt -87.5 178.14 6.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.975 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -92.21 179.71 5.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.363 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -51.85 109.47 0.37 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -175.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 92.32 22.57 29.16 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.974 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 76.48 28.34 59.81 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.366 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.806 ' HD3' ' HB3' ' A' ' 96' ' ' GLU . 53.8 mttp -93.56 156.5 16.7 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.486 HD12 HD21 ' A' ' 117' ' ' LEU . 30.3 pt -74.25 139.11 19.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.041 0.448 . . . . 0.0 111.401 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 18.6 t -94.11 109.06 20.86 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.486 HD21 HD12 ' A' ' 115' ' ' ILE . 96.0 mt -91.19 175.62 6.87 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.23 -177.252 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.565 HG23 ' HB2' ' A' ' 121' ' ' PHE . 4.7 t -71.98 146.2 47.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.904 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.463 ' HA ' ' HE3' ' A' ' 122' ' ' LYS . 13.4 t70 -65.49 -30.26 71.01 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.621 -176.058 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -80.03 -15.57 56.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.753 -172.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.565 ' HB2' HG23 ' A' ' 118' ' ' THR . 49.1 t80 -70.93 -34.15 71.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.006 -176.389 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.53 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 42.3 mttt -57.81 -58.67 16.87 Favored Pre-proline 0 CA--C 1.539 0.522 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.085 -176.215 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.53 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 29.0 Cg_endo -64.37 -34.87 53.04 Favored 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 121.83 1.687 . . . . 0.0 111.976 178.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 42.3 tp -61.62 -45.24 94.92 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.837 0.351 . . . . 0.0 110.349 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.47 ' O ' HG23 ' A' ' 129' ' ' VAL . 57.2 t-105 -59.23 -57.26 13.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.587 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.03 -32.17 71.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.884 -175.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -70.36 -36.56 74.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.903 0.382 . . . . 0.0 111.169 -178.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -89.36 -31.16 17.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.061 -173.07 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.562 HG13 ' HA ' ' A' ' 130' ' ' PRO . 51.2 t -53.64 138.95 51.05 Favored Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 176.128 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.562 ' HA ' HG13 ' A' ' 129' ' ' VAL . 6.9 Cg_endo -88.59 -151.64 0.52 Allowed 'Cis proline' 0 C--N 1.349 0.591 0 C-N-CA 124.727 -0.947 . . . . 0.0 114.453 6.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 9.4 mtmp? 75.24 36.66 0.5 Allowed 'General case' 0 C--N 1.343 0.309 0 C-N-CA 123.759 0.823 . . . . 0.0 110.427 -172.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -128.01 152.9 47.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.828 -179.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.598 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -146.1 175.17 25.72 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 47.6 tp -58.45 -38.25 77.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 117.355 0.578 . . . . 0.0 111.497 -176.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.12 -43.85 70.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.732 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 29.5 m80 -70.33 -36.61 74.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.682 0.277 . . . . 0.0 110.73 -178.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.75 -50.57 62.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.283 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 21.8 ptm -71.69 -31.67 67.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.55 -175.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -73.22 -45.35 56.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.682 0.277 . . . . 0.0 111.418 -179.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.2 mt -85.72 -15.98 40.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.569 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -98.79 -69.44 0.93 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.433 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' LEU . . . . . 0.589 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 94.9 mt -65.97 -38.69 89.19 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -176.298 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.32 -62.28 6.15 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 121.086 -0.578 . . . . 0.0 113.352 -177.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -64.4 -31.17 62.38 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.55 2.167 . . . . 0.0 112.414 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 38.3 t90 -62.57 -39.51 93.9 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.009 0.433 . . . . 0.0 110.621 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.624 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 98.7 mt -60.1 -34.52 73.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.876 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.02 -4.89 41.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.759 -176.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 61.4 t -85.47 -56.12 5.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.702 -0.226 . . . . 0.0 111.511 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -107.07 -29.49 9.36 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -172.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.624 ' HB ' ' O ' ' A' ' 146' ' ' LEU . 1.7 mp -57.91 -48.7 96.67 Favored Pre-proline 0 CA--C 1.541 0.622 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -175.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 151' ' ' PRO . . . . . 0.448 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 54.3 Cg_exo -54.59 -37.87 90.65 Favored 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 121.79 1.66 . . . . 0.0 112.346 175.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.31 -44.4 87.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.401 179.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.84 -36.9 80.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.887 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 150' ' ' ILE . 64.9 mt -66.48 -41.18 88.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.816 178.495 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 151' ' ' PRO . 52.8 mt-30 -62.89 -39.06 93.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.023 0.439 . . . . 0.0 111.326 178.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -85.98 -5.58 59.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.633 -178.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 71.8 38.31 60.78 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.06 -0.591 . . . . 0.0 112.781 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 5.4 t -91.07 4.17 6.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.546 0.689 . . . . 0.0 110.105 -178.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.8 mm -71.48 130.13 35.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.174 179.245 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -64.04 -34.73 78.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.095 -178.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -78.54 123.4 27.04 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -88.44 -164.21 1.09 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.244 0.545 . . . . 0.0 111.574 -175.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -60.61 162.76 6.1 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.452 179.068 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 164' ' ' LYS . 32.4 mmtp -82.67 -13.54 56.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.363 -177.429 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 43.3 t -68.72 95.55 0.67 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.198 -0.456 . . . . 0.0 109.979 175.045 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -160.41 177.41 10.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.962 -178.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -85.13 160.84 19.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.208 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -65.9 116.87 7.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.1 178.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -86.36 122.23 30.03 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.826 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -82.14 109.35 16.37 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.73 -9.24 58.37 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.056 0.455 . . . . 0.0 111.176 -175.129 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 33.5 t-80 -147.36 134.15 20.08 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 51.8 m170 -93.94 154.2 17.81 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.023 0.439 . . . . 0.0 110.891 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -101.49 -174.87 2.7 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.566 178.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 79.0 m-70 . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.683 -0.675 . . . . 0.0 109.305 176.051 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.833 0.349 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.462 ' O ' HG23 ' A' ' 10' ' ' VAL . 11.0 m -59.57 -47.41 85.68 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.597 178.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 -67.08 -29.59 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.013 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -60.63 -50.79 72.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.95 0.405 . . . . 0.0 110.067 175.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.37 -42.5 95.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.88 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.5 HG21 HD21 ' A' ' 140' ' ' LEU . 64.7 t -62.52 -32.35 55.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.911 0.386 . . . . 0.0 110.589 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.4 t -69.54 -21.89 63.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.695 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.07 -3.31 54.4 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.06 0.457 . . . . 0.0 110.129 177.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.421 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 42.6 mt -108.35 88.46 4.97 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.57 175.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 10.3 Cg_endo -49.1 147.89 10.43 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 123.588 2.859 . . . . 0.0 113.318 -173.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.528 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 29.5 m -79.17 142.36 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.503 178.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.624 HD23 ' HG2' ' A' ' 31' ' ' ARG . 7.3 mp -81.33 134.16 35.53 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HD3' ' H ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -106.23 -4.43 20.19 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.748 -173.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.1 m -87.55 -53.98 4.51 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 173.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.8 t30 46.25 81.13 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.52 0 O-C-N 124.037 0.836 . . . . 0.0 112.276 175.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.71 165.43 23.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.946 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -100.67 177.97 28.41 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.938 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.45 5.76 2.21 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 123.399 2.733 . . . . 0.0 113.238 -176.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.526 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 3.4 mmp_? -84.14 -48.0 10.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.828 0.347 . . . . 0.0 110.86 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -91.66 92.59 8.52 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 176.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.55 ' O ' HG23 ' A' ' 29' ' ' VAL . 61.4 mtt85 -59.9 -31.26 69.65 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -175.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.26 -52.16 60.03 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.603 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 12.3 mt -72.82 -28.57 62.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.716 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.546 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 67.9 t-105 -60.87 -49.54 77.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.463 175.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 25' ' ' ARG . 86.4 t -61.55 -30.5 48.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.927 178.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.453 HE21 ' HB3' ' A' ' 30' ' ' GLN . 11.2 mt-30 -68.85 -49.94 54.11 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.84 0.352 . . . . 0.0 110.568 175.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.624 ' HG2' HD23 ' A' ' 16' ' ' LEU . 16.3 ttp180 -63.36 -32.16 73.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.063 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -59.47 -48.47 81.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.683 -179.405 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.5 ptpp? -72.16 -34.89 68.83 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.248 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 30' ' ' GLN . 49.3 mt-10 -60.02 -46.92 87.92 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.718 0.77 . . . . 0.0 109.485 174.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -67.02 -42.45 84.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.614 -1.176 . . . . 0.0 111.028 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.24 -45.1 95.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.946 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -60.77 -39.2 87.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.955 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.4 m -62.89 -39.29 94.04 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.348 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.424 ' O ' HG23 ' A' ' 43' ' ' VAL . 96.1 mt -65.34 -47.78 75.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.584 177.546 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.63 -43.32 98.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.681 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.4 tpp180 -56.2 -47.19 78.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.737 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.413 ' HD2' ' HE1' ' A' ' 54' ' ' PHE . 43.1 t80 -65.06 -45.58 84.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.724 -178.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.71 HG21 HH21 ' A' ' 55' ' ' ARG . 98.2 t -63.01 -45.16 99.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.107 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -59.94 -50.4 73.92 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.555 0.693 . . . . 0.0 110.137 177.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -53.64 -40.94 66.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.54 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.652 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 91.8 m-20 -68.49 -44.53 74.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.175 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -62.99 -31.9 73.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.284 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -64.24 -36.1 82.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 0.0 110.199 176.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.17 0.43 40.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.859 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.9 t70 74.02 12.12 4.29 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.291 177.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.652 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 5.3 t30 -119.82 92.78 3.87 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.12 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.89 146.86 35.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.692 0.282 . . . . 0.0 110.703 -176.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.779 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -104.94 -68.69 0.84 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -171.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.779 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 26.5 p90 -160.65 165.91 29.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.733 0.777 . . . . 0.0 112.923 -165.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.71 HH21 HG21 ' A' ' 43' ' ' VAL . 2.4 mmp_? -131.44 121.84 25.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.641 -1.163 . . . . 0.0 108.898 166.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.514 HD21 HD11 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -134.11 125.32 27.73 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 -177.004 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -131.93 168.77 17.31 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.844 0.354 . . . . 0.0 110.321 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.465 ' OG ' ' HA2' ' A' ' 62' ' ' GLY . 6.3 t -130.48 178.2 6.79 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.31 -0.404 . . . . 0.0 109.948 -175.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -84.43 -177.98 6.78 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.4 ptpp? -60.66 -28.43 68.58 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -93.59 -10.9 33.12 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.592 0.234 . . . . 0.0 111.092 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.465 ' HA2' ' OG ' ' A' ' 58' ' ' SER . . . 71.48 13.31 74.1 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.913 -0.66 . . . . 0.0 113.047 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.8 p -80.64 -15.92 55.36 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -174.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.516 ' HA ' ' HA ' ' A' ' 85' ' ' ASP . 32.1 ttm180 -143.65 122.1 12.41 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 55.3 m95 -103.12 139.03 39.16 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.361 -178.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 p90 -146.0 146.43 30.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.93 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.54 -153.51 21.94 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.836 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.601 ' HG3' ' HZ3' ' A' ' 70' ' ' TRP . 5.5 ptpp? -151.23 143.81 24.31 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.098 0.475 . . . . 0.0 110.987 -178.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 15.9 p -122.79 141.23 52.05 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.561 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.659 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 2.9 p90 -122.7 137.06 55.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.462 0.649 . . . . 0.0 110.877 -178.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -117.89 123.27 45.44 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.708 -176.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 34.7 mm -87.59 126.71 41.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.117 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.422 ' HB3' ' HE1' ' A' ' 78' ' ' TYR . 11.8 t60 -140.59 124.76 17.51 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 176.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.443 ' C ' HD22 ' A' ' 75' ' ' LEU . 39.1 t70 68.3 -85.95 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.93 0.769 . . . . 0.0 110.422 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.443 HD22 ' C ' ' A' ' 74' ' ' ASP . 2.2 mm? -142.03 5.62 1.72 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 175.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 82.0 mt -111.47 153.67 25.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.898 0.38 . . . . 0.0 111.116 -172.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -116.68 129.01 55.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.958 176.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.422 ' HE1' ' HB3' ' A' ' 73' ' ' HIS . 43.0 m-85 -115.74 101.21 8.62 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.837 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.659 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 1.1 pm0 -96.2 135.76 37.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.092 0.473 . . . . 0.0 110.926 177.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.404 ' HD1' ' HG2' ' A' ' 101' ' ' GLU . 60.9 m-85 -124.75 138.76 54.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.919 -179.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -93.93 124.58 38.03 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.514 HD11 HD21 ' A' ' 56' ' ' LEU . 39.5 pt -130.8 160.32 42.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.927 0.394 . . . . 0.0 111.608 -173.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -154.14 153.39 31.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.398 177.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -172.55 162.31 5.16 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.516 ' HA ' ' HA ' ' A' ' 64' ' ' ARG . 5.6 p-10 -115.64 176.1 5.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.625 0.25 . . . . 0.0 110.504 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.405 HG21 ' CH2' ' A' ' 28' ' ' TRP . 50.6 mm -114.34 89.05 16.62 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.227 -175.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 20.6 Cg_endo -61.05 165.4 12.41 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.596 2.197 . . . . 0.0 112.122 177.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 55.6 mt -64.32 -21.84 29.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.256 0.551 . . . . 0.0 110.974 -178.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.16 -20.11 64.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.293 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.656 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 49.6 t80 -88.31 144.51 34.18 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.656 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.2 Cg_endo -95.5 17.67 36.31 Favored 'Cis proline' 0 N--CA 1.459 -0.531 0 C-N-CA 124.495 -1.044 . . . . 0.0 113.822 3.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 10.3 m -65.24 -38.45 90.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.51 0.671 . . . . 0.0 110.186 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -129.18 141.73 51.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.612 175.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.44 144.48 91.78 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.636 -0.257 . . . . 0.0 111.256 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.416 ' HD3' ' CD1' ' A' ' 90' ' ' TYR . 95.2 Cg_endo -92.98 -171.9 0.33 Allowed 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.159 2.572 . . . . 0.0 112.39 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -106.71 123.21 47.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.392 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.86 126.22 41.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.581 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -92.24 117.64 30.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.116 -178.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.459 HG22 HG22 ' A' ' 82' ' ' ILE . 25.6 t -119.96 87.24 38.19 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.439 178.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -68.74 -6.5 18.1 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.867 2.378 . . . . 0.0 113.008 -176.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.404 ' HG2' ' HD1' ' A' ' 80' ' ' PHE . 14.6 tp10 -78.87 -43.25 25.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.046 0.45 . . . . 0.0 110.53 178.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.8 HD22 ' HG ' ' A' ' 153' ' ' LEU . 86.7 mt -86.76 -35.11 19.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.977 -175.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.0 128.67 38.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.364 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 95.86 -29.36 10.0 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.147 -177.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -92.34 4.59 53.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.914 0.388 . . . . 0.0 111.392 -177.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.9 t . . . . . 0 C--N 1.321 -0.661 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 175.567 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . 0.581 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . . . . . . 0 N--CA 1.448 -0.562 0 CA-C-O 120.246 -0.197 . . . . 0.0 113.079 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -96.51 131.19 43.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.941 0.401 . . . . 0.0 111.652 -173.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 33.3 pt -75.86 170.75 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.688 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 35.1 m -111.14 93.7 4.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.13 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 93.5 mt -74.28 157.32 36.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.722 0.296 . . . . 0.0 110.859 179.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.457 HG23 ' HB2' ' A' ' 121' ' ' PHE . 2.6 t -72.37 151.97 42.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.029 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -67.06 -25.38 66.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.601 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -78.56 -20.03 51.51 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.428 -176.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.457 ' HB2' HG23 ' A' ' 118' ' ' THR . 56.3 t80 -71.44 -34.43 70.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.953 -177.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.58 -53.53 63.63 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.009 -176.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.43 ' O ' ' HG3' ' A' ' 127' ' ' ARG . 37.0 Cg_endo -67.47 -34.17 27.07 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.529 1.486 . . . . 0.0 112.227 175.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.3 tp -60.35 -45.56 93.06 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.859 0.362 . . . . 0.0 110.462 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.539 ' O ' HG23 ' A' ' 129' ' ' VAL . 41.6 t-105 -59.91 -54.88 40.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.143 177.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.95 -34.68 68.26 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.413 -175.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.43 ' HG3' ' O ' ' A' ' 123' ' ' PRO . 97.0 mtt180 -69.15 -30.12 68.29 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -178.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -95.62 -21.8 18.0 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -172.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 125' ' ' TRP . 89.3 t -46.22 129.96 7.58 Favored Pre-proline 0 N--CA 1.473 0.678 0 O-C-N 123.446 0.466 . . . . 0.0 111.542 -178.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 129' ' ' VAL . 72.0 Cg_endo -96.72 -120.08 0.0 OUTLIER 'Cis proline' 0 CA--C 1.536 0.59 0 C-N-CA 124.016 -1.243 . . . . 0.0 113.156 2.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.528 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 64.8 mttm 67.42 22.37 9.41 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.331 175.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -91.84 -178.95 5.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.587 0.708 . . . . 0.0 112.151 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -178.31 157.71 21.87 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.393 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.6 tp -54.19 -40.24 67.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.792 0.296 . . . . 0.0 111.618 -177.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.43 -38.26 74.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.061 0.458 . . . . 0.0 111.015 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -71.87 -45.85 59.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.161 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.3 tp -59.19 -46.81 87.43 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.343 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . 0.41 ' HE1' ' CD2' ' A' ' 42' ' ' TYR . 7.8 tmm? -62.38 -47.69 83.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.215 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.75 -38.79 73.51 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -176.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.5 HD21 HG21 ' A' ' 10' ' ' VAL . 95.9 mt -86.87 -17.95 32.09 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -175.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -112.55 -66.63 0.5 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.296 -0.954 . . . . 0.0 113.041 -177.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.603 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 54.9 tp -66.45 -42.85 87.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.664 0.269 . . . . 0.0 111.031 -175.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -51.75 -61.94 6.0 Favored Glycine 0 CA--C 1.523 0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.63 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . 0.476 ' O ' HG23 ' A' ' 148' ' ' VAL . 33.9 Cg_endo -65.63 -31.86 49.05 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.314 2.009 . . . . 0.0 112.702 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 33.5 t90 -64.5 -33.74 76.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.694 0.283 . . . . 0.0 111.0 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 90.4 mt -58.55 -40.65 83.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.953 0.406 . . . . 0.0 110.167 177.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.0 -2.12 29.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.306 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 144' ' ' PRO . 90.8 t -104.85 -55.19 5.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.529 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -95.74 -32.48 12.71 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -173.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.607 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 40.2 mm -56.45 -41.19 89.88 Favored Pre-proline 0 CA--C 1.54 0.565 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -176.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.607 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 1.2 Cg_endo -46.18 -40.56 21.59 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 122.395 2.063 . . . . 0.0 112.792 171.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -61.93 -49.31 76.65 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.041 0.448 . . . . 0.0 110.097 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.8 ' HG ' HD22 ' A' ' 102' ' ' LEU . 3.7 mm? -60.52 -42.81 97.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.086 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.94 -53.3 31.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.038 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -65.31 -36.34 83.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.389 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . 0.431 ' HZ3' ' HB3' ' A' ' 156' ' ' LYS . 5.8 ttpm? -70.99 -16.53 62.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.986 0.422 . . . . 0.0 110.42 -178.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.71 17.69 63.19 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.333 172.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 29.1 m -87.54 -19.99 7.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.861 0.331 . . . . 0.0 110.969 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.519 HG13 ' HB3' ' A' ' 153' ' ' LEU . 44.5 mt . . . . . 0 C--N 1.328 -0.363 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.491 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 CA--C 1.525 0.009 0 CA-C-O 120.859 0.362 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.2 m -61.12 -42.63 98.88 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.517 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -64.41 -38.35 90.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.442 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -62.97 -40.37 97.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.06 178.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 5' ' ' ALA . 96.3 t -58.53 -47.36 88.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 120.93 0.395 . . . . 0.0 110.448 178.012 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.2 t -67.17 -25.72 34.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.868 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.6 m -81.71 -40.71 22.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.375 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.498 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 34.9 mt-10 -79.1 -12.21 60.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.655 0.264 . . . . 0.0 111.372 -179.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.7 mt -105.35 89.76 3.44 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 172.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.498 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 87.8 Cg_exo -45.52 151.2 1.15 Allowed 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 124.058 3.172 . . . . 0.0 114.25 -172.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.585 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 20.0 m -86.05 145.21 8.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.716 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.742 HD21 ' HG2' ' A' ' 35' ' ' GLU . 8.2 mp -85.11 134.58 34.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.893 -178.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -82.07 -32.87 30.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.721 0.772 . . . . 0.0 109.545 174.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.494 HG23 HD12 ' A' ' 27' ' ' LEU . 25.4 m -85.03 135.21 34.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.427 -175.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -135.24 93.23 2.96 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.388 178.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -162.42 161.38 27.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.516 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -103.77 -176.61 25.85 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.397 -179.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.51 -6.54 13.86 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 123.454 2.769 . . . . 0.0 113.051 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.438 ' HG3' HG23 ' A' ' 88' ' ' ILE . 45.7 mtp180 -71.31 -24.63 62.16 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.566 0.222 . . . . 0.0 111.239 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -113.83 96.42 5.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.526 ' O ' HG23 ' A' ' 29' ' ' VAL . 87.6 mtm180 -64.44 -32.95 74.78 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -173.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -68.41 -45.53 72.39 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.418 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.494 HD12 HG23 ' A' ' 18' ' ' THR . 4.5 mm? -71.7 -26.95 62.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.208 0.528 . . . . 0.0 110.203 174.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.531 ' HH2' HG21 ' A' ' 86' ' ' ILE . 63.7 t-105 -64.1 -41.84 97.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.297 178.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 25' ' ' ARG . 96.5 t -60.08 -37.84 74.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.158 0.504 . . . . 0.0 110.174 175.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 38.7 mt-30 -67.07 -43.49 82.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.14 178.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.469 HH11 ' HG3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -62.41 -30.51 71.27 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.35 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.494 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 2.1 mm? -65.29 -49.45 69.48 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.225 177.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.442 ' HG2' ' HA ' ' A' ' 30' ' ' GLN . 19.7 ptpt -66.37 -38.59 87.92 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 120.826 -0.349 . . . . 0.0 110.961 -178.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.534 ' HB3' ' HG ' ' A' ' 16' ' ' LEU . 26.4 mm-40 -61.88 -51.1 69.57 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.973 0.416 . . . . 0.0 110.392 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.742 ' HG2' HD21 ' A' ' 16' ' ' LEU . 6.0 mm-40 -63.36 -42.06 98.85 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.578 177.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.494 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -58.85 -45.02 91.06 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.281 -178.241 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 84.3 mm-40 -58.99 -43.09 91.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.027 0.442 . . . . 0.0 110.438 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.448 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 18.0 m -66.54 -40.58 89.16 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.763 177.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 35' ' ' GLU . 95.9 mt -62.95 -49.01 76.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.014 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 36' ' ' TYR . 85.8 mt -55.59 -47.44 78.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 O-C-N 123.163 0.289 . . . . 0.0 110.582 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -61.52 -41.07 96.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.375 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.484 ' HE2' ' HZ ' ' A' ' 54' ' ' PHE . 80.0 t80 -72.1 -46.21 57.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.22 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.44 ' O ' ' HG3' ' A' ' 47' ' ' LYS . 85.3 t -62.91 -37.34 78.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.068 0.461 . . . . 0.0 110.295 179.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.7 -50.56 70.65 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 175.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -53.72 -48.66 69.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.52 177.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -62.49 -39.36 93.21 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -178.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 32.2 mtmm -68.88 -37.28 78.93 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.312 177.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -66.5 -34.91 78.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.713 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -85.86 -1.61 57.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.256 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.9 t70 61.62 29.68 18.3 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.667 0.746 . . . . 0.0 110.48 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -122.9 55.1 1.2 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.575 -175.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -93.7 106.59 18.55 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 65.0 p-90 -125.5 5.16 7.6 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -174.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.484 ' HZ ' ' HE2' ' A' ' 42' ' ' TYR . 19.7 p90 -154.64 147.0 23.91 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.077 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.53 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 23.0 tpt180 -126.57 123.32 37.42 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.575 178.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.1 mt -121.52 124.6 44.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.002 0.43 . . . . 0.0 110.112 175.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -134.78 152.37 51.7 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.178 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.6 m -126.23 159.35 33.27 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 120.771 0.32 . . . . 0.0 111.553 -171.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -75.74 173.2 11.41 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -69.14 -12.73 61.94 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -170.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -85.35 -25.53 27.04 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.831 0.348 . . . . 0.0 110.373 175.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.39 17.74 77.85 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.984 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.9 p -83.73 -30.28 26.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.953 0.406 . . . . 0.0 111.757 -177.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 64' ' ' ARG . 50.3 mtp180 -128.72 128.32 43.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.239 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -110.91 126.43 54.71 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.436 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 83' ' ' GLU . 39.7 p90 -136.46 167.05 22.08 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.53 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 168.33 -138.77 5.31 Favored Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.011 -1.09 . . . . 0.0 112.544 178.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 81' ' ' ASP . 20.7 ttmm -153.03 134.73 14.53 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -172.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 64.5 m -119.67 122.66 42.0 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 174.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.585 ' HB3' ' HG2' ' A' ' 79' ' ' GLU . 41.5 p90 -124.43 129.98 51.65 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.284 0.564 . . . . 0.0 110.399 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -121.01 133.96 55.28 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 -179.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 43.3 mm -96.9 121.47 47.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.411 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -147.15 116.87 7.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.035 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 57.24 58.4 3.93 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.918 0.761 . . . . 0.0 111.224 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.1 mt 72.65 -38.64 0.42 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.385 0.674 . . . . 0.0 112.641 175.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.35 137.14 55.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.318 0.58 . . . . 0.0 112.068 -175.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -108.55 102.37 11.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.667 175.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 17.8 p90 -104.6 119.71 39.62 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.185 0.517 . . . . 0.0 110.6 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.585 ' HG2' ' HB3' ' A' ' 70' ' ' TRP . 57.4 mt-10 -105.77 136.44 45.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.328 -178.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -121.25 112.57 18.79 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.507 ' HA ' ' HA ' ' A' ' 68' ' ' LYS . 2.3 m-20 -83.34 112.97 20.39 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 38.2 pt -114.62 173.76 3.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.266 -173.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.456 ' HA ' ' HA ' ' A' ' 66' ' ' PHE . 10.0 pt-20 -162.44 157.71 22.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.785 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.583 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 36.0 p90 -160.91 148.15 15.43 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.084 0.469 . . . . 0.0 111.077 176.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -93.34 164.0 13.38 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.831 177.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.531 HG21 ' HH2' ' A' ' 28' ' ' TRP . 39.7 mm -107.45 91.98 7.75 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.631 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 1.3 Cg_endo -40.79 148.22 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 124.181 3.254 . . . . 0.0 113.807 -178.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.438 HG23 ' HG3' ' A' ' 23' ' ' ARG . 50.2 mm -58.52 -39.42 75.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.957 -174.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.3 p -83.19 40.5 0.71 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.213 0.53 . . . . 0.0 112.064 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.534 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 25.0 t80 -77.76 147.65 74.75 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.483 177.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.534 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 19.9 Cg_endo -94.76 13.35 44.72 Favored 'Cis proline' 0 N--CA 1.453 -0.856 0 C-N-CA 124.513 -1.036 . . . . 0.0 112.883 -2.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 22.5 m -62.28 -35.84 80.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.33 0.586 . . . . 0.0 110.191 178.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.6 m -105.77 119.66 39.71 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.641 173.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -81.41 152.05 69.79 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.528 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.563 ' HG2' HD13 ' A' ' 134' ' ' LEU . 50.9 Cg_exo -55.31 136.47 73.66 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.891 2.394 . . . . 0.0 112.163 174.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.486 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 19.9 mt-10 -79.74 -22.68 42.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.201 -173.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.583 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 62.8 mt 65.95 116.24 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-O 121.363 0.601 . . . . 0.0 111.665 -178.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.738 ' HB2' ' HG2' ' A' ' 114' ' ' LYS . . . -119.62 138.38 53.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.357 0.599 . . . . 0.0 111.84 -177.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 16.7 t -124.43 86.18 55.26 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.713 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.91 -21.71 65.6 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.333 2.689 . . . . 0.0 114.138 -172.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.65 -29.81 56.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.208 0.528 . . . . 0.0 110.375 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.482 HD23 ' HD2' ' A' ' 105' ' ' LYS . 75.2 mt -89.92 4.05 51.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.309 -176.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -62.26 110.57 1.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 87.02 -2.55 87.08 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.26 -178.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.482 ' HD2' HD23 ' A' ' 102' ' ' LEU . 4.2 ttmp? -101.9 -5.87 24.2 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 121.433 0.635 . . . . 0.0 110.045 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 t . . . . . 0 C--N 1.324 -0.521 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.648 177.941 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.197 0 N-CA-C 112.229 -0.348 . . . . 0.0 112.229 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.738 ' HG2' ' HB2' ' A' ' 98' ' ' ALA . 95.0 mttt -91.8 137.54 32.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 176.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.5 pt -82.13 167.55 2.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.376 0.607 . . . . 0.0 112.32 -168.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 17.6 p -114.27 116.71 29.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.054 176.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.8 mt -85.7 -175.14 5.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.183 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.454 HG22 ' H ' ' A' ' 120' ' ' HIS . 31.5 m -59.86 131.93 52.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.092 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -63.57 -32.33 73.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.82 -177.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.454 ' H ' HG22 ' A' ' 118' ' ' THR . 25.2 m80 -75.18 -22.11 58.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.09 -179.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -71.5 -33.57 69.36 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.35 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.434 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 28.1 ttpp -55.69 -56.75 26.46 Favored Pre-proline 0 CA--C 1.542 0.647 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.975 -178.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.434 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 36.3 Cg_endo -67.28 -31.28 35.75 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.589 1.526 . . . . 0.0 112.104 175.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 54.5 tp -61.33 -44.8 96.59 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.414 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.549 ' O ' HG23 ' A' ' 129' ' ' VAL . 49.9 t-105 -59.84 -54.61 44.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.309 178.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.12 -16.13 63.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.968 -176.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -86.35 -21.6 27.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.958 0.408 . . . . 0.0 110.591 178.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -110.11 25.61 11.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.972 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.549 HG23 ' O ' ' A' ' 125' ' ' TRP . 87.2 t -102.13 135.23 19.69 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.641 174.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.484 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 88.3 Cg_endo -89.05 -153.33 0.64 Allowed 'Cis proline' 0 N--CA 1.462 -0.344 0 C-N-CA 124.085 -1.215 . . . . 0.0 112.851 1.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.585 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 53.5 mtmt 76.28 7.1 3.54 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.836 0.855 . . . . 0.0 111.759 -176.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.2 171.25 7.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 173.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -169.94 176.02 43.85 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.43 -0.89 . . . . 0.0 112.244 -174.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.563 HD13 ' HG2' ' A' ' 95' ' ' PRO . 60.9 tp -61.97 -37.09 83.46 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 122.784 0.433 . . . . 0.0 111.49 -174.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.54 -39.58 76.93 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.403 0.62 . . . . 0.0 110.591 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -69.93 -36.1 75.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.065 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.501 HD22 ' HD2' ' A' ' 95' ' ' PRO . 57.3 tp -66.42 -53.49 35.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.414 -179.087 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.2 ptt? -62.18 -35.64 79.44 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.522 -175.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.34 -41.76 69.4 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.7 mt -95.61 -12.12 26.15 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -172.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -112.91 -53.9 0.47 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.155 -1.022 . . . . 0.0 113.739 -175.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.501 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 52.0 tp -64.36 -42.54 96.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.715 0.258 . . . . 0.0 111.479 -173.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.05 -61.69 7.22 Favored Glycine 0 CA--C 1.522 0.471 0 C-N-CA 121.244 -0.503 . . . . 0.0 113.068 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -58.38 -29.01 86.92 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.733 2.288 . . . . 0.0 113.081 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -66.87 -37.46 84.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.744 0.307 . . . . 0.0 110.818 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 91.8 mt -55.21 -38.13 68.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.316 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.57 -6.11 46.66 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 57.5 t -82.14 -40.1 17.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.734 0.302 . . . . 0.0 111.584 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -125.01 -39.78 2.22 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -173.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.469 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 48.2 mm -55.02 -52.56 70.0 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -169.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.6 Cg_endo -54.27 -33.86 77.38 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.102 1.868 . . . . 0.0 112.921 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.506 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 20.7 t70 -87.14 -29.67 21.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.9 0.381 . . . . 0.0 110.371 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.624 ' HA ' ' HE2' ' A' ' 156' ' ' LYS . 24.2 tp -56.96 -39.65 74.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.589 179.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 60.4 mt -64.18 -40.32 88.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.361 176.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -66.93 -34.62 78.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.223 -178.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . 0.624 ' HE2' ' HA ' ' A' ' 153' ' ' LEU . 54.4 mttm -55.6 -30.76 61.45 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.087 0.47 . . . . 0.0 110.962 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.88 13.64 71.69 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.688 -0.768 . . . . 0.0 111.756 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 28.7 m -79.7 -17.12 12.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.136 0.494 . . . . 0.0 110.78 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 61.8 mt . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.007 178.343 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.421 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 121.106 0.479 . . . . 0.0 109.856 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 25.0 m -66.94 -43.5 83.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.42 177.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.08 -49.19 78.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.696 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.445 ' HG3' ' N ' ' A' ' 9' ' ' VAL . 12.4 ptm180 -65.44 -45.3 84.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.437 -175.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.445 ' N ' ' HG3' ' A' ' 8' ' ' ARG . 88.4 t -61.73 -43.65 97.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 C-N-CA 121.124 -0.231 . . . . 0.0 111.047 -177.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.7 t -63.96 -31.35 52.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.915 0.388 . . . . 0.0 110.696 178.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.1 m -83.18 -17.33 43.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.257 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -93.08 -4.3 52.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.328 0.585 . . . . 0.0 110.095 175.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.1 mt -116.63 89.07 26.82 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.619 176.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -40.67 139.52 1.24 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.058 3.172 . . . . 0.0 113.687 -176.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.599 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.5 m -81.23 151.46 4.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.325 -177.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.6 mp -83.98 169.53 14.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.436 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.405 ' N ' ' HD2' ' A' ' 17' ' ' LYS . 2.6 mptp? -122.64 -48.39 2.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.959 0.409 . . . . 0.0 110.235 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.8 m -84.32 95.54 8.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.407 0.623 . . . . 0.0 110.957 -177.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -89.22 79.46 7.11 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.444 0.64 . . . . 0.0 110.089 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -122.68 168.23 12.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.075 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.53 ' HA3' ' O ' ' A' ' 90' ' ' TYR . . . -125.38 177.89 16.79 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.247 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.551 ' HB2' HG23 ' A' ' 88' ' ' ILE . 18.0 Cg_exo -66.45 -4.46 10.81 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 123.317 2.678 . . . . 0.0 112.959 -175.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.465 ' HD2' HG22 ' A' ' 88' ' ' ILE . 15.0 mmm180 -64.65 -35.44 81.02 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.946 0.403 . . . . 0.0 109.948 174.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -110.25 106.41 15.8 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.59 ' O ' HG23 ' A' ' 29' ' ' VAL . 74.6 mtm180 -61.6 -39.46 91.32 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.807 -173.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -70.02 -47.47 61.97 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.899 0.38 . . . . 0.0 110.958 -175.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 27' ' ' LEU . 4.4 mm? -67.96 -28.43 67.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.373 177.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 59.6 t-105 -64.59 -39.46 93.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.891 174.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.59 HG23 ' O ' ' A' ' 25' ' ' ARG . 72.4 t -55.8 -44.27 76.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.489 175.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -64.46 -50.74 66.31 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.369 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.417 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 22.8 ttt180 -62.47 -36.59 82.95 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.07 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.81 -40.86 69.95 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 178.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.547 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 66.9 mttm -65.86 -44.65 84.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.3 177.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -64.71 -41.46 95.97 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.531 -178.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -58.87 -43.33 90.82 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.2 0.524 . . . . 0.0 109.661 175.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -65.74 -31.35 72.3 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.451 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.547 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 28.9 mm-40 -61.01 -47.44 86.45 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.806 0.336 . . . . 0.0 110.419 178.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.0 m -63.04 -40.62 98.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.491 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.483 ' O ' HG23 ' A' ' 43' ' ' VAL . 95.7 mt -63.78 -55.43 23.13 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.229 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 97.9 mt -56.63 -43.08 78.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 O-C-N 123.29 0.368 . . . . 0.0 111.267 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.1 tpp85 -57.99 -47.19 83.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.605 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -69.82 -37.69 76.31 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.782 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 39' ' ' LEU . 75.3 t -60.56 -40.24 83.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.878 0.37 . . . . 0.0 110.675 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.591 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 40.7 mt-10 -70.32 -37.86 74.81 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.979 177.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -57.69 -42.61 83.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.426 0.631 . . . . 0.0 109.698 172.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.606 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 15.3 m-20 -62.55 -57.56 10.68 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.708 -1.133 . . . . 0.0 112.008 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.591 ' HG2' ' HA ' ' A' ' 44' ' ' GLU . 21.7 ptmt -66.6 -25.64 66.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.483 -175.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -76.42 -21.02 56.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.951 0.405 . . . . 0.0 110.692 176.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -97.95 4.04 49.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.059 175.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.4 t70 60.06 26.38 15.71 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.956 0.884 . . . . 0.0 110.908 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -134.67 87.55 2.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.005 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.606 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 41.9 t0 -83.06 156.71 23.21 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.053 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.566 ' HB3' ' CD2' ' A' ' 54' ' ' PHE . 1.2 m95 -100.25 -56.9 2.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.863 -170.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.566 ' CD2' ' HB3' ' A' ' 53' ' ' TRP . 44.5 p90 -161.51 157.52 25.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.327 0.584 . . . . 0.0 111.87 -172.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.449 ' HD2' ' HA ' ' A' ' 55' ' ' ARG . 19.7 tpt180 -108.46 123.72 49.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 168.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.0 tp -130.92 124.12 30.41 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.061 0.458 . . . . 0.0 110.683 -173.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -101.9 158.51 16.08 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.465 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.2 m -141.84 149.92 40.93 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.753 0.311 . . . . 0.0 110.687 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.0 p-10 -79.27 169.97 17.33 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 172.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.662 ' HD3' ' H ' ' A' ' 60' ' ' LYS . 1.9 mppt? -63.31 -24.04 67.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.764 0.316 . . . . 0.0 111.534 -175.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -82.0 -22.41 36.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.911 -177.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.25 21.93 79.26 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.783 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.518 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . 15.4 p -99.42 -28.09 13.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.176 0.512 . . . . 0.0 111.182 -177.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.733 HH22 ' HB3' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -119.27 109.11 15.44 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.462 -178.399 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.99 ' HB2' ' HB2' ' A' ' 84' ' ' PHE . 27.1 m95 -107.51 140.18 40.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.138 177.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -152.35 142.42 22.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.789 0.328 . . . . 0.0 110.687 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 173.71 -149.82 11.33 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -142.02 138.61 31.95 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.894 0.347 . . . . 0.0 110.596 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.445 ' HA ' ' HB3' ' A' ' 54' ' ' PHE . 49.0 t -122.34 150.93 41.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.008 -178.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.722 ' HB3' ' HA ' ' A' ' 79' ' ' GLU . 47.5 p90 -159.9 159.98 33.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.817 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -149.2 139.64 22.44 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 172.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 26.1 mm -84.03 114.4 24.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.011 0.434 . . . . 0.0 110.938 -173.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -127.11 122.19 33.55 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.476 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 62.3 34.07 16.09 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 123.667 0.604 . . . . 0.0 110.075 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 75' ' ' LEU . 1.8 tm? 75.36 -20.03 0.37 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.927 -178.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.4 mt -66.2 115.79 6.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.737 0.303 . . . . 0.0 110.86 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -94.34 106.97 18.95 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.478 ' HD1' ' HE1' ' A' ' 80' ' ' PHE . 6.7 p90 -121.8 117.69 27.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.129 0.49 . . . . 0.0 110.432 177.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.722 ' HA ' ' HB3' ' A' ' 70' ' ' TRP . 0.9 OUTLIER -110.72 138.98 46.42 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.867 -177.424 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.478 ' HE1' ' HD1' ' A' ' 78' ' ' TYR . 65.5 m-85 -127.83 129.79 47.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.63 -177.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -73.65 125.0 27.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.226 0.536 . . . . 0.0 110.206 174.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.509 HG22 HG13 ' A' ' 99' ' ' VAL . 38.3 pt -127.92 155.34 39.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.659 -175.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.733 ' HB3' HH22 ' A' ' 64' ' ' ARG . 44.7 mt-10 -127.37 163.0 24.98 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.771 175.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.99 ' HB2' ' HB2' ' A' ' 65' ' ' TRP . 93.2 m-85 -134.94 143.32 46.82 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.435 176.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -121.56 137.96 54.51 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.518 ' HB ' ' HA ' ' A' ' 63' ' ' THR . 51.0 mm -108.3 89.38 5.79 Favored Pre-proline 0 C--N 1.312 -1.057 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.463 -178.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -56.98 150.31 56.55 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.101 1.867 . . . . 0.0 110.531 175.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.551 HG23 ' HB2' ' A' ' 22' ' ' PRO . 2.1 mt -79.16 1.48 2.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.544 0.688 . . . . 0.0 109.996 -174.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.1 p -88.02 -4.94 58.74 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.737 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.717 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 33.5 t80 -65.39 145.51 99.06 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.528 175.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.717 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 98.1 Cg_endo -95.75 5.53 45.67 Favored 'Cis proline' 0 N--CA 1.455 -0.753 0 C-N-CA 124.453 -1.061 . . . . 0.0 113.029 0.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 10.2 m -62.13 -33.7 74.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.537 0.684 . . . . 0.0 109.653 178.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.0 m -111.59 135.47 52.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.065 171.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.56 146.16 98.99 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.051 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.534 ' HD3' ' CE1' ' A' ' 90' ' ' TYR . 57.3 Cg_endo -73.74 159.07 46.16 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.54 2.16 . . . . 0.0 111.697 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -104.5 129.8 52.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.187 0.518 . . . . 0.0 111.178 -175.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.499 HD12 HD13 ' A' ' 115' ' ' ILE . 54.4 mt -101.64 123.64 54.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.215 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -113.08 135.0 54.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.115 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.509 HG13 HG22 ' A' ' 82' ' ' ILE . 18.7 t -121.09 87.74 44.21 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-O 120.588 0.233 . . . . 0.0 111.407 -176.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.45 -20.63 71.08 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.993 2.462 . . . . 0.0 112.347 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.41 ' HG2' ' HA ' ' A' ' 80' ' ' PHE . 9.8 tp10 -71.75 -29.03 64.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.204 0.526 . . . . 0.0 110.602 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.0 mt -98.28 -31.43 12.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -50.86 109.64 0.34 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 123.724 0.64 . . . . 0.0 111.554 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 92.23 -36.75 3.57 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.747 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.407 ' HG2' HG11 ' A' ' 158' ' ' VAL . 37.2 ttpt -81.45 -26.55 35.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.081 0.467 . . . . 0.0 111.031 -175.191 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 5.8 t . . . . . 0 C--N 1.325 -0.475 0 CA-C-O 120.838 0.352 . . . . 0.0 110.596 178.745 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.193 0 N-CA-C 112.419 -0.272 . . . . 0.0 112.419 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 97' ' ' ILE . 17.1 ptpt -101.87 158.68 15.95 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.499 HD13 HD12 ' A' ' 97' ' ' ILE . 38.6 pt -72.28 147.98 9.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.958 0.409 . . . . 0.0 111.323 -176.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 2.0 p -97.97 116.98 31.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.523 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 96.7 mt -92.77 158.69 15.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.988 0.423 . . . . 0.0 111.28 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.2 t -87.62 157.39 19.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.207 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.28 -53.35 59.16 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 -172.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -71.59 -10.01 59.11 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -173.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -71.06 -33.96 70.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.928 0.394 . . . . 0.0 110.238 178.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -62.14 -55.39 41.04 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.632 -177.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -62.42 -34.84 75.27 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.584 1.523 . . . . 0.0 111.917 175.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 49.2 tp -59.35 -46.41 88.7 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.368 177.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 57.3 t-105 -59.33 -56.03 27.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.707 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.33 -36.51 82.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.159 -175.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -67.72 -31.89 72.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.301 -177.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -95.96 20.97 9.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.455 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 90.4 t -91.28 137.6 26.11 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 172.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.444 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 97.5 Cg_endo -93.36 -152.88 0.37 Allowed 'Cis proline' 0 N--CA 1.46 -0.493 0 C-N-CA 124.265 -1.139 . . . . 0.0 113.58 2.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.599 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 9.6 mtmp? 77.21 -5.96 2.08 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.955 0.902 . . . . 0.0 111.614 -176.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -80.74 152.22 28.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.291 174.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.417 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -156.72 179.17 32.74 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.797 -0.716 . . . . 0.0 111.977 -174.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' A' ' 138' ' ' MET . 53.9 tp -64.73 -40.76 95.87 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 122.57 0.348 . . . . 0.0 111.197 -174.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.42 -35.91 76.92 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.499 0.666 . . . . 0.0 110.751 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . 0.417 ' HE1' ' HA ' ' A' ' 15' ' ' VAL . 47.7 m80 -71.23 -33.02 69.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.166 178.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 62.0 tp -66.49 -33.81 76.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.321 176.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 134' ' ' LEU . 23.7 mmt -56.87 -55.65 31.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.098 0.475 . . . . 0.0 110.173 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.17 -40.77 82.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.674 -0.693 . . . . 0.0 112.657 -177.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.1 mt -86.36 -28.97 23.31 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -171.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -115.61 -57.13 0.34 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.285 -0.959 . . . . 0.0 113.165 -175.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.496 HD12 HD13 ' A' ' 97' ' ' ILE . 10.2 tt -62.48 -49.51 75.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.64 0.257 . . . . 0.0 111.208 -174.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.25 -61.45 7.38 Favored Glycine 0 CA--C 1.524 0.65 0 CA-C-N 116.178 -0.465 . . . . 0.0 113.49 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.83 -35.77 89.39 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.891 2.394 . . . . 0.0 113.059 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -65.22 -40.93 94.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.613 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 80.1 mt -59.95 -33.58 72.11 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.805 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.73 -13.87 62.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.663 -177.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 44.8 t -103.17 -35.85 3.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.091 0.472 . . . . 0.0 110.641 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -85.71 -51.89 6.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.027 -174.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.561 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 40.8 mm -60.67 -52.11 74.9 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -170.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.561 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 56.2 Cg_exo -53.74 -34.71 75.74 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 122.18 1.92 . . . . 0.0 112.707 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -67.14 -41.03 86.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.595 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 57.8 tp -68.81 -35.72 77.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.082 0.468 . . . . 0.0 110.371 176.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.516 HG12 HD12 ' A' ' 159' ' ' ILE . 77.2 mt -62.4 -48.3 88.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.363 177.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -66.01 -26.06 67.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.842 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . 0.565 ' HE3' HG21 ' A' ' 158' ' ' VAL . 34.8 ttpt -74.0 -16.03 61.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.987 0.422 . . . . 0.0 110.268 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 83.62 18.32 64.16 Favored Glycine 0 C--O 1.229 -0.164 0 C-N-CA 121.078 -0.582 . . . . 0.0 113.607 172.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . 0.565 HG21 ' HE3' ' A' ' 156' ' ' LYS . 41.1 t -88.4 -18.59 8.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.526 0.679 . . . . 0.0 110.751 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.516 HD12 HG12 ' A' ' 154' ' ' ILE . 66.0 mt . . . . . 0 C--N 1.322 -0.624 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.47 ' HA ' ' NE ' ' A' ' 8' ' ' ARG . . . . . . . . 0 CA--C 1.521 -0.144 0 CA-C-O 120.907 0.384 . . . . 0.0 110.745 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.452 ' O ' HG23 ' A' ' 10' ' ' VAL . 24.8 m -56.62 -49.53 74.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.186 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.6 ptt180 -67.79 -38.24 83.07 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -173.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.47 ' NE ' ' HA ' ' A' ' 5' ' ' ALA . 17.3 ptt180 -71.17 -32.23 68.65 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.535 -177.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 5' ' ' ALA . 79.1 t -68.64 -45.59 81.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 6' ' ' THR . 57.4 t -67.89 -26.5 34.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.891 0.377 . . . . 0.0 110.899 178.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.3 t -70.03 -50.79 37.83 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.741 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.424 ' O ' ' HD2' ' A' ' 41' ' ' ARG . 50.2 mt-10 -83.94 -8.96 59.04 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -176.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.416 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 54.0 mt -104.74 88.2 2.16 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 170.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.6 Cg_endo -49.42 146.09 14.83 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.919 3.079 . . . . 0.0 113.657 -170.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.0 m -77.55 160.8 4.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.255 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.505 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 6.1 mp -110.05 148.99 30.65 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.161 -176.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -110.24 -20.96 12.47 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 -174.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 32.7 m -88.44 115.86 26.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.771 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -112.49 104.34 12.45 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -151.07 157.94 43.44 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.266 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.17 -177.05 29.04 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.152 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.95 5.68 5.15 Favored 'Trans proline' 0 CA--C 1.531 0.348 0 C-N-CA 122.913 2.409 . . . . 0.0 113.103 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.811 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 0.4 OUTLIER -92.52 -46.61 7.55 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 177.598 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -80.16 75.9 6.93 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 174.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.591 ' HA ' ' HB3' ' A' ' 28' ' ' TRP . 93.8 mtt180 -71.22 -25.06 62.34 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -168.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.602 ' HG3' HD22 ' A' ' 27' ' ' LEU . 7.5 pt-20 -63.53 -35.78 81.61 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.371 171.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.602 HD22 ' HG3' ' A' ' 26' ' ' GLU . 3.8 mm? -81.29 -29.52 34.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.046 0.451 . . . . 0.0 109.954 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.591 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 64.5 t-105 -61.16 -39.18 89.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.445 177.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 25' ' ' ARG . 87.2 t -59.55 -40.96 83.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 121.107 0.479 . . . . 0.0 110.414 175.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -66.86 -41.76 86.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.226 0.536 . . . . 0.0 109.678 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.551 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 11.8 tpt180 -62.23 -36.54 82.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.805 176.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 61.9 mt -57.8 -54.9 41.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.215 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.47 ' HB2' ' HE3' ' A' ' 33' ' ' LYS . 19.1 ptmt -61.23 -37.02 81.57 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.572 -176.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -59.31 -50.87 72.32 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.133 0.492 . . . . 0.0 110.68 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.452 ' HA ' HD21 ' A' ' 16' ' ' LEU . 8.5 tp10 -65.44 -42.05 92.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.138 -178.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.474 ' O ' HG13 ' A' ' 40' ' ' ILE . 23.5 m-85 -60.53 -45.36 94.11 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.165 178.284 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -60.66 -40.63 92.77 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.655 0.264 . . . . 0.0 110.848 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.405 ' HA ' ' HG2' ' A' ' 14' ' ' PRO . 8.3 t -64.73 -46.89 80.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.97 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.497 ' O ' HG23 ' A' ' 43' ' ' VAL . 64.0 mt -56.07 -53.92 51.26 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.293 177.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.523 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 82.5 mt -55.98 -40.67 64.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.883 -175.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.483 ' O ' ' HD3' ' A' ' 41' ' ' ARG . 0.0 OUTLIER -61.33 -44.34 97.35 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.704 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -65.91 -36.99 84.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.11 178.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 39' ' ' LEU . 94.9 t -64.89 -42.46 94.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.62 177.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 42.1 mt-10 -53.51 -56.21 18.9 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 123.315 0.384 . . . . 0.0 111.289 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -52.22 -41.85 63.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.146 0.498 . . . . 0.0 111.075 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.599 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 83.3 m-20 -72.47 -51.07 21.73 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.602 -176.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 31.9 mmmt -59.08 -38.93 80.61 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.557 0.218 . . . . 0.0 111.14 176.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -63.57 -41.46 98.38 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.499 178.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.18 3.69 22.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.865 0.364 . . . . 0.0 110.495 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.1 t70 67.9 9.38 7.1 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.681 0.792 . . . . 0.0 111.23 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.599 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 5.9 t30 -98.78 77.3 2.24 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.77 102.5 0.59 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.386 0.613 . . . . 0.0 109.848 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.574 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -67.04 -57.16 7.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.66 -1.155 . . . . 0.0 112.437 -168.808 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.574 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 37.1 p90 -156.72 161.44 39.82 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.27 0.557 . . . . 0.0 111.152 -171.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.499 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 18.4 tpp85 -121.46 123.42 42.02 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 171.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 19.4 tp -124.03 122.68 38.54 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.031 0.443 . . . . 0.0 110.401 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -105.59 156.06 18.61 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.442 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.8 p -135.54 159.72 40.73 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.767 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.406 ' ND2' ' HB3' ' A' ' 64' ' ' ARG . 97.8 m-20 -73.1 176.32 5.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.104 173.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -57.56 -43.08 84.21 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.915 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -81.22 -20.47 40.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.718 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.82 25.97 65.93 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.646 -0.787 . . . . 0.0 111.314 -173.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.7 p -85.71 -4.89 59.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.972 0.415 . . . . 0.0 112.014 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.406 ' HB3' ' ND2' ' A' ' 59' ' ' ASN . 56.0 ttt180 -155.95 129.86 8.58 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 -179.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -121.22 142.09 50.24 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 -177.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -155.0 160.99 41.48 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 -177.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.499 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 163.68 -160.09 32.83 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.537 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -115.21 147.07 40.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.811 0.339 . . . . 0.0 110.91 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.588 ' SG ' ' HB2' ' A' ' 80' ' ' PHE . 5.3 p -117.49 134.26 55.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.134 172.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.457 ' CD1' ' HG2' ' A' ' 79' ' ' GLU . 13.6 m-90 -114.24 128.65 56.46 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.221 0.534 . . . . 0.0 111.559 -175.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -136.21 120.6 18.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.088 175.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.415 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.7 mp -105.61 123.73 60.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.981 0.419 . . . . 0.0 110.486 -176.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -128.46 108.31 10.44 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.717 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.27 57.69 4.33 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.674 0.609 . . . . 0.0 111.31 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.8 mt 70.11 -0.6 2.72 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.355 -0.839 . . . . 0.0 113.141 175.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 66.5 mt -91.91 113.69 26.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.999 0.428 . . . . 0.0 110.571 177.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.3 tttt -99.95 96.3 7.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.181 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -104.54 125.96 51.18 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.053 0.454 . . . . 0.0 110.182 176.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.457 ' HG2' ' CD1' ' A' ' 70' ' ' TRP . 28.4 mt-10 -106.88 135.41 48.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.186 -174.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.588 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . 84.7 m-85 -120.9 129.97 53.71 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.679 0.276 . . . . 0.0 110.871 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -88.09 121.09 30.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.859 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.403 HG22 HG22 ' A' ' 99' ' ' VAL . 40.1 pt -125.34 157.19 34.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.541 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -158.57 158.99 35.0 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.723 174.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.42 ' CE1' HD21 ' A' ' 134' ' ' LEU . 30.5 p90 -159.14 153.79 24.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.349 177.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.433 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 8.7 p-10 -99.41 166.6 11.1 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.89 -177.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.3 mm -111.95 89.68 12.0 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.201 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.433 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 11.0 Cg_exo -66.02 164.66 26.62 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.551 2.167 . . . . 0.0 112.12 -177.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 58.0 mt -66.49 -22.14 29.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.36 0.6 . . . . 0.0 110.052 177.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -82.23 3.38 27.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.041 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -77.94 142.72 65.17 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -96.23 10.51 41.76 Favored 'Cis proline' 0 N--CA 1.457 -0.645 0 C-N-CA 124.178 -1.176 . . . . 0.0 113.126 -1.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.523 ' HA ' HG11 ' A' ' 129' ' ' VAL . 15.9 m -56.51 -35.3 67.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.32 0.581 . . . . 0.0 110.99 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.4 m -130.66 127.62 39.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.886 175.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.4 ' HB2' ' CE2' ' A' ' 125' ' ' TRP . . . -73.38 143.44 82.81 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.824 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -83.63 134.0 6.31 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.69 2.26 . . . . 0.0 112.226 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.625 ' HB2' ' HD2' ' A' ' 114' ' ' LYS . 2.9 mp0 -62.24 132.64 53.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.149 176.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.501 ' O ' HG12 ' A' ' 115' ' ' ILE . 57.7 mt -75.64 143.47 13.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.391 -178.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.517 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -107.45 124.1 49.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.792 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.403 HG22 HG22 ' A' ' 82' ' ' ILE . 25.6 t -119.98 87.22 38.25 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.016 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -70.73 6.2 1.74 Allowed 'Trans proline' 0 N--CA 1.474 0.379 0 C-N-CA 123.5 2.8 . . . . 0.0 114.046 -173.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -103.95 -44.03 5.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.836 0.351 . . . . 0.0 110.84 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.826 ' HA ' ' HD3' ' A' ' 105' ' ' LYS . 91.4 mt -83.47 0.33 46.78 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -172.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -64.6 -15.1 60.6 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -171.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -114.8 2.71 23.03 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.56 -0.828 . . . . 0.0 113.633 -177.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.826 ' HD3' ' HA ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -127.96 -20.34 3.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.688 0.744 . . . . 0.0 112.37 -178.466 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.578 HG22 ' O ' ' A' ' 102' ' ' LEU . 7.7 t . . . . . 0 C--N 1.331 -0.238 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.382 173.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . 0.517 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . . . . . . 0 N--CA 1.449 -0.475 0 N-CA-C 112.292 -0.323 . . . . 0.0 112.292 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.625 ' HD2' ' HB2' ' A' ' 96' ' ' GLU . 64.1 mmtt -70.03 111.77 5.94 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 122.422 0.289 . . . . 0.0 110.978 -179.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 97' ' ' ILE . 34.9 pt -81.65 164.17 3.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.312 -178.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 53.0 t -99.85 119.89 38.9 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.058 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 96.1 mt -79.17 177.07 9.1 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.859 175.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.65 140.18 58.84 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.561 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.09 -46.56 61.83 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -171.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.6 m170 -92.91 -5.93 49.73 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.414 -174.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -71.38 -41.18 69.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.357 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.566 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 79.2 tttt -65.79 -49.89 57.11 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.68 -177.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.566 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 34.6 Cg_exo -60.99 -32.15 92.08 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.839 1.693 . . . . 0.0 111.83 175.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 52.3 tp -60.82 -46.98 88.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.984 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.492 ' O ' HG23 ' A' ' 129' ' ' VAL . 17.7 t-105 -54.23 -56.66 16.18 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.565 177.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -58.23 -35.21 71.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.648 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 127' ' ' ARG . 6.1 ttp180 -68.31 -36.31 79.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.066 0.46 . . . . 0.0 110.801 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -79.76 -31.4 40.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.513 -173.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.523 HG11 ' HA ' ' A' ' 92' ' ' THR . 94.8 t -53.5 137.24 51.75 Favored Pre-proline 0 N--CA 1.468 0.433 0 O-C-N 123.394 0.434 . . . . 0.0 110.545 176.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.493 ' HA ' HG13 ' A' ' 129' ' ' VAL . 86.5 Cg_endo -90.43 -147.55 0.28 Allowed 'Cis proline' 0 C--N 1.349 0.572 0 C-N-CA 124.28 -1.133 . . . . 0.0 113.204 5.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 33.1 ttpt 67.5 4.69 3.93 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.409 0.684 . . . . 0.0 111.439 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -101.56 159.96 14.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.789 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.551 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -136.78 158.25 24.07 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.947 -174.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.42 HD21 ' CE1' ' A' ' 84' ' ' PHE . 53.6 tp -63.84 -38.76 92.29 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.23 0.612 . . . . 0.0 111.198 -177.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.59 -31.03 56.24 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.407 0.622 . . . . 0.0 111.165 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -71.2 -31.46 67.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.514 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 63.1 tp -61.73 -48.34 81.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.943 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 5.4 mpp? -66.25 -41.03 90.52 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.738 0.304 . . . . 0.0 111.206 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.18 -49.99 44.83 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 87.8 mt -88.86 -21.71 23.54 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -172.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -106.77 -62.58 0.59 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.01 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.501 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 53.9 tp -64.75 -42.15 95.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 -175.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.03 -61.87 6.49 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 121.248 -0.501 . . . . 0.0 112.991 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . 0.478 ' O ' HG23 ' A' ' 148' ' ' VAL . 48.9 Cg_exo -58.66 -33.84 98.52 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.635 2.223 . . . . 0.0 112.699 176.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 39.9 t90 -59.72 -44.31 93.78 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.994 0.426 . . . . 0.0 110.258 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 76.8 mt -62.75 -37.75 87.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.719 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.9 -11.84 61.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.907 -176.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 144' ' ' PRO . 59.5 t -89.13 -46.66 15.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.787 0.327 . . . . 0.0 110.828 178.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . 0.444 ' O ' HD23 ' A' ' 153' ' ' LEU . 59.2 mm-40 -83.8 -43.14 15.72 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -173.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.504 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 1.6 mp -54.21 -50.97 81.63 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -170.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.504 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 11.6 Cg_endo -54.91 -34.0 84.31 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 122.108 1.872 . . . . 0.0 113.055 -178.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -87.5 -43.2 12.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.98 0.419 . . . . 0.0 110.75 -177.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 149' ' ' GLU . 4.2 mm? -60.44 -35.58 76.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.639 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.534 ' HA ' ' HB ' ' A' ' 159' ' ' ILE . 67.9 mt -65.25 -40.32 88.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.066 0.46 . . . . 0.0 110.187 175.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -66.14 -34.75 78.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.564 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . 0.413 ' HD3' HD13 ' A' ' 153' ' ' LEU . 58.8 mtpt -65.29 -17.93 64.9 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.28 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 81.19 22.03 61.61 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.7 178.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 28.5 m -103.2 -21.16 5.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.855 0.359 . . . . 0.0 110.797 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.534 ' HB ' ' HA ' ' A' ' 154' ' ' ILE . 45.0 mm . . . . . 0 C--N 1.326 -0.417 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 176.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.465 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 120.903 0.383 . . . . 0.0 110.856 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.1 m -58.88 -51.14 71.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.609 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -65.26 -38.07 89.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.702 -174.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.1 ppt_? -75.16 -23.5 57.78 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.247 -177.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 5' ' ' ALA . 76.1 t -75.56 -50.68 22.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.826 0.346 . . . . 0.0 110.217 175.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.8 t -62.29 -30.4 48.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.876 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.8 t -64.31 -21.89 66.76 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.386 -178.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -95.98 2.37 53.41 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.975 0.416 . . . . 0.0 110.812 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.462 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 32.1 mt -118.93 88.0 35.1 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.462 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 6.4 Cg_endo -46.76 148.64 3.63 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 124.398 3.399 . . . . 0.0 114.382 -170.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.4 m -83.36 152.88 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.237 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.761 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 6.1 mp -103.21 136.15 43.53 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.382 -175.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.47 ' HD2' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -94.76 -45.62 7.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.188 0.518 . . . . 0.0 110.779 -173.434 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.44 HG21 ' HB3' ' A' ' 30' ' ' GLN . 0.6 OUTLIER -88.86 83.35 6.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.224 -174.681 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.455 ' OD1' ' HD2' ' A' ' 31' ' ' ARG . 84.9 m-20 -124.62 127.37 47.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.413 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.457 ' HB3' ' HB3' ' A' ' 27' ' ' LEU . . . -140.45 -65.5 0.45 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.866 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 158.85 166.71 18.43 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.873 -0.679 . . . . 0.0 111.694 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.9 -10.87 29.47 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.061 2.508 . . . . 0.0 111.89 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.507 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 4.8 mmp_? -63.63 -44.47 93.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.417 176.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.539 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 10.3 t0 -91.74 111.28 22.73 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 -178.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.459 ' O ' HG23 ' A' ' 29' ' ' VAL . 18.1 mtp180 -55.14 -51.28 66.95 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.026 -178.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.77 -44.02 94.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.901 0.381 . . . . 0.0 111.345 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.539 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 4.4 mm? -70.55 -29.39 65.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.204 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.546 ' CH2' HG21 ' A' ' 86' ' ' ILE . 75.6 t-105 -73.99 -42.0 61.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 177.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 25' ' ' ARG . 72.1 t -60.97 -42.51 93.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.982 0.42 . . . . 0.0 110.082 176.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.454 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 2.4 mm100 -62.15 -52.43 63.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.604 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.534 HH12 HD22 ' A' ' 16' ' ' LEU . 1.8 ttt85 -56.62 -39.37 73.49 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.144 0.278 . . . . 0.0 111.338 178.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.523 ' HG ' ' CE2' ' A' ' 36' ' ' TYR . 18.1 tp -57.34 -47.57 81.26 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.773 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -67.5 -38.97 85.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.863 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 6.7 mm-40 -55.76 -50.67 69.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.232 0.539 . . . . 0.0 110.312 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.539 ' HA ' HD21 ' A' ' 16' ' ' LEU . 12.6 tp10 -65.53 -37.85 87.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.424 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.523 ' CE2' ' HG ' ' A' ' 32' ' ' LEU . 10.7 m-85 -59.78 -38.28 81.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.145 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -60.59 -45.12 95.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.993 0.425 . . . . 0.0 110.252 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.7 t -63.77 -47.04 82.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.552 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.436 ' O ' HG23 ' A' ' 43' ' ' VAL . 94.7 mt -58.78 -48.08 82.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.093 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 36' ' ' TYR . 80.0 mt -57.86 -47.14 86.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.778 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -63.43 -40.25 96.67 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.704 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -59.76 -48.87 79.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.524 HG12 ' HE2' ' A' ' 47' ' ' LYS . 94.3 t -59.19 -38.41 74.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.781 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.63 -50.31 74.31 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 173.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.2 -40.47 81.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.918 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.431 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 16.2 m120 -55.72 -55.28 34.14 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.916 176.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.524 ' HE2' HG12 ' A' ' 43' ' ' VAL . 53.8 mttm -66.21 -34.81 78.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.973 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -68.41 -28.32 66.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.704 0.287 . . . . 0.0 111.384 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -93.81 2.16 56.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.754 0.312 . . . . 0.0 110.788 177.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.1 t0 64.24 20.14 12.06 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.827 0.822 . . . . 0.0 110.677 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -118.39 72.96 0.89 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.627 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.431 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 14.8 t70 -91.85 88.81 6.78 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.172 -179.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.444 ' HB2' ' O ' ' A' ' 70' ' ' TRP . 24.1 p-90 -117.28 2.95 12.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.986 -173.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -119.23 129.88 55.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.498 0.666 . . . . 0.0 112.195 -167.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -140.45 124.23 17.24 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.906 -1.043 . . . . 0.0 108.376 174.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.7 tp -134.49 127.99 32.52 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.764 0.316 . . . . 0.0 110.259 -178.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -128.39 160.42 32.28 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.5 p -142.23 172.72 12.31 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.997 0.427 . . . . 0.0 111.019 -176.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 33.1 p30 -89.66 163.55 15.09 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 168.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.472 ' HE2' ' HB2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -66.27 -21.39 66.28 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -172.825 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -74.38 -25.94 59.8 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.572 175.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.03 22.36 78.0 Favored Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.162 -177.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 26.8 p -89.97 -26.94 20.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.864 0.364 . . . . 0.0 111.336 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.3 mtt180 -127.58 132.99 49.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.034 0.445 . . . . 0.0 110.553 175.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -115.82 128.21 55.65 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.244 175.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.7 p90 -130.4 129.32 42.91 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -131.24 166.84 22.67 Favored Glycine 0 N--CA 1.435 -1.401 0 C-N-CA 119.838 -1.173 . . . . 0.0 113.28 -172.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -124.24 131.23 53.51 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.0 p -128.64 131.6 48.07 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.418 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.444 ' O ' ' HB2' ' A' ' 53' ' ' TRP . 6.7 p90 -133.26 121.47 22.5 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.261 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.435 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 14.5 t80 -117.82 129.44 55.66 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.896 -172.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.449 ' N ' HD12 ' A' ' 72' ' ' ILE . 4.0 mp -93.83 113.79 29.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -138.21 118.68 13.83 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.653 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 56.79 45.21 22.09 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.58 0.55 . . . . 0.0 110.84 -176.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.407 HD13 ' HA ' ' A' ' 75' ' ' LEU . 4.4 mm? 67.26 4.74 3.83 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.479 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 99.2 mt -96.96 113.14 24.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.106 0.479 . . . . 0.0 110.126 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -96.44 93.47 6.84 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.32 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.435 ' CE1' ' HB3' ' A' ' 71' ' ' TYR . 14.2 p90 -99.66 150.13 22.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.597 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -124.37 136.27 53.95 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.499 -174.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.412 ' HD1' ' HG2' ' A' ' 101' ' ' GLU . 96.4 m-85 -133.5 137.96 45.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.948 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -102.75 137.1 41.41 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.011 0.434 . . . . 0.0 110.051 176.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 99' ' ' VAL . 40.8 pt -136.41 158.16 37.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.396 -176.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -155.79 156.4 34.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.245 0.545 . . . . 0.0 110.829 175.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.589 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 42.4 p90 -155.46 149.81 25.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.23 177.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -102.36 163.52 12.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.503 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.546 HG21 ' CH2' ' A' ' 28' ' ' TRP . 50.8 mm -105.66 91.49 5.12 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.189 -178.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.04 164.01 10.86 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.677 2.251 . . . . 0.0 112.798 -179.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 73.4 mt -66.33 -33.39 63.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.196 -177.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.9 p -85.19 17.57 2.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.25 0.548 . . . . 0.0 111.64 -176.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.502 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 69.0 t80 -79.15 143.4 60.86 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 176.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.502 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.4 Cg_endo -96.7 14.74 36.42 Favored 'Cis proline' 0 N--CA 1.459 -0.509 0 C-N-CA 124.497 -1.043 . . . . 0.0 113.689 2.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.5 m -65.57 -26.93 68.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.543 0.687 . . . . 0.0 109.972 178.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.3 m -114.01 131.57 56.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.543 172.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -70.73 144.92 91.6 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.804 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 5.7 Cg_exo -72.8 143.41 37.14 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.8 2.334 . . . . 0.0 112.307 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.499 ' HB3' ' HD3' ' A' ' 114' ' ' LYS . 48.0 mt-10 -86.63 101.17 13.0 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.993 0.425 . . . . 0.0 110.046 179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.589 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 61.6 mt -74.35 125.42 33.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.781 -178.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -105.58 134.14 49.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.54 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.525 HG22 HG22 ' A' ' 82' ' ' ILE . 42.5 t -127.78 86.84 57.33 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.54 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.04 -24.53 73.93 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.861 2.374 . . . . 0.0 112.664 -175.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.412 ' HG2' ' HD1' ' A' ' 80' ' ' PHE . 10.4 tp10 -63.58 -38.9 92.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.574 176.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 98.7 mt -108.99 34.16 3.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.312 -177.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -63.01 -16.98 61.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.03 -175.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -171.74 30.17 0.12 Allowed Glycine 0 C--N 1.314 -0.65 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.145 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -100.08 8.2 44.11 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -175.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.2 t . . . . . 0 C--N 1.324 -0.507 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 174.994 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.208 0 N-CA-C 112.302 -0.319 . . . . 0.0 112.302 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.499 ' HD3' ' HB3' ' A' ' 96' ' ' GLU . 59.4 mttp -109.36 139.18 44.64 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 35.4 pt -68.02 146.69 12.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.149 0.499 . . . . 0.0 112.314 -173.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.2 t -104.53 100.07 9.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.885 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 97.3 mt -88.16 171.84 9.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.334 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 10.2 t -64.83 142.07 58.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.795 0.331 . . . . 0.0 110.161 178.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -65.42 -25.09 67.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.521 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -79.93 -6.67 57.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.734 0.302 . . . . 0.0 111.61 -177.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -71.71 -36.44 70.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.707 0.289 . . . . 0.0 110.529 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.453 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 99.8 mttt -68.21 -50.51 29.46 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.987 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 10.3 Cg_endo -55.29 -37.81 94.2 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 121.932 1.755 . . . . 0.0 111.88 172.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.77 -46.05 87.01 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.721 0.296 . . . . 0.0 110.27 176.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.58 ' O ' HG23 ' A' ' 129' ' ' VAL . 17.9 t-105 -53.16 -57.6 9.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.624 176.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.43 -27.35 68.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.647 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 -74.44 -25.29 59.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.958 0.409 . . . . 0.0 110.945 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -104.01 15.12 29.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.858 -175.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 125' ' ' TRP . 95.9 t -98.57 137.26 20.63 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.434 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 82.0 Cg_endo -89.98 -158.25 1.02 Allowed 'Cis proline' 0 N--CA 1.46 -0.473 0 C-N-CA 123.871 -1.304 . . . . 0.0 113.243 -0.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.761 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 57.8 mttp 75.51 0.79 3.5 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.898 0.879 . . . . 0.0 111.73 -174.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -79.08 169.77 17.68 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -149.32 160.48 28.45 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.652 -176.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' A' ' 137' ' ' LEU . 49.3 tp -69.85 -38.45 76.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 122.678 0.391 . . . . 0.0 110.368 -177.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.9 -30.82 64.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.246 0.546 . . . . 0.0 110.809 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -70.38 -31.9 69.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.45 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.424 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 49.5 tp -60.52 -51.96 67.22 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.137 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 5.4 mpp? -67.19 -33.61 75.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.732 0.301 . . . . 0.0 111.141 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.7 -48.39 47.68 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.976 -178.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 84.5 mt -97.97 -2.94 39.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -173.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -119.13 -64.82 0.29 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.316 -0.945 . . . . 0.0 112.586 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.473 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 52.6 tp -62.3 -51.86 66.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.47 0.176 . . . . 0.0 111.37 -176.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -50.7 -61.07 6.32 Favored Glycine 0 CA--C 1.523 0.581 0 CA-C-N 116.181 -0.463 . . . . 0.0 113.298 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . 0.569 ' O ' HG23 ' A' ' 148' ' ' VAL . 72.6 Cg_exo -53.49 -40.42 78.79 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.724 2.283 . . . . 0.0 112.73 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -63.47 -41.82 98.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.709 0.29 . . . . 0.0 110.616 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.494 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 89.7 mt -59.99 -39.28 85.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.091 0.472 . . . . 0.0 110.092 176.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.63 -18.66 64.34 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.736 -179.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 144' ' ' PRO . 86.4 t -71.61 -56.68 9.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -175.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -134.5 0.53 3.04 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -172.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.582 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 33.4 mm -68.2 -52.18 23.22 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.157 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.582 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 38.2 Cg_exo -61.42 -29.36 85.24 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.734 1.623 . . . . 0.0 111.516 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -69.84 -40.98 75.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.008 178.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.537 HD23 HD11 ' A' ' 159' ' ' ILE . 24.7 tp -68.11 -30.93 70.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.499 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 150' ' ' ILE . 74.3 mt -62.14 -44.86 99.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.073 0.463 . . . . 0.0 110.077 175.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 54.3 tp60 -69.16 -14.66 63.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.081 -178.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . 0.559 ' HE2' ' HA ' ' A' ' 156' ' ' LYS . 11.2 mmpt? -68.3 -20.94 64.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.95 0.405 . . . . 0.0 110.228 174.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 88.96 13.15 62.75 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.722 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 27.5 m -100.11 -16.31 7.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.844 0.354 . . . . 0.0 111.645 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.537 HD11 HD23 ' A' ' 153' ' ' LEU . 55.6 mt . . . . . 0 C--N 1.327 -0.38 0 CA-C-O 121.12 0.486 . . . . 0.0 110.391 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.485 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 120.608 0.242 . . . . 0.0 110.625 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.513 ' O ' HG23 ' A' ' 10' ' ' VAL . 17.4 m -57.43 -48.63 78.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.59 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.417 ' HA ' ' HD3' ' A' ' 7' ' ' ARG . 24.0 mmt180 -64.11 -38.98 93.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.79 0.328 . . . . 0.0 110.658 -178.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 8' ' ' ARG . 44.5 ttp180 -65.2 -40.02 93.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.286 177.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 5' ' ' ALA . 52.3 t -63.96 -44.14 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.04 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 6' ' ' THR . 46.7 t -68.38 -20.15 25.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 121.103 0.478 . . . . 0.0 110.613 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.1 m -81.54 -47.61 12.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.786 176.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -69.85 -27.88 65.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.896 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.608 HG23 ' HB2' ' A' ' 38' ' ' SER . 39.6 mt -106.56 88.67 3.54 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.827 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -65.69 179.32 1.77 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.981 2.454 . . . . 0.0 113.109 -174.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.592 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.8 m -88.85 162.98 2.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.102 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.812 HD21 ' HB3' ' A' ' 35' ' ' GLU . 9.1 mp -92.07 156.09 17.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.448 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -71.45 -33.06 69.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.151 0.5 . . . . 0.0 110.267 178.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.567 HG23 ' HB3' ' A' ' 31' ' ' ARG . 3.0 t -146.74 152.36 38.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.629 -176.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -132.1 36.32 3.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.084 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.63 149.48 48.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.439 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.38 176.78 54.58 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.327 -179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.8 -3.44 6.88 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.364 2.709 . . . . 0.0 112.587 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.546 ' HD2' HG22 ' A' ' 88' ' ' ILE . 0.3 OUTLIER -64.11 -29.5 70.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.7 176.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -109.33 110.55 21.74 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 57.9 mtp85 -56.61 -51.59 68.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.647 -174.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -65.6 -52.82 49.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.68 0.276 . . . . 0.0 111.197 -174.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.502 HD12 HG21 ' A' ' 18' ' ' THR . 4.4 mm? -63.67 -33.42 75.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.002 -177.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.467 ' CZ2' HG21 ' A' ' 86' ' ' ILE . 63.7 t-105 -63.19 -52.05 63.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.633 176.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.6 t -64.7 -34.34 69.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.975 0.417 . . . . 0.0 110.662 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -71.58 -44.48 64.42 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.053 -178.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.567 ' HB3' HG23 ' A' ' 18' ' ' THR . 6.8 ptm180 -68.37 -28.54 67.2 Favored 'General case' 0 CA--C 1.523 -0.095 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -43.72 76.08 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.046 174.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -67.51 -40.48 85.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.536 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -61.12 -45.05 96.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.233 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.812 ' HB3' HD21 ' A' ' 16' ' ' LEU . 22.0 pt-20 -77.41 -29.29 52.99 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.953 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.491 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.0 OUTLIER -57.35 -47.1 82.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.92 0.39 . . . . 0.0 110.404 171.747 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -63.98 -37.92 89.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.732 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.608 ' HB2' HG23 ' A' ' 13' ' ' ILE . 0.6 OUTLIER -72.18 -31.38 65.86 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.732 177.068 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 56.9 mt -62.28 -49.28 76.3 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 170.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.3 mt -58.32 -40.66 78.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.837 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.432 ' NE ' ' HA ' ' A' ' 41' ' ' ARG . 4.5 mmp_? -53.42 -52.54 59.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.75 0.31 . . . . 0.0 111.192 176.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -63.16 -47.2 83.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.697 -177.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.8 t -62.67 -41.38 92.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.546 ' OE2' ' HD3' ' A' ' 47' ' ' LYS . 6.7 tp10 -61.72 -51.34 68.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.354 0.597 . . . . 0.0 110.318 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -59.31 -39.45 83.1 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.89 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -66.9 -47.42 71.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.573 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.546 ' HD3' ' OE2' ' A' ' 44' ' ' GLU . 22.8 ptmt -66.59 -28.75 68.75 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.207 -0.197 . . . . 0.0 110.887 -178.053 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.464 HD22 ' HG3' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -71.98 -24.72 61.63 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.245 0.545 . . . . 0.0 110.302 176.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -88.17 7.06 33.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.266 176.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.7 t70 72.81 3.87 4.81 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.469 176.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.517 ' C ' HD22 ' A' ' 51' ' ' ASN . 0.2 OUTLIER -117.81 86.11 2.46 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.129 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.27 136.07 51.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.088 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -88.79 -78.78 0.33 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.906 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -150.95 171.25 17.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.124 0.488 . . . . 0.0 111.453 -170.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 -132.48 124.05 27.81 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.043 172.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.0 mt -126.69 127.12 44.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.94 0.4 . . . . 0.0 111.378 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -133.22 163.32 29.55 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.354 173.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -129.54 166.72 19.11 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.737 0.303 . . . . 0.0 110.738 -173.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.494 ' HB3' ' OE1' ' A' ' 61' ' ' GLU . 4.3 m-20 -58.71 159.71 6.42 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 167.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -67.19 -17.94 65.04 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 -177.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.494 ' OE1' ' HB3' ' A' ' 59' ' ' ASN . 1.4 mp0 -85.78 -17.66 35.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.021 0.438 . . . . 0.0 110.519 174.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.03 11.55 83.89 Favored Glycine 0 C--O 1.227 -0.311 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.542 -177.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.4 p -77.37 -36.7 53.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.884 0.373 . . . . 0.0 111.808 -177.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.7 mtt180 -123.07 144.22 49.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.095 0.474 . . . . 0.0 110.857 175.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.97 ' HB2' ' HB2' ' A' ' 84' ' ' PHE . 22.8 m95 -118.89 150.33 40.05 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.196 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -154.12 150.61 28.34 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 174.27 -165.1 36.5 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.297 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -138.29 142.3 39.8 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.461 ' SG ' HD13 ' A' ' 82' ' ' ILE . 78.1 m -115.9 129.63 56.49 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.065 177.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.64 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 28.9 m-90 -100.5 125.85 46.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.949 0.404 . . . . 0.0 109.963 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 38.5 t80 -117.37 120.32 37.81 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.131 0.491 . . . . 0.0 110.367 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 50.8 mm -94.9 118.44 41.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.7 178.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 10.2 t60 -141.56 121.43 13.57 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.69 41.49 15.01 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.465 0.65 . . . . 0.0 110.156 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.8 mt 71.92 -4.89 1.83 Allowed 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.214 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.7 mt -91.95 144.6 25.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.666 0.27 . . . . 0.0 110.762 -177.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -109.34 117.42 34.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.508 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -130.28 128.68 42.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.782 0.325 . . . . 0.0 110.14 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.64 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 9.6 pt-20 -102.29 145.24 29.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.158 -177.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -123.48 135.78 54.24 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.874 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -92.14 129.82 38.0 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.803 -178.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.523 HG22 HG22 ' A' ' 99' ' ' VAL . 42.5 pt -126.78 149.58 31.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.734 -174.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -131.15 163.44 27.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.981 174.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.97 ' HB2' ' HB2' ' A' ' 65' ' ' TRP . 44.9 m-85 -150.11 148.66 29.25 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.854 -179.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -129.85 148.13 51.69 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 169.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.467 HG21 ' CZ2' ' A' ' 28' ' ' TRP . 47.9 mm -109.68 91.7 10.94 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -172.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 15.0 Cg_endo -56.19 159.02 13.48 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.533 2.155 . . . . 0.0 111.715 174.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.546 HG22 ' HD2' ' A' ' 23' ' ' ARG . 23.3 mm -71.99 -14.58 17.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.373 0.606 . . . . 0.0 110.702 -175.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.2 p -89.69 1.98 55.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.634 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.6 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 65.6 t80 -80.62 146.87 61.73 Favored Pre-proline 0 C--N 1.328 -0.336 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 176.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.6 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 85.1 Cg_endo -95.18 16.41 39.24 Favored 'Cis proline' 0 C--N 1.351 0.671 0 C-N-CA 124.519 -1.034 . . . . 0.0 113.608 1.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -64.04 -37.06 86.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.591 0.71 . . . . 0.0 109.586 176.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.4 m -111.16 124.73 52.78 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.799 176.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -71.58 144.43 88.73 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.811 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -89.48 -164.44 0.16 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.907 2.405 . . . . 0.0 112.04 177.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -123.89 127.15 47.59 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.6 HG12 ' CZ ' ' A' ' 84' ' ' PHE . 47.6 mt -66.05 115.76 4.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -89.54 112.38 23.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.026 -176.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.523 HG22 HG22 ' A' ' 82' ' ' ILE . 34.0 t -125.28 85.34 58.45 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.804 176.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -73.58 -9.62 22.91 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.795 2.33 . . . . 0.0 112.59 -175.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -73.68 -43.13 60.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.398 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.409 ' O ' HG22 ' A' ' 106' ' ' THR . 90.3 mt -82.36 -30.19 30.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.836 -178.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.502 ' HB2' ' HA2' ' A' ' 113' ' ' GLY . 16.6 t70 -53.66 124.91 16.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.949 178.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 106.37 -27.25 17.55 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.214 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.796 ' HG2' HG11 ' A' ' 158' ' ' VAL . 10.5 mptt -101.25 -42.4 6.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.016 0.436 . . . . 0.0 110.424 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.572 ' HB ' HD21 ' A' ' 153' ' ' LEU . 5.7 t . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.386 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . 0.502 ' HA2' ' HB2' ' A' ' 103' ' ' ASP . . . . . . . . 0 N--CA 1.448 -0.52 0 CA-C-O 120.408 -0.106 . . . . 0.0 113.014 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.16 136.91 43.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.901 0.381 . . . . 0.0 111.056 -178.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 43.4 pt -69.19 162.18 3.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.878 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 53.1 t -113.63 105.32 13.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.847 0.356 . . . . 0.0 110.345 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.1 mt -93.74 -178.33 4.65 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.842 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.8 t -85.14 158.81 20.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.002 -176.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -75.32 -12.88 60.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.069 0.462 . . . . 0.0 110.741 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 61.1 m-70 -80.79 -12.26 59.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.264 0.554 . . . . 0.0 110.201 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -70.75 -45.18 65.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.346 -172.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.45 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 14.7 mmmm -60.53 -52.23 74.26 Favored Pre-proline 0 C--O 1.236 0.392 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -175.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 26.5 Cg_endo -63.85 -31.87 67.31 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 121.769 1.646 . . . . 0.0 112.205 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 47.4 tp -66.1 -45.09 82.42 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.9 0.381 . . . . 0.0 110.171 177.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 41.8 t-105 -56.88 -49.3 75.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.482 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.14 -21.85 65.81 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.727 -176.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -84.64 -35.16 22.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.125 0.488 . . . . 0.0 110.3 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -73.85 -42.43 60.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.076 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.571 HG13 ' HA ' ' A' ' 130' ' ' PRO . 98.7 t -60.28 141.07 91.25 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.571 ' HA ' HG13 ' A' ' 129' ' ' VAL . 65.6 Cg_endo -84.29 -159.47 1.82 Allowed 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 124.909 -0.871 . . . . 0.0 114.061 6.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.592 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 73.7 mmtt 71.36 11.25 6.7 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.631 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -94.65 163.27 13.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.208 0.528 . . . . 0.0 111.742 -171.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -159.43 162.63 32.98 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.064 -0.814 . . . . 0.0 111.064 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.7 tp -60.39 -29.14 68.75 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -173.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.13 -39.12 66.19 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.187 0.518 . . . . 0.0 111.781 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.0 m80 -71.47 -32.48 68.34 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.95 -178.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 49.3 tp -63.28 -44.05 96.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 110.746 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 14.4 mmt -64.11 -52.69 57.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.512 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.08 -34.16 77.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.548 -175.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.1 mt -98.39 -17.9 18.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -174.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -111.72 -64.04 0.49 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.981 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 38.5 tp -63.16 -41.31 99.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 -171.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.95 -61.79 6.98 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.084 -179.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -58.74 -28.69 87.46 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.766 2.311 . . . . 0.0 112.908 177.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 64.7 t90 -72.05 -45.64 60.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.052 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 96.7 mt -60.16 -34.99 74.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.079 0.466 . . . . 0.0 111.16 -178.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.23 -2.81 20.29 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.989 -176.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 60.5 t -92.82 -55.28 6.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -109.82 -12.49 14.59 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -170.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.586 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 1.4 mp -55.58 -45.52 99.86 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.689 178.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 11.0 Cg_endo -55.77 -32.36 84.07 Favored 'Trans proline' 0 C--N 1.357 1.02 0 C-N-CA 122.026 1.817 . . . . 0.0 112.73 174.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.604 ' HA ' ' HG2' ' A' ' 155' ' ' GLN . 31.6 t70 -71.29 -36.48 71.68 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 120.589 0.233 . . . . 0.0 110.645 -179.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.572 HD21 ' HB ' ' A' ' 106' ' ' THR . 4.3 mm? -65.7 -31.63 72.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.9 0.381 . . . . 0.0 110.362 176.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 66.0 mt -72.51 -47.11 53.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.616 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.604 ' HG2' ' HA ' ' A' ' 152' ' ' ASP . 13.3 pt20 -71.16 -20.84 62.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.805 0.336 . . . . 0.0 110.723 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -72.68 -32.39 65.77 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.105 0.479 . . . . 0.0 109.762 175.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 99.58 10.08 48.29 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.176 177.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . 0.796 HG11 ' HG2' ' A' ' 105' ' ' LYS . 42.1 t -91.62 -14.06 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.356 0.598 . . . . 0.0 110.485 -178.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.401 HG12 ' HB3' ' A' ' 153' ' ' LEU . 37.4 mm . . . . . 0 C--N 1.323 -0.548 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.139 176.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.478 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 120.813 0.34 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.426 ' O ' HG23 ' A' ' 10' ' ' VAL . 7.4 m -58.53 -50.38 73.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.979 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -72.92 -25.28 60.99 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.042 -0.263 . . . . 0.0 111.136 -177.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -69.98 -43.74 70.83 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 5' ' ' ALA . 73.8 t -58.37 -44.99 89.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.613 177.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 6' ' ' THR . 50.5 t -67.04 -24.21 31.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.183 0.516 . . . . 0.0 110.815 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t -80.01 -43.1 22.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.657 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.595 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 42.5 mt-10 -75.45 -27.27 58.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.844 0.354 . . . . 0.0 110.94 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 47.9 mt -104.92 89.19 2.73 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.235 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.595 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 33.1 Cg_exo -59.23 165.06 9.55 Favored 'Trans proline' 0 N--CA 1.475 0.385 0 C-N-CA 123.538 2.826 . . . . 0.0 113.811 -173.102 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.474 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 30.3 m -83.59 162.42 3.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.166 178.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.569 HD21 ' HB2' ' A' ' 35' ' ' GLU . 7.0 mp -93.44 134.55 35.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.407 177.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -36.61 74.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.702 0.287 . . . . 0.0 111.293 -176.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.46 ' O ' ' HG3' ' A' ' 31' ' ' ARG . 6.2 p -107.61 139.67 41.8 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.725 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -132.56 77.11 1.73 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.409 0.623 . . . . 0.0 109.547 176.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -115.86 174.68 5.9 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.276 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.29 -179.69 23.15 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.331 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -69.29 2.39 3.31 Favored 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 123.015 2.477 . . . . 0.0 112.847 -178.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.403 ' HD2' HG23 ' A' ' 88' ' ' ILE . 26.3 mtp-105 -74.76 -44.68 48.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.617 0.722 . . . . 0.0 109.775 176.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.54 ' HB3' HD23 ' A' ' 27' ' ' LEU . 11.8 m-20 -94.62 101.54 13.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.653 -1.158 . . . . 0.0 109.925 -174.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.565 ' O ' HG23 ' A' ' 29' ' ' VAL . 60.2 mtm180 -57.63 -52.84 63.76 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -170.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.6 -41.6 92.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.049 0.452 . . . . 0.0 110.902 -175.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.54 HD23 ' HB3' ' A' ' 24' ' ' ASP . 3.3 mm? -67.63 -34.46 77.02 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.976 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.588 ' CH2' HG21 ' A' ' 86' ' ' ILE . 76.4 t-105 -67.66 -43.35 80.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.406 177.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 25' ' ' ARG . 84.1 t -61.09 -47.21 94.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 O-C-N 123.186 0.304 . . . . 0.0 111.501 -178.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.491 ' HA ' ' HG2' ' A' ' 33' ' ' LYS . 3.8 pt20 -72.03 -32.49 67.17 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.72 -178.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 18' ' ' THR . 18.8 ttp85 -66.22 -39.8 89.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.55 0.691 . . . . 0.0 109.301 174.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -63.69 -47.69 80.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.192 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.491 ' HG2' ' HA ' ' A' ' 30' ' ' GLN . 19.4 ptpt -64.38 -38.42 90.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.672 0.272 . . . . 0.0 111.204 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 12.7 mm-40 -69.54 -32.52 71.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.018 0.437 . . . . 0.0 110.366 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.569 ' HB2' HD21 ' A' ' 16' ' ' LEU . 37.6 tt0 -70.59 -35.98 73.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.435 176.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.42 ' O ' HG13 ' A' ' 40' ' ' ILE . 4.5 m-30 -59.71 -49.14 78.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.74 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -59.4 -41.46 89.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.943 0.401 . . . . 0.0 110.602 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.5 t -58.33 -44.8 88.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.346 177.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.453 ' O ' HG23 ' A' ' 43' ' ' VAL . 88.1 mt -64.16 -52.64 58.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.274 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 36' ' ' TYR . 86.3 mt -54.58 -41.45 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.473 -176.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -56.8 -45.98 81.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.938 0.399 . . . . 0.0 110.85 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -73.56 -35.71 65.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.672 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 39' ' ' LEU . 80.9 t -62.68 -45.95 97.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.993 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -34.27 75.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.193 -179.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -60.88 -44.43 97.09 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 174.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.527 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 62.0 m-20 -63.55 -36.97 85.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.837 177.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -60.97 -49.68 76.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.727 0.299 . . . . 0.0 110.712 177.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.97 -41.06 95.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.264 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -86.09 5.9 31.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.757 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 56.03 33.2 21.38 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 122.127 0.965 . . . . 0.0 109.816 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -117.66 24.85 10.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.068 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.527 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 29.9 t70 -67.5 100.14 0.83 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.973 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 58.5 p-90 -114.33 2.93 14.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.282 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -162.29 169.6 20.37 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.554 -178.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -160.99 124.33 3.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.3 168.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.536 HD13 ' HA3' ' A' ' 67' ' ' GLY . 3.4 mm? -90.24 123.99 34.5 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.304 -178.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -110.22 147.17 34.3 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 176.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.7 p -128.94 157.1 42.58 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 120.981 0.419 . . . . 0.0 111.31 -171.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -79.31 168.56 19.36 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 172.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -57.1 -49.33 76.23 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -174.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -68.76 -19.54 64.33 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.849 0.357 . . . . 0.0 111.551 178.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.43 16.49 80.32 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.774 -174.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.5 p -88.46 -39.55 14.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.171 0.51 . . . . 0.0 111.078 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -101.57 128.46 47.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.075 174.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 54.9 m95 -116.04 145.15 43.23 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.011 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -152.36 86.06 1.28 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.688 0.756 . . . . 0.0 109.674 -177.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.536 ' HA3' HD13 ' A' ' 56' ' ' LEU . . . -104.8 146.55 16.14 Favored Glycine 0 N--CA 1.439 -1.104 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.074 -176.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 81' ' ' ASP . 1.5 ptpp? -100.18 130.93 46.37 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 54.8 m -131.48 127.99 38.47 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.089 -177.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.726 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 8.2 p90 -119.32 138.51 52.99 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.07 0.462 . . . . 0.0 110.948 -177.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -117.54 120.45 38.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.786 -178.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.446 ' N ' HD12 ' A' ' 72' ' ' ILE . 4.1 mp -91.39 121.03 41.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.996 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -147.97 124.6 11.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.011 175.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.1 t70 59.95 50.13 7.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.034 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.4 mt 74.46 -33.43 0.25 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 114.767 -1.106 . . . . 0.0 112.642 178.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 51.1 mt -76.0 139.61 41.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.038 0.447 . . . . 0.0 111.548 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -121.38 106.86 11.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.966 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.419 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 79.9 m-85 -96.26 121.53 38.15 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.255 178.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.726 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 0.0 OUTLIER -108.38 135.83 49.03 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.418 0.628 . . . . 0.0 111.208 -179.903 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -128.41 120.25 26.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.158 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.42 ' HA ' ' HA ' ' A' ' 68' ' ' LYS . 2.4 m-20 -78.24 119.12 21.17 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 171.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.4 pt -114.46 130.31 69.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.337 0.589 . . . . 0.0 110.416 -179.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -120.06 149.4 42.24 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.538 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.608 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 45.7 p90 -158.14 162.8 37.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.338 0.589 . . . . 0.0 110.934 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -106.64 154.78 20.43 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.176 -177.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.588 HG21 ' CH2' ' A' ' 28' ' ' TRP . 43.7 mm -104.19 90.46 3.13 Favored Pre-proline 0 C--N 1.324 -0.517 0 C-N-CA 122.734 0.413 . . . . 0.0 110.676 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -70.99 175.9 8.46 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.797 2.332 . . . . 0.0 112.182 -177.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.403 HG23 ' HD2' ' A' ' 23' ' ' ARG . 51.6 mm -68.47 -22.66 27.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.147 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.63 -13.74 61.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.219 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.497 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 63.5 t80 -87.47 143.75 34.61 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.497 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 23.0 Cg_endo -96.34 26.17 20.36 Favored 'Cis proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.825 -0.906 . . . . 0.0 112.883 0.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.1 m -69.57 -34.99 74.95 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.528 0.68 . . . . 0.0 110.129 178.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -131.32 145.64 51.95 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.16 175.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.12 144.3 99.02 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.437 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -80.61 161.08 22.03 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.79 2.327 . . . . 0.0 112.342 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -93.17 101.56 13.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.24 0.543 . . . . 0.0 110.537 -177.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.608 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 63.2 mt -72.38 136.72 25.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.783 -177.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -102.28 116.66 33.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.788 0.328 . . . . 0.0 110.864 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.442 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 5.8 p -124.04 87.74 53.05 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-O 121.889 0.852 . . . . 0.0 110.659 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 99' ' ' VAL . 18.8 Cg_endo -59.97 -36.35 90.3 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 123.287 2.658 . . . . 0.0 114.056 -172.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -82.65 17.87 1.7 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -171.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.464 ' O ' HG22 ' A' ' 106' ' ' THR . 42.3 mt -106.09 -15.69 14.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.274 0.559 . . . . 0.0 109.751 169.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.68 144.01 54.57 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.101 -176.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 77.74 -8.64 34.5 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.601 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.9 mtmm -117.22 -48.92 2.61 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.71 -0.288 . . . . 0.0 111.473 -176.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 102' ' ' LEU . 14.1 t . . . . . 0 C--N 1.326 -0.455 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.219 0 N-CA-C 112.767 -0.133 . . . . 0.0 112.767 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -141.44 -171.9 3.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.473 HD13 ' HB ' ' A' ' 97' ' ' ILE . 46.3 pt -123.7 152.36 28.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.891 0.377 . . . . 0.0 111.115 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.8 t -112.09 111.06 21.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.473 173.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.35 165.32 20.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.604 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.402 ' HB ' ' CB ' ' A' ' 121' ' ' PHE . 2.7 m -55.1 133.67 48.96 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.856 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -56.91 -49.42 75.62 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -172.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -79.03 -15.43 58.25 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.991 -0.284 . . . . 0.0 111.703 -177.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.402 ' CB ' ' HB ' ' A' ' 118' ' ' THR . 85.9 t80 -71.37 -33.69 69.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.134 0.493 . . . . 0.0 110.145 179.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.614 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 54.0 mtpt -59.88 -51.22 82.28 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.427 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.614 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 25.9 Cg_exo -64.63 -35.62 46.33 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.761 1.641 . . . . 0.0 111.862 171.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.5 tp -59.6 -37.34 78.3 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.881 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.508 ' O ' HG23 ' A' ' 129' ' ' VAL . 48.0 t-105 -54.83 -50.44 68.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.417 176.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.21 -18.31 65.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.708 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -83.78 -20.4 33.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.005 0.431 . . . . 0.0 110.894 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -104.07 10.1 36.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.797 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 125' ' ' TRP . 94.9 t -93.79 139.69 22.79 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 174.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.414 ' HA ' HG13 ' A' ' 129' ' ' VAL . 69.5 Cg_endo -95.98 -154.7 0.35 Allowed 'Cis proline' 0 N--CA 1.456 -0.677 0 C-N-CA 124.165 -1.181 . . . . 0.0 113.49 1.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.474 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 54.8 mtmt 71.99 12.06 6.07 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.834 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -90.51 177.44 6.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.073 176.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -169.35 172.56 43.52 Favored Glycine 0 C--O 1.236 0.236 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.243 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 45.1 tp -60.41 -36.15 77.46 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.815 0.446 . . . . 0.0 111.66 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.52 -41.78 73.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.29 0.567 . . . . 0.0 111.124 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -71.84 -34.86 69.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.536 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 69.3 tp -67.3 -41.14 85.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.19 -178.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 24.7 mmt -69.05 -40.68 78.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.82 0.343 . . . . 0.0 111.017 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.07 -47.37 62.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.766 -177.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 86.9 mt -84.34 -29.1 26.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.005 0.431 . . . . 0.0 111.419 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.432 ' O ' ' HB2' ' A' ' 145' ' ' TRP . . . -96.41 -77.93 1.38 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.852 -0.689 . . . . 0.0 113.092 -176.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.8 tp -55.07 -47.92 74.22 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -170.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.6 -63.15 5.48 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.995 -0.621 . . . . 0.0 113.522 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.6 -27.31 53.4 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.42 2.08 . . . . 0.0 112.085 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . 0.432 ' HB2' ' O ' ' A' ' 141' ' ' GLY . 56.6 t90 -62.2 -45.05 95.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.74 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 96.4 mt -67.37 -34.18 76.75 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.132 0.492 . . . . 0.0 110.549 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.97 -5.05 36.08 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.954 -176.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 84.7 t -70.26 -55.13 15.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . 0.489 ' O ' HD23 ' A' ' 153' ' ' LEU . 0.0 OUTLIER -135.08 -12.82 2.16 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.709 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.552 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 32.1 mm -55.76 -50.66 85.83 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-N 118.059 0.39 . . . . 0.0 111.836 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.3 Cg_endo -53.58 -34.75 74.36 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 122.203 1.935 . . . . 0.0 112.533 177.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -78.22 -39.31 40.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.771 -177.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.489 HD23 ' O ' ' A' ' 149' ' ' GLU . 4.0 mm? -58.35 -37.78 75.87 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.705 177.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 71.7 mt -63.02 -47.19 93.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.685 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.45 ' HG3' ' O ' ' A' ' 151' ' ' PRO . 22.3 mt-30 -68.46 -27.92 66.58 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.774 -178.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -63.85 -27.43 69.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.432 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 87.13 6.24 79.06 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.846 176.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.9 p -78.45 -26.61 14.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.294 0.569 . . . . 0.0 110.386 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 54.7 mt . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.0 177.199 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.446 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 CA--C 1.528 0.102 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.2 m -59.78 -55.44 34.21 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.095 0.474 . . . . 0.0 111.297 -175.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.99 -22.04 64.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.292 -177.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' A' ' 8' ' ' ARG . 21.6 ttt180 -71.16 -39.23 72.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.377 178.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 5' ' ' ALA . 99.4 t -63.73 -43.37 97.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.196 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.9 t -60.32 -39.13 79.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.398 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.3 m -61.86 -37.78 85.78 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -177.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -88.11 8.58 26.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.836 0.351 . . . . 0.0 111.475 -177.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 54.1 mt -121.87 86.93 46.35 Favored Pre-proline 0 C--O 1.237 0.404 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 172.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -48.85 146.29 11.88 Favored 'Trans proline' 0 C--O 1.238 0.484 0 C-N-CA 123.674 2.916 . . . . 0.0 114.047 -173.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.431 ' HB ' ' O ' ' A' ' 131' ' ' LYS . 33.0 m -81.04 162.79 3.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.611 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' A' ' 35' ' ' GLU . 10.0 mp -96.19 146.15 24.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.814 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -75.03 -39.54 60.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.41 -176.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.606 HG21 HD12 ' A' ' 27' ' ' LEU . 62.8 m -124.02 128.48 49.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.735 -173.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -91.71 118.36 30.59 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 173.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -161.2 156.75 24.67 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.578 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.29 -164.55 15.85 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.65 177.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.91 5.69 2.86 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.78 2.32 . . . . 0.0 113.232 -176.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 51.6 mtm180 -70.74 -62.67 1.3 Allowed 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -84.33 97.87 9.7 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.666 HH22 ' HG2' ' A' ' 61' ' ' GLU . 15.1 mtp180 -63.26 -33.2 74.99 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.213 -173.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -70.93 -50.73 31.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.558 0.218 . . . . 0.0 111.034 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.606 HD12 HG21 ' A' ' 18' ' ' THR . 4.3 mm? -66.91 -28.74 68.55 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.218 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.575 ' CH2' HG21 ' A' ' 86' ' ' ILE . 72.0 t-105 -60.53 -45.48 93.7 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.889 172.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 25' ' ' ARG . 70.2 t -61.07 -42.9 94.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.231 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.423 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 12.1 mt-30 -58.19 -53.92 52.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.388 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -67.34 -28.75 68.23 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.737 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.4 tp -62.59 -46.56 87.76 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 8.4 mtpm? -56.46 -58.81 6.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.056 176.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 18.3 mm-40 -62.13 -39.31 92.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.523 -174.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.775 ' HB2' HD21 ' A' ' 16' ' ' LEU . 39.6 tt0 -67.36 -38.29 84.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.389 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.548 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.1 m-85 -64.17 -30.45 71.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.527 176.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 90.2 mm-40 -68.3 -42.59 79.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.141 176.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.3 m -61.23 -39.72 91.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.984 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.511 HD12 ' HA ' ' A' ' 36' ' ' TYR . 76.6 mt -60.66 -49.35 77.85 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.884 177.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 36' ' ' TYR . 84.3 mt -51.98 -44.7 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 120.79 0.329 . . . . 0.0 110.603 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.516 ' O ' ' HB2' ' A' ' 45' ' ' ASN . 18.6 tpt180 -58.71 -51.18 71.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.222 177.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -66.62 -42.93 86.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.648 0.261 . . . . 0.0 111.066 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 39' ' ' LEU . 94.8 t -61.83 -47.85 91.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.548 179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -63.57 -42.86 98.29 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.528 0.68 . . . . 0.0 109.705 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' A' ' 41' ' ' ARG . 1.0 OUTLIER -53.77 -49.29 68.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.398 178.202 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -69.7 -43.25 72.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.439 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -66.49 -43.84 84.28 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -177.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.401 ' ND2' ' HA ' ' A' ' 45' ' ' ASN . 2.9 p30 -70.98 -23.85 62.29 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.987 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.52 8.41 7.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.732 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.4 t0 62.77 41.39 9.03 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.597 0.713 . . . . 0.0 110.515 177.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -141.52 87.44 2.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.508 174.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -101.46 101.81 12.48 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.55 ' HA ' ' CD1' ' A' ' 70' ' ' TRP . 52.6 p-90 -123.72 -1.37 8.46 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -173.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -154.21 158.16 39.88 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.96 -172.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.89 130.34 2.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.977 168.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.3 tp -124.53 131.47 53.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.427 -173.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -126.26 175.95 7.44 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.949 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.0 m -154.46 166.96 31.62 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.729 0.299 . . . . 0.0 110.826 -178.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.431 HD21 ' HB2' ' A' ' 64' ' ' ARG . 6.9 p30 -79.54 172.37 13.88 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 169.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -64.31 -26.04 68.31 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -174.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.666 ' HG2' HH22 ' A' ' 25' ' ' ARG . 37.4 mt-10 -80.25 -23.53 40.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.87 0.367 . . . . 0.0 110.834 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.69 17.91 73.48 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.962 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -86.11 -6.54 58.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.227 0.536 . . . . 0.0 110.969 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.431 ' HB2' HD21 ' A' ' 59' ' ' ASN . 50.5 mtm180 -142.0 120.77 12.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.469 176.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 24.9 m95 -106.11 130.06 54.08 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -146.45 137.76 24.45 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.274 0.559 . . . . 0.0 110.527 -175.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.93 -152.63 6.77 Favored Glycine 0 N--CA 1.442 -0.933 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.158 -178.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.691 ' HD3' ' CZ3' ' A' ' 70' ' ' TRP . 34.9 tttp -143.02 143.16 31.78 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -177.206 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.6 p -144.84 148.42 33.96 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.691 ' CZ3' ' HD3' ' A' ' 68' ' ' LYS . 0.7 OUTLIER -138.29 151.38 47.54 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.939 0.4 . . . . 0.0 110.902 179.119 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -117.71 138.09 52.25 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.383 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.2 mm -107.22 123.99 62.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.186 -176.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -159.5 123.17 3.73 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.393 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 57.26 55.55 5.79 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.809 0.693 . . . . 0.0 112.057 177.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 69.46 1.64 3.4 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.789 175.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 76.8 mt -107.18 138.14 43.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.085 0.469 . . . . 0.0 111.509 -174.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.1 ttmm -119.57 109.0 15.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.246 175.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -107.04 116.0 31.16 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.608 ' HB2' ' HE3' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -105.29 144.97 31.33 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.253 0.549 . . . . 0.0 111.519 -177.215 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -135.04 151.09 50.46 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.335 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.71 118.66 37.12 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.0 pt -113.31 147.04 17.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.63 0 CA-C-O 121.109 0.481 . . . . 0.0 111.187 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -150.69 153.06 34.9 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.242 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.601 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 39.1 p90 -158.27 155.46 28.92 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.406 176.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.474 ' O ' ' HB3' ' A' ' 95' ' ' PRO . 7.8 p-10 -95.06 156.86 16.14 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.015 -176.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.575 HG21 ' CH2' ' A' ' 28' ' ' TRP . 46.8 mm -109.76 90.43 9.07 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.988 175.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 11.7 Cg_endo -53.62 155.31 13.8 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.932 2.421 . . . . 0.0 112.751 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 39.6 mm -67.75 -21.12 26.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.515 0.674 . . . . 0.0 110.031 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.1 p -85.71 10.55 13.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.89 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.533 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 51.6 t80 -72.64 145.54 87.37 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.533 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 95.3 Cg_endo -94.75 11.99 46.46 Favored 'Cis proline' 0 C--N 1.35 0.608 0 C-N-CA 124.318 -1.117 . . . . 0.0 113.328 -0.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 23.7 m -62.75 -31.22 72.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.488 0.661 . . . . 0.0 110.304 178.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 32.0 m -114.01 134.18 55.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.016 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.407 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -75.49 145.05 78.65 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.454 -178.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.474 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 19.3 Cg_exo -66.7 151.79 81.92 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.156 2.57 . . . . 0.0 112.395 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -93.34 100.48 12.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.353 -178.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.601 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.4 mt -71.97 121.67 22.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.815 -178.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -118.71 125.47 49.74 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.106 0.479 . . . . 0.0 111.114 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 24.3 t -118.32 87.2 29.44 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.428 175.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.74 -25.21 74.9 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 123.288 2.659 . . . . 0.0 113.761 -172.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.03 -17.86 60.92 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.88 -43.59 95.61 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 38.6 t70 55.06 26.35 8.04 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.825 0.703 . . . . 0.0 112.127 170.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 68.56 16.1 69.28 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.961 -0.637 . . . . 0.0 113.045 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.503 ' HB2' ' NZ ' ' A' ' 105' ' ' LYS . 4.6 ttmp? -76.16 -18.03 59.29 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.001 0.429 . . . . 0.0 110.783 -178.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.426 ' OG1' HD11 ' A' ' 153' ' ' LEU . 2.9 t . . . . . 0 CA--C 1.542 0.635 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.982 -177.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.613 0 N-CA-C 112.215 -0.354 . . . . 0.0 112.215 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.1 mtpp -76.73 120.81 22.42 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.6 pt -75.64 155.15 6.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.959 0.409 . . . . 0.0 110.811 -178.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 7.9 p -97.54 114.85 26.83 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.009 -178.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.8 mt -100.12 142.56 31.43 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 174.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.5 t -71.1 156.31 39.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.075 0.464 . . . . 0.0 111.261 -176.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -66.48 -42.93 86.76 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -172.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.445 ' C ' ' HD2' ' A' ' 123' ' ' PRO . 12.6 m-70 -62.25 -14.68 40.92 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -178.224 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -66.87 -33.92 76.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.952 0.406 . . . . 0.0 110.141 176.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.641 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 37.9 mtpt -62.7 -52.39 65.04 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.073 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.641 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 31.2 Cg_exo -59.74 -35.56 94.17 Favored 'Trans proline' 0 C--N 1.359 1.096 0 C-N-CA 121.697 1.598 . . . . 0.0 112.028 173.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 59.1 tp -63.55 -44.54 93.89 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.551 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.406 ' O ' HG23 ' A' ' 129' ' ' VAL . 47.3 t-105 -57.94 -57.46 12.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.894 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.72 -29.96 71.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.719 -176.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 13.3 ttm180 -64.53 -30.94 71.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.221 -178.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -102.14 16.48 25.98 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.336 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 125' ' ' TRP . 93.9 t -106.49 134.46 19.79 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 172.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -83.27 -162.77 2.93 Favored 'Cis proline' 0 C--N 1.347 0.45 0 C-N-CA 124.208 -1.164 . . . . 0.0 114.001 3.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.431 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 68.1 mttm 74.67 7.73 4.39 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.441 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -89.99 175.47 7.17 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 177.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -164.9 155.37 26.73 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.107 -177.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.42 HD21 ' CE2' ' A' ' 84' ' ' PHE . 43.3 tp -65.4 -30.98 71.85 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 122.78 0.432 . . . . 0.0 111.068 -175.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.45 ' O ' ' HG2' ' A' ' 138' ' ' MET . . . -56.81 -33.02 66.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.411 0.624 . . . . 0.0 110.936 176.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -71.46 -32.25 68.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.367 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.6 tp -67.44 -40.13 85.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.258 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' A' ' 135' ' ' ALA . 23.5 ptp -72.09 -36.54 69.52 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.866 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -75.07 -45.69 39.71 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 88.6 mt -93.97 -23.72 17.94 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -174.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -101.17 -65.83 0.79 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.851 -177.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.6 tp -59.26 -57.14 14.33 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -173.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.82 -61.98 6.32 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-N 116.156 -0.475 . . . . 0.0 113.819 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . 0.43 ' O ' HG23 ' A' ' 148' ' ' VAL . 53.2 Cg_exo -57.29 -35.07 98.85 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.717 2.278 . . . . 0.0 113.137 -179.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 45.9 t90 -64.31 -49.58 71.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.058 0.456 . . . . 0.0 109.917 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.39 -32.31 73.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.8 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.22 -12.57 60.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.993 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 144' ' ' PRO . 67.2 t -88.57 -56.14 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.672 0.272 . . . . 0.0 110.916 178.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . 0.529 ' O ' ' HG ' ' A' ' 153' ' ' LEU . 7.7 mm-40 -80.49 -52.79 7.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -173.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.614 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 48.9 mm -55.21 -54.46 50.34 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -170.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.614 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 31.6 Cg_exo -60.4 -33.76 93.89 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.99 1.793 . . . . 0.0 112.314 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -75.03 -43.49 53.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.331 -177.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 149' ' ' GLU . 23.3 mt -56.98 -34.58 68.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.247 178.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 150' ' ' ILE . 73.0 mt -62.59 -49.59 83.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.552 177.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -68.96 -34.43 75.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.489 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -73.83 -16.95 61.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.879 0.371 . . . . 0.0 111.054 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.14 24.62 47.45 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.215 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 51.4 t -83.17 -33.29 10.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.557 0.694 . . . . 0.0 109.294 178.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 72.8 mt . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.241 174.021 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.326 0 CA-C-O 121.059 0.457 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.438 ' O ' HG23 ' A' ' 10' ' ' VAL . 22.6 m -62.76 -46.25 88.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.182 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -66.77 -29.68 69.69 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.117 -176.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.5 ttm180 -62.6 -47.98 81.41 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.42 ' O ' HG13 ' A' ' 13' ' ' ILE . 58.5 t -57.34 -46.36 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.721 178.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 6' ' ' THR . 67.5 t -60.16 -36.9 70.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.183 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.4 m -76.08 -37.99 57.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.73 -176.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -82.37 8.58 11.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.201 0.524 . . . . 0.0 110.593 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.457 HG12 ' HB2' ' A' ' 42' ' ' TYR . 71.1 mt -114.2 89.56 17.66 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.387 171.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -40.04 143.04 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.268 3.312 . . . . 0.0 114.202 -175.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 m -83.23 162.85 3.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.732 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.827 HD21 ' HB3' ' A' ' 35' ' ' GLU . 6.8 mp -95.96 134.77 38.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.68 -177.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -86.32 -30.84 21.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.275 0.559 . . . . 0.0 109.868 174.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 27.5 m -96.83 125.89 41.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.29 -176.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -132.04 104.2 6.69 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.129 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -149.76 173.65 13.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.019 -178.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.94 166.16 17.75 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.112 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -66.86 -1.87 6.77 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 123.322 2.682 . . . . 0.0 113.327 -177.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -72.48 -18.23 61.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.583 0.23 . . . . 0.0 111.471 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -116.6 112.19 20.94 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 175.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 29' ' ' VAL . 48.8 mtt180 -58.57 -51.48 69.71 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -173.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -72.62 -35.89 67.94 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.379 -0.528 . . . . 0.0 111.667 -173.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.05 -34.32 75.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.991 0.424 . . . . 0.0 110.207 174.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.415 ' O ' HD23 ' A' ' 32' ' ' LEU . 44.9 t-105 -66.01 -48.08 72.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.878 176.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 25' ' ' ARG . 80.0 t -63.2 -35.95 74.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 178.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.528 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 5.9 tt0 -66.94 -39.05 87.21 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.925 178.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.508 HH12 ' HG3' ' A' ' 91' ' ' PRO . 25.2 ttt85 -68.61 -38.28 80.45 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.17 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.585 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 1.7 mm? -52.68 -51.97 57.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.476 176.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 18.7 ptpt -67.52 -25.53 65.88 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.621 0.248 . . . . 0.0 111.132 -179.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.528 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 28.3 mm-40 -64.47 -62.53 1.54 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.766 175.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.827 ' HB3' HD21 ' A' ' 16' ' ' LEU . 12.1 pt-20 -73.1 -26.02 61.09 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.332 -177.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.585 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -52.42 -45.81 66.1 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 169.092 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.3 mm-40 -61.01 -42.4 98.37 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.524 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.8 m -59.03 -45.04 91.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.445 176.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.428 ' O ' HG23 ' A' ' 43' ' ' VAL . 77.7 mt -60.47 -55.45 33.36 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.798 178.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 79.9 mt -60.26 -39.24 80.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.049 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' A' ' 41' ' ' ARG . 6.9 tpp85 -66.69 -41.22 88.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.647 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.457 ' HB2' HG12 ' A' ' 13' ' ' ILE . 86.5 t80 -66.27 -44.77 82.66 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.091 177.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 39' ' ' LEU . 92.3 t -59.76 -38.62 76.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.329 176.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -57.13 -59.87 4.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.263 0.554 . . . . 0.0 110.061 176.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -58.8 -35.49 72.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.356 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -68.45 -46.1 70.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.461 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -67.29 -28.52 68.08 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.148 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -67.64 -14.28 62.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.89 0.376 . . . . 0.0 110.89 177.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -101.34 14.88 30.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.216 174.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.6 t70 70.54 5.83 5.55 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.504 0.721 . . . . 0.0 111.487 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.507 ' OD1' ' HD1' ' A' ' 53' ' ' TRP . 23.7 t-20 -102.28 142.37 33.62 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.862 -0.524 . . . . 0.0 110.984 -176.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -158.09 111.43 2.44 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.507 ' HD1' ' OD1' ' A' ' 51' ' ' ASN . 56.1 p-90 -130.04 -3.03 4.55 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -172.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.4 ' HZ ' ' HD2' ' A' ' 42' ' ' TYR . 10.8 p90 -152.42 156.52 39.67 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.072 -0.651 . . . . 0.0 111.67 -174.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -161.92 126.79 3.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.565 171.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.543 HD13 ' HA3' ' A' ' 67' ' ' GLY . 3.8 mm? -100.54 130.38 46.6 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.242 -174.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -120.83 160.41 23.47 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 172.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 p -154.34 174.9 14.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 120.964 0.411 . . . . 0.0 111.163 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -83.04 170.73 14.54 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 172.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -65.65 -24.89 67.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.681 0.276 . . . . 0.0 111.544 -176.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -71.4 -24.72 62.11 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.805 0.336 . . . . 0.0 110.686 176.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.67 23.53 77.91 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.539 -0.625 . . . . 0.0 111.539 -176.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.2 p -95.2 -39.23 10.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.139 0.495 . . . . 0.0 111.397 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.1 mmt-85 -110.12 116.82 32.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.25 177.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 39.1 m95 -110.34 133.93 52.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.346 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -129.84 128.56 42.53 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.072 176.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.543 ' HA3' HD13 ' A' ' 56' ' ' LEU . . . -126.62 138.4 10.62 Favored Glycine 0 N--CA 1.441 -0.978 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.255 -175.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -101.25 131.98 47.0 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 177.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 38.0 m -120.14 136.45 54.61 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.733 -176.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 24.8 m-90 -126.35 122.74 36.27 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.331 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.432 ' HD2' ' HH ' ' A' ' 78' ' ' TYR . 3.8 t80 -128.24 119.11 24.52 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.24 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.498 HD13 ' HA ' ' A' ' 77' ' ' LYS . 31.7 mm -101.76 113.92 39.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.96 175.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 23.4 t60 -154.18 140.58 18.71 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -176.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.3 t70 62.73 27.26 16.03 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.34 0.591 . . . . 0.0 109.898 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 66.42 12.4 8.64 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.837 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.8 mt -105.93 135.73 46.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.122 0.487 . . . . 0.0 110.956 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.498 ' HA ' HD13 ' A' ' 72' ' ' ILE . 63.4 tttp -97.98 119.25 36.28 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.742 177.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.432 ' HH ' ' HD2' ' A' ' 71' ' ' TYR . 15.0 p90 -141.1 143.45 34.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.098 0.475 . . . . 0.0 110.53 174.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -135.69 148.7 49.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.994 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -138.63 144.16 39.6 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -108.57 128.38 54.77 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 121.106 0.479 . . . . 0.0 109.73 174.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 29.2 pt -117.7 151.04 19.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.583 -175.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -139.21 153.82 47.94 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 174.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.585 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 31.2 p90 -156.38 151.35 26.22 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.481 177.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.562 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 29.5 t70 -98.73 145.29 27.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.998 -177.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.0 mm -107.7 89.97 5.74 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.627 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.562 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 22.4 Cg_exo -64.49 164.04 24.89 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.554 2.169 . . . . 0.0 111.982 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 57.2 mt -69.2 -18.5 22.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.38 0.61 . . . . 0.0 110.322 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -79.95 9.02 5.85 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.392 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.558 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 78.2 t80 -77.94 139.46 61.65 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.558 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 44.2 Cg_endo -95.82 13.09 41.28 Favored 'Cis proline' 0 C--N 1.349 0.573 0 C-N-CA 124.314 -1.119 . . . . 0.0 113.856 1.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 38.1 m -58.5 -31.91 68.31 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.356 0.598 . . . . 0.0 110.496 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 35.6 m -123.63 124.4 42.7 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.785 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.498 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -69.0 143.93 95.04 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.518 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 17.2 Cg_exo -68.22 155.53 69.05 Favored 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 123.31 2.673 . . . . 0.0 112.687 179.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -102.3 116.87 33.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.926 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.585 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 4.2 mp -88.46 117.95 33.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -90.24 -44.0 10.02 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.816 -175.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.421 ' CG1' ' HG ' ' A' ' 102' ' ' LEU . 17.9 t 63.52 86.58 0.14 Allowed Pre-proline 0 CA--C 1.535 0.399 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.889 -176.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -61.15 -28.14 85.02 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.957 2.438 . . . . 0.0 112.969 -175.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.92 -37.08 83.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.855 0.36 . . . . 0.0 110.876 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.472 ' HA ' ' HB3' ' A' ' 105' ' ' LYS . 60.8 mt -82.33 -10.78 58.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.741 -173.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -61.84 112.45 2.3 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 81.02 -12.29 37.71 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.34 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.472 ' HB3' ' HA ' ' A' ' 102' ' ' LEU . 3.6 tppp? -86.33 -60.7 1.93 Allowed 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.638 HG23 HD11 ' A' ' 153' ' ' LEU . 66.4 m . . . . . 0 C--N 1.322 -0.602 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.707 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.422 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 98' ' ' ALA . 16.5 ptpt -164.61 164.47 21.54 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -175.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.5 pt -73.46 135.24 28.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 120.966 0.412 . . . . 0.0 110.419 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.6 t -96.83 117.92 32.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.34 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.7 mt -98.21 164.19 12.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.337 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 3.5 t -72.14 152.09 42.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.078 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -68.41 -26.93 65.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.101 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -70.43 -18.51 63.01 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.64 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -67.12 -33.62 75.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.054 0.454 . . . . 0.0 110.035 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.411 ' HB2' ' CD ' ' A' ' 123' ' ' PRO . 41.8 mtpt -58.6 -58.94 15.47 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.842 -178.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.411 ' CD ' ' HB2' ' A' ' 122' ' ' LYS . 27.9 Cg_endo -63.94 -26.76 66.6 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 121.874 1.716 . . . . 0.0 112.451 178.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 64.5 tp -66.31 -47.24 74.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.968 0.414 . . . . 0.0 110.24 175.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -67.19 -51.42 53.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.624 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.05 -15.37 59.35 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.19 -176.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -78.55 -40.91 33.59 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.95 0.405 . . . . 0.0 110.786 177.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -105.16 70.53 0.9 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.105 0.479 . . . . 0.0 110.949 -173.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 68.2 t -130.9 128.69 22.43 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.267 176.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.454 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 78.0 Cg_endo -87.92 -139.83 0.15 OUTLIER 'Cis proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.728 -1.363 . . . . 0.0 112.91 1.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 50.6 mtmt 75.54 -7.62 1.75 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.496 0.718 . . . . 0.0 111.533 -178.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.7 m-30 -95.65 141.17 29.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.29 171.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -145.98 -174.06 17.79 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 42.7 tp -57.14 -38.31 73.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.78 0.29 . . . . 0.0 111.415 -176.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.56 -43.63 89.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.005 0.431 . . . . 0.0 111.173 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 20.2 m80 -70.99 -36.66 72.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.313 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.8 tp -60.31 -47.89 84.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.249 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . 0.429 ' HA ' ' CE ' ' A' ' 138' ' ' MET . 18.2 mmt -63.96 -43.17 96.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.034 -178.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.14 75.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.951 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.8 mt -86.86 -33.31 19.84 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -176.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -98.6 -64.89 0.86 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.4 -0.905 . . . . 0.0 113.109 -176.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.7 tp -66.21 -44.26 84.34 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -173.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -51.8 -61.59 6.32 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.371 -0.442 . . . . 0.0 113.566 -178.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -62.42 -31.46 80.98 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.571 2.18 . . . . 0.0 112.37 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 52.3 t90 -62.66 -46.17 89.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.022 0.439 . . . . 0.0 110.097 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 86.8 mt -63.94 -33.11 74.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.784 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.6 -18.1 64.86 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.476 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 64.7 t -104.36 -54.5 6.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.493 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -77.21 -35.18 55.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -171.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.572 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 31.9 mm -59.62 -51.84 78.25 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 111.79 0.292 . . . . 0.0 111.79 -178.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.572 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 50.6 Cg_exo -55.12 -34.53 87.87 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.974 1.783 . . . . 0.0 112.129 175.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.87 -45.04 87.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.725 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.638 HD11 HG23 ' A' ' 106' ' ' THR . 4.2 mm? -67.94 -30.25 69.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.231 178.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 150' ' ' ILE . 65.5 mt -70.93 -42.1 77.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.139 0.495 . . . . 0.0 110.172 175.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -63.42 -42.61 98.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.904 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 43.0 tttp -67.98 -31.83 71.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.125 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 79.99 33.67 32.5 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.904 174.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.2 t -97.37 -14.76 7.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.021 0.439 . . . . 0.0 110.934 -177.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.7 mt . . . . . 0 C--N 1.328 -0.365 0 CA-C-O 121.389 0.614 . . . . 0.0 109.658 177.338 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.417 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.227 0 CA-C-O 121.279 0.562 . . . . 0.0 109.965 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.2 m -64.68 -45.7 85.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.488 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.52 -30.0 70.71 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.282 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -66.64 -41.65 87.93 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 5' ' ' ALA . 71.9 t -58.74 -46.1 90.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.319 177.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.1 t -66.42 -28.85 44.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.752 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.8 t -76.87 -36.27 56.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.946 -178.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -86.13 -4.31 59.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.429 . . . . 0.0 110.879 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 61.6 mt -119.06 86.36 31.69 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 173.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.15 149.51 27.67 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.665 2.91 . . . . 0.0 113.768 -172.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.8 m -76.23 175.1 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.037 178.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.422 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 6.3 mp -100.27 163.59 12.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.485 -179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.63 -39.7 5.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 172.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.624 ' HB ' ' HG3' ' A' ' 34' ' ' GLU . 23.0 m -88.92 135.86 33.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.148 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -150.02 121.44 7.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.51 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.669 ' H ' ' HD2' ' A' ' 31' ' ' ARG . . . -156.28 -178.99 7.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.277 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.5 168.56 19.76 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.058 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.74 -7.48 18.37 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 123.2 2.6 . . . . 0.0 113.2 -177.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.407 ' HB2' ' HE ' ' A' ' 23' ' ' ARG . 11.0 mtm180 -70.28 -51.26 31.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.638 0.732 . . . . 0.0 109.723 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.6 93.77 3.65 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.133 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.415 ' O ' HG23 ' A' ' 29' ' ' VAL . 97.9 mtt180 -55.75 -52.17 64.85 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -168.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.553 ' HG3' HD22 ' A' ' 27' ' ' LEU . 10.0 pt-20 -71.37 -33.93 69.99 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -174.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.553 HD22 ' HG3' ' A' ' 26' ' ' GLU . 4.2 mm? -75.48 -33.31 60.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.967 0.413 . . . . 0.0 110.341 178.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.51 ' CH2' HG21 ' A' ' 86' ' ' ILE . 64.1 t-105 -65.32 -50.67 64.76 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.126 177.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 25' ' ' ARG . 84.3 t -60.17 -32.68 51.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 121.123 0.487 . . . . 0.0 110.49 177.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.517 ' HB3' HG21 ' A' ' 18' ' ' THR . 16.2 tt0 -67.32 -49.21 65.06 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.249 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.669 ' HD2' ' H ' ' A' ' 20' ' ' ALA . 2.9 ptm180 -70.31 -27.58 64.5 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.374 -0.53 . . . . 0.0 110.066 178.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.437 ' HA ' HD22 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -62.84 -44.77 95.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.231 -0.441 . . . . 0.0 109.866 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.499 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 18.5 ptpt -73.38 -31.09 63.71 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.349 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.624 ' HG3' ' HB ' ' A' ' 18' ' ' THR . 6.1 mm-40 -57.35 -51.51 69.11 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.381 0.61 . . . . 0.0 109.69 172.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.552 ' OE1' ' HA3' ' A' ' 133' ' ' GLY . 5.3 tp10 -64.66 -39.64 94.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.075 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.426 ' O ' HG13 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -61.85 -42.18 98.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.798 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 15.4 mm100 -64.43 -39.2 93.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.899 0.38 . . . . 0.0 110.314 177.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.7 t -61.74 -43.14 99.43 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.884 175.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.418 ' O ' HG23 ' A' ' 43' ' ' VAL . 61.9 mt -59.86 -52.29 66.09 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.84 175.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 36' ' ' TYR . 77.7 mt -59.06 -33.28 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.87 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 41' ' ' ARG . 6.8 tpp180 -61.1 -44.6 97.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.275 177.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -68.6 -43.17 77.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.422 177.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.497 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 86.6 t -59.42 -42.02 86.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.655 178.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.44 -47.26 86.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.756 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -54.57 -41.51 69.94 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.371 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.479 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 89.3 m-20 -67.5 -41.28 84.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.141 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 74.0 mmtt -68.09 -27.57 66.59 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.244 -0.182 . . . . 0.0 110.808 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.18 -41.65 79.7 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.946 178.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -107.83 3.88 24.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.81 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.6 t70 59.14 31.46 21.29 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.5 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -97.17 16.04 20.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.469 -177.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.479 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 20.7 t0 -57.75 138.93 55.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.202 -178.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 59.7 p-90 -143.33 -0.25 1.11 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.167 -0.47 . . . . 0.0 112.104 -172.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -140.44 135.26 31.84 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 119.893 -0.723 . . . . 0.0 112.019 -170.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -130.33 125.04 33.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.056 174.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.1 126.91 49.43 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.873 0.368 . . . . 0.0 110.274 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -118.08 160.35 21.67 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.633 177.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.4 p -158.67 168.74 26.07 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.766 0.317 . . . . 0.0 110.834 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -75.72 172.88 11.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.025 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -71.93 -14.85 62.04 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -175.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.25 -18.22 29.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.853 0.358 . . . . 0.0 110.239 176.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.22 23.94 70.2 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 116.042 -0.527 . . . . 0.0 112.244 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.8 p -90.97 -4.35 56.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.025 0.441 . . . . 0.0 111.436 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -152.47 128.42 10.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -120.59 136.97 54.65 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.865 0.364 . . . . 0.0 110.69 -176.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.4 p90 -141.01 139.25 34.14 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.326 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -165.1 -177.73 37.81 Favored Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 119.427 -1.368 . . . . 0.0 113.128 -177.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.51 ' HD2' ' CZ2' ' A' ' 70' ' ' TRP . 22.7 ttmm -130.65 133.05 45.8 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 -177.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.426 ' O ' ' HA ' ' A' ' 79' ' ' GLU . 6.9 p -112.6 130.13 56.13 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.321 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.683 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 16.6 m-90 -103.64 131.11 51.09 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.57 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -118.22 119.51 34.89 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 175.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 15.7 mm -101.89 119.78 50.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.221 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -140.36 107.32 5.42 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.254 177.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.5 t70 55.07 64.75 1.69 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.548 173.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 75' ' ' LEU . 3.6 mm? 67.12 2.08 2.62 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.658 175.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -107.4 137.45 45.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.762 0.315 . . . . 0.0 110.401 177.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 21.4 ttpt -118.0 113.87 22.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.263 -179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -112.4 122.19 47.0 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.683 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 8.2 pt-20 -115.26 140.13 49.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.988 0.423 . . . . 0.0 110.904 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -127.8 126.18 41.22 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.153 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -87.23 126.06 34.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.862 177.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.475 HG22 HG22 ' A' ' 99' ' ' VAL . 41.1 pt -125.25 153.42 32.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.92 -175.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -147.82 155.12 41.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.798 0.333 . . . . 0.0 110.502 176.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.434 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 44.2 p90 -165.21 159.28 17.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.288 177.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -104.28 170.15 8.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.259 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.51 HG21 ' CH2' ' A' ' 28' ' ' TRP . 47.7 mm -114.91 90.89 24.27 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.936 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 11.0 Cg_endo -53.52 159.74 6.02 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.249 2.633 . . . . 0.0 112.89 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.1 mm -71.66 -18.5 19.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.509 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 m -88.52 9.31 24.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.05 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.473 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 47.7 t80 -81.37 146.05 56.9 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.31 -0.404 . . . . 0.0 109.914 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.473 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 10.9 Cg_endo -92.99 12.81 51.03 Favored 'Cis proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.48 -1.05 . . . . 0.0 112.696 -2.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.4 m -59.38 -28.83 67.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.389 0.614 . . . . 0.0 110.61 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 74.0 m -128.51 132.52 48.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.557 173.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.62 144.67 69.87 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.214 -178.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -85.82 173.98 6.81 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.826 2.351 . . . . 0.0 112.332 178.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.646 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 45.1 mt-10 -109.09 116.99 33.01 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.296 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.434 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.8 mt -76.24 132.43 33.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.457 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.739 ' HA ' ' HA3' ' A' ' 113' ' ' GLY . . . -107.15 128.88 54.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.926 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.475 HG22 HG22 ' A' ' 82' ' ' ILE . 10.6 t -122.83 86.06 50.12 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -63.13 -17.94 62.61 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.855 2.37 . . . . 0.0 112.829 -175.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -81.09 -27.54 35.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.96 0.41 . . . . 0.0 111.006 -178.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 72.9 mt -88.42 -17.82 29.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.978 0.418 . . . . 0.0 110.13 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -57.54 112.59 1.48 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.031 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 82.93 -11.84 52.05 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.092 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.416 ' HB2' ' NZ ' ' A' ' 105' ' ' LYS . 4.9 ttmp? -93.47 -44.51 8.21 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 120.802 0.334 . . . . 0.0 110.789 -177.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.0 m . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.194 178.919 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . 0.739 ' HA3' ' HA ' ' A' ' 98' ' ' ALA . . . . . . . . 0 N--CA 1.437 -1.257 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.646 ' HA ' ' HB3' ' A' ' 96' ' ' GLU . 7.4 mtpm? 49.03 39.55 15.1 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 122.782 0.433 . . . . 0.0 111.389 178.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.6 pt -72.15 135.51 27.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.295 0.569 . . . . 0.0 110.957 -177.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 2.8 p -108.58 153.2 23.71 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.004 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.428 ' HB2' ' CD1' ' A' ' 121' ' ' PHE . 64.7 mt -91.37 -171.39 2.93 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.008 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.7 t -61.1 145.68 50.07 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -58.41 -30.69 67.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.492 -173.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -54.77 -30.98 58.1 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.169 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.428 ' CD1' ' HB2' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -69.19 -33.04 72.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.469 -175.561 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.464 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 10.0 tmtt? -58.77 -57.08 29.49 Favored Pre-proline 0 CA--C 1.541 0.618 0 CA-C-O 119.714 -0.184 . . . . 0.0 111.393 -173.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.464 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 35.6 Cg_endo -66.95 -34.95 27.91 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 121.672 1.581 . . . . 0.0 111.982 175.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 43.9 tp -60.98 -37.91 84.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.927 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.482 ' CZ3' HD13 ' A' ' 137' ' ' LEU . 63.7 t-105 -61.21 -54.71 40.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.484 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.48 -33.27 74.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.303 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 31.6 mtt180 -63.7 -37.12 86.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.465 177.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -83.47 -61.24 1.89 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -175.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.47 HG13 ' HA ' ' A' ' 130' ' ' PRO . 94.6 t -47.49 132.93 10.35 Favored Pre-proline 0 N--CA 1.471 0.602 0 O-C-N 123.627 0.579 . . . . 0.0 111.407 -175.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.481 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 91.7 Cg_endo -77.61 -164.65 4.04 Favored 'Cis proline' 0 C--N 1.35 0.643 0 C-N-CA 124.259 -1.142 . . . . 0.0 114.298 7.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 30.8 mttm 73.66 -9.87 1.15 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.867 -178.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . 0.506 ' HZ ' HD12 ' A' ' 140' ' ' LEU . 6.0 t80 -106.68 151.36 25.21 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.552 ' HA3' ' OE1' ' A' ' 35' ' ' GLU . . . -166.96 -158.18 11.13 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 119.629 -1.272 . . . . 0.0 113.759 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 48.6 tp -63.22 -44.93 93.89 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.746 0.646 . . . . 0.0 112.746 -169.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.04 87.51 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.944 0.878 . . . . 0.0 110.002 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -72.7 -32.48 65.79 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.533 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.482 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 65.8 tp -66.66 -48.74 68.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.308 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 20.3 ptm -65.34 -34.83 79.24 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 121.071 -0.252 . . . . 0.0 111.073 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.18 -45.66 72.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.708 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.506 HD12 ' HZ ' ' A' ' 132' ' ' PHE . 76.2 mt -91.0 -16.06 28.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.825 -174.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -110.43 -67.34 0.56 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.259 -176.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.5 tp -60.97 -46.11 92.03 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 -174.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.5 -62.18 6.47 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.061 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.61 -33.84 96.71 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.705 2.27 . . . . 0.0 112.962 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 18.7 t90 -57.66 -52.67 64.48 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.241 0.543 . . . . 0.0 109.772 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.405 ' HA ' HG12 ' A' ' 150' ' ' ILE . 88.9 mt -67.47 -36.13 80.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.892 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.21 -24.15 67.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.362 -174.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 57.7 t -104.23 -54.72 6.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.78 -0.368 . . . . 0.0 111.905 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -73.99 -34.08 64.07 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -170.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.493 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.0 mm -66.52 -49.77 50.21 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -176.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.493 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 79.1 Cg_exo -50.21 -39.52 52.09 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 122.225 1.95 . . . . 0.0 112.95 177.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -70.6 -42.27 71.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.71 0.291 . . . . 0.0 110.491 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 23.2 tp -59.51 -35.71 74.67 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.071 0.462 . . . . 0.0 110.438 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 150' ' ' ILE . 69.2 mt -70.34 -53.69 21.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.692 177.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -64.47 -26.65 68.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.854 -175.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -70.77 -14.32 62.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.721 -178.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 90.92 16.66 54.01 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.764 176.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 59.9 t -80.95 -62.74 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.944 0.402 . . . . 0.0 110.284 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 13.2 pt . . . . . 0 C--N 1.324 -0.54 0 CA-C-O 121.356 0.598 . . . . 0.0 111.261 179.905 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.453 -0.288 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.5 m -57.98 -44.17 86.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.424 177.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 51.3 mmm-85 -59.4 -48.17 82.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.952 -178.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.3 -46.16 77.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.065 -177.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 5' ' ' ALA . 79.5 t -59.45 -48.07 88.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.304 -178.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 92.5 t -66.74 -26.99 38.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.966 0.412 . . . . 0.0 110.803 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -77.26 -54.22 6.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.424 -177.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -80.56 0.49 33.68 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.976 0.417 . . . . 0.0 111.708 -173.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.642 HG12 ' HB2' ' A' ' 42' ' ' TYR . 60.9 mt -108.97 87.96 5.1 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 169.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.533 ' HG2' ' HG3' ' A' ' 41' ' ' ARG . 80.7 Cg_exo -48.48 140.46 21.31 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 123.978 3.119 . . . . 0.0 114.006 -170.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.513 ' HB ' ' HG2' ' A' ' 131' ' ' LYS . 35.6 m -73.43 163.4 4.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.942 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mp -106.94 154.8 20.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.092 -175.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.412 ' HB2' ' NZ ' ' A' ' 17' ' ' LYS . 9.0 mtmp? -99.91 -47.27 5.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.905 177.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.561 HG23 HD12 ' A' ' 27' ' ' LEU . 72.7 m -82.97 116.59 22.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.424 -177.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.479 ' OD1' ' HG3' ' A' ' 91' ' ' PRO . 38.4 t-20 -148.16 99.06 3.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.08 -58.08 0.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.508 -174.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 151.68 170.16 18.11 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.961 176.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.73 -13.36 17.96 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 123.042 2.494 . . . . 0.0 112.294 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.44 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 1.7 mmp_? -65.76 -33.85 76.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.758 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -93.43 107.34 19.2 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 mmp_? -58.22 -43.41 87.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.876 -176.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.43 -45.2 66.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.846 0.355 . . . . 0.0 110.681 -174.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.561 HD12 HG23 ' A' ' 18' ' ' THR . 4.5 mm? -73.18 -23.56 60.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.774 178.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 51.7 t-105 -70.66 -45.66 64.7 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 25' ' ' ARG . 99.5 t -60.78 -38.66 79.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.094 0.473 . . . . 0.0 110.029 175.244 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.583 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 0.7 OUTLIER -61.33 -37.27 82.67 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.459 174.813 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.573 HH22 ' HA2' ' A' ' 133' ' ' GLY . 2.4 mtp180 -64.5 -37.4 87.41 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.119 177.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 32' ' ' LEU . 4.1 mm? -56.7 -42.69 79.57 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 175.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -60.12 -47.84 84.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.468 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 11.0 mm-40 -59.57 -49.77 76.46 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.836 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -62.07 -44.73 96.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.802 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.42 ' O ' HG13 ' A' ' 40' ' ' ILE . 8.4 m-30 -57.67 -46.66 83.97 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.452 0.168 . . . . 0.0 111.308 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -58.56 -46.78 86.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 0.0 110.684 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.8 t -66.84 -44.42 81.08 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.468 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.427 ' O ' HG23 ' A' ' 43' ' ' VAL . 58.5 mt -60.52 -53.88 52.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.216 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 36' ' ' TYR . 79.9 mt -57.71 -39.8 72.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.48 0.181 . . . . 0.0 110.702 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.533 ' HG3' ' HG2' ' A' ' 14' ' ' PRO . 5.9 mmp_? -59.63 -56.88 16.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.911 176.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.642 ' HB2' HG12 ' A' ' 13' ' ' ILE . 36.4 t80 -57.44 -50.07 74.2 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.355 -179.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.513 HG12 ' HE2' ' A' ' 47' ' ' LYS . 91.1 t -63.56 -37.52 79.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.162 -176.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 40' ' ' ILE . 2.7 tp10 -63.22 -49.82 72.66 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.342 0.591 . . . . 0.0 109.99 179.193 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.414 ' HA ' HD21 ' A' ' 48' ' ' ASN . 89.3 m-20 -59.29 -36.59 75.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.568 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.449 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 65.6 t30 -73.2 -40.06 65.05 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.411 -177.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.513 ' HE2' HG12 ' A' ' 43' ' ' VAL . 66.5 mttm -63.04 -46.38 87.83 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.802 -178.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.414 HD21 ' HA ' ' A' ' 45' ' ' ASN . 10.4 p30 -71.8 -14.71 62.06 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.853 -175.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -89.81 -2.82 58.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.825 0.345 . . . . 0.0 110.452 175.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.2 t0 60.78 40.25 16.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.277 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -122.99 17.83 10.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.923 0.868 . . . . 0.0 109.505 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.449 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 22.4 t70 -62.3 101.47 0.23 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.827 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.442 ' HB2' ' O ' ' A' ' 70' ' ' TRP . 15.9 p-90 -111.13 -40.98 4.3 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -167.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.586 ' H ' ' HD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -124.1 162.34 23.75 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 121.776 -0.577 . . . . 0.0 111.762 -174.235 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -156.28 129.03 7.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.848 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -112.61 144.14 42.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.252 0.549 . . . . 0.0 111.759 -173.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -109.25 162.99 13.77 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 173.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.1 m -153.19 155.4 36.59 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.808 0.337 . . . . 0.0 110.904 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -81.49 168.73 17.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 169.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -73.87 -6.5 47.56 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.805 -174.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -84.8 -25.58 28.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.98 0.419 . . . . 0.0 110.258 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.04 18.23 74.43 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.2 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.0 p -90.38 -4.35 57.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -176.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 64' ' ' ARG . 12.8 ttp180 -151.99 128.37 10.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.788 0.328 . . . . 0.0 110.17 172.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -111.54 126.56 55.11 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.36 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -137.25 138.04 39.68 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.212 -175.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -172.66 -155.94 12.0 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.676 -0.774 . . . . 0.0 112.051 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -138.66 153.61 48.58 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.771 0.319 . . . . 0.0 110.406 -178.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.8 p -128.19 123.97 35.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.841 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.6 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 17.0 m-90 -102.11 121.56 42.43 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 175.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.427 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 11.1 t80 -118.99 124.5 47.14 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.175 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 41.6 mm -97.9 114.8 36.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -177.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -146.57 118.42 8.15 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.403 177.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.6 t0 62.1 41.95 10.32 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.333 0.587 . . . . 0.0 110.828 175.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mm? 70.44 5.04 5.19 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.693 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.2 mt -88.48 106.12 18.06 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.998 0.427 . . . . 0.0 110.199 176.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -94.28 93.61 7.84 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.427 ' CE1' ' HB3' ' A' ' 71' ' ' TYR . 30.1 p90 -118.22 138.85 52.05 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.067 0.46 . . . . 0.0 111.087 -177.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.6 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 0.7 OUTLIER -115.21 141.87 47.43 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.74 179.734 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -123.85 136.95 54.69 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.174 174.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -85.48 110.91 19.52 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.403 ' HA ' HG22 ' A' ' 99' ' ' VAL . 32.0 pt -115.16 155.62 16.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.016 -172.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -166.08 159.64 15.61 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.631 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 52.3 p90 -159.39 147.73 17.71 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.55 178.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -98.98 159.45 14.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.307 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.7 mm -106.6 90.32 4.91 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.328 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.18 148.5 18.09 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 123.102 2.535 . . . . 0.0 112.591 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 38.8 mm -71.66 -14.31 17.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.559 0.695 . . . . 0.0 110.091 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 2.9 p -84.21 7.65 18.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.423 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.698 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 63.5 t80 -69.63 144.65 94.2 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.698 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 37.8 Cg_endo -92.7 3.01 60.17 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 124.186 -1.173 . . . . 0.0 114.133 1.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.9 m -58.02 -41.71 83.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.459 0.647 . . . . 0.0 110.09 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.5 m -103.93 120.92 42.04 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.206 172.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.61 145.07 95.61 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.479 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.441 ' HD2' HD22 ' A' ' 137' ' ' LEU . 25.7 Cg_exo -62.63 115.38 2.87 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.64 2.227 . . . . 0.0 111.221 175.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.575 ' CB ' ' HD2' ' A' ' 114' ' ' LYS . 30.6 mt-10 -74.44 117.33 16.13 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.83 -175.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.631 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.5 mt -66.6 127.76 28.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 175.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.98 -78.0 0.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.142 -170.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.403 HG22 ' HA ' ' A' ' 82' ' ' ILE . 8.1 t 51.69 75.79 0.61 Allowed Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.598 -175.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.88 -21.16 56.14 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 123.096 2.531 . . . . 0.0 112.798 -175.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 10.6 tp10 -63.61 -28.49 69.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.368 -178.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 97.8 mt -77.62 -22.53 50.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.288 -177.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -68.67 -16.38 63.81 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.557 0.694 . . . . 0.0 110.726 -178.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -108.5 10.37 35.74 Favored Glycine 0 C--N 1.316 -0.535 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.891 176.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 48.5 mmtm -115.49 -68.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.679 0.276 . . . . 0.0 111.497 -177.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.486 -173.814 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 112.018 -0.433 . . . . 0.0 112.018 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.575 ' HD2' ' CB ' ' A' ' 96' ' ' GLU . 38.6 mmtt -138.89 143.49 38.75 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -178.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.407 ' CD1' ' HB ' ' A' ' 97' ' ' ILE . 39.4 pt -76.34 152.9 5.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.825 179.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 39.0 t -88.71 106.54 18.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.461 -179.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.9 mt -92.68 -175.49 3.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.7 t -84.36 155.52 22.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.716 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -73.53 -24.58 60.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.701 -178.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -82.64 -2.73 54.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.088 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -69.83 -40.94 75.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.023 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.432 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 31.6 mmtp -63.77 -53.7 48.0 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.792 -177.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.432 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 16.1 Cg_endo -59.46 -32.08 95.79 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 121.738 1.626 . . . . 0.0 112.419 176.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.6 tp -69.43 -47.97 62.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.993 0.425 . . . . 0.0 110.312 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -61.12 -51.88 67.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.878 -177.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.24 -28.97 70.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.459 -177.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -68.88 -38.73 79.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.089 0.471 . . . . 0.0 110.241 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -66.78 -54.97 17.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.71 -176.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 59.3 t -42.22 125.29 2.76 Favored Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 124.188 0.93 . . . . 0.0 111.983 -173.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.453 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 85.4 Cg_endo -81.92 -132.45 0.09 OUTLIER 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.079 -1.217 . . . . 0.0 113.027 4.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.513 ' HG2' ' HB ' ' A' ' 15' ' ' VAL . 7.1 ttmm 70.34 -45.0 0.58 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 176.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -74.12 155.82 38.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.949 0.405 . . . . 0.0 110.837 -177.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.573 ' HA2' HH22 ' A' ' 31' ' ' ARG . . . -144.97 174.17 25.15 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.435 -175.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.445 HD11 ' CE2' ' A' ' 84' ' ' PHE . 47.8 tp -69.59 -37.17 76.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.781 0.324 . . . . 0.0 110.913 -175.47 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.09 -37.88 64.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.429 0.633 . . . . 0.0 110.695 174.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -71.23 -32.73 69.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.419 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.441 HD22 ' HD2' ' A' ' 95' ' ' PRO . 61.7 tp -65.6 -48.91 70.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.197 -178.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 22.9 ptp -67.25 -34.78 78.17 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.992 -177.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -75.47 -53.47 8.61 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.91 -17.31 44.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.821 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -95.49 -71.59 1.11 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.434 -0.889 . . . . 0.0 112.897 -177.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.488 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 44.5 tp -67.6 -36.51 81.0 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -172.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.88 -62.22 6.31 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.093 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -65.53 -26.63 54.38 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.601 2.201 . . . . 0.0 112.6 177.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -65.47 -39.37 91.89 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.921 0.391 . . . . 0.0 110.651 -178.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 96.3 mt -59.03 -32.88 70.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.828 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.78 1.68 14.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.785 -177.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 61.4 t -101.18 -55.86 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.854 0.359 . . . . 0.0 111.187 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -84.57 -46.63 11.37 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -174.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.478 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 48.0 mm -58.69 -54.46 56.01 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -169.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 12.2 Cg_endo -54.93 -38.98 92.66 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 122.299 1.999 . . . . 0.0 113.202 -175.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.5 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 38.6 t70 -81.68 -34.29 30.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.725 0.298 . . . . 0.0 110.275 -178.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.429 ' HG ' ' HB ' ' A' ' 158' ' ' VAL . 20.2 tp -59.95 -39.15 84.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.032 0.444 . . . . 0.0 110.481 178.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 150' ' ' ILE . 60.5 mt -64.37 -44.02 97.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.223 0.535 . . . . 0.0 110.06 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -68.32 -28.82 67.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.127 -177.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 30.7 mtpp -71.86 -9.51 58.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.729 0.299 . . . . 0.0 110.959 176.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.45 26.2 40.28 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.379 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . 0.429 ' HB ' ' HG ' ' A' ' 153' ' ' LEU . 40.8 t -94.69 -28.91 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 0.0 110.23 179.016 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.42 HD11 HD23 ' A' ' 153' ' ' LEU . 58.8 mt . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.707 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.787 0.327 . . . . 0.0 110.495 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.451 ' O ' HG23 ' A' ' 10' ' ' VAL . 89.7 m -55.82 -52.94 62.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.261 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -61.74 -32.53 72.77 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.864 0.364 . . . . 0.0 110.873 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -63.89 -41.23 97.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.649 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.2 t -78.61 -42.48 25.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.128 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 6' ' ' THR . 82.5 t -59.62 -36.96 68.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.592 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.1 m -64.42 -25.15 67.89 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.029 0.442 . . . . 0.0 111.022 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.564 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 37.7 mt-10 -91.99 -13.99 30.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.429 -177.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 52.4 mt -107.69 89.91 5.68 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.616 0.246 . . . . 0.0 110.752 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.564 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 38.9 Cg_exo -55.73 158.34 13.8 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.545 2.83 . . . . 0.0 113.373 -174.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.555 ' HB ' ' O ' ' A' ' 131' ' ' LYS . 28.4 m -100.24 170.98 1.42 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.181 -178.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.562 ' HG ' ' HB3' ' A' ' 34' ' ' GLU . 9.4 mp -91.58 -177.71 4.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.538 -178.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -137.04 6.75 2.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.705 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.566 HG21 HD12 ' A' ' 27' ' ' LEU . 27.0 m -154.21 96.33 1.93 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.869 0.366 . . . . 0.0 110.834 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -111.24 110.08 20.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.942 0.401 . . . . 0.0 110.901 -177.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.467 ' O ' ' HD3' ' A' ' 91' ' ' PRO . . . -143.91 -178.37 5.89 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.345 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.15 165.5 54.05 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.988 -175.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 88' ' ' ILE . 16.2 Cg_exo -69.3 -15.94 39.14 Favored 'Trans proline' 0 CA--C 1.529 0.259 0 C-N-CA 123.368 2.712 . . . . 0.0 112.526 178.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 23' ' ' ARG . 36.0 mtp-105 -83.32 -14.01 53.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.185 0.517 . . . . 0.0 110.072 178.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -80.48 64.35 5.25 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 170.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.402 ' O ' HG23 ' A' ' 29' ' ' VAL . 12.4 mtm-85 -54.23 -43.35 70.79 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.876 -167.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.413 ' HG3' HD22 ' A' ' 27' ' ' LEU . 7.4 pt-20 -60.13 -45.27 93.59 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.651 0.263 . . . . 0.0 111.614 -178.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.566 HD12 HG21 ' A' ' 18' ' ' THR . 4.1 mm? -81.94 -19.92 39.73 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.949 0.404 . . . . 0.0 110.978 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.449 ' HE3' HH21 ' A' ' 31' ' ' ARG . 62.3 t-105 -65.76 -39.81 91.43 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.772 177.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 25' ' ' ARG . 88.0 t -61.3 -42.37 93.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.091 176.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.515 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 26.6 tt0 -67.09 -42.56 84.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.367 0.603 . . . . 0.0 110.187 176.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.456 ' HD3' ' O ' ' A' ' 18' ' ' THR . 15.9 ttp-105 -63.56 -32.69 74.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.07 -179.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -59.7 -47.33 86.07 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.344 178.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 10.3 ptmm? -65.52 -33.63 76.37 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.462 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.562 ' HB3' ' HG ' ' A' ' 16' ' ' LEU . 29.8 mm-40 -64.56 -48.98 73.0 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.837 0.351 . . . . 0.0 110.23 177.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -59.88 -44.47 94.18 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.458 ' O ' HG13 ' A' ' 40' ' ' ILE . 11.0 m-85 -59.38 -46.54 88.37 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.213 178.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -65.25 -37.79 88.32 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.468 0.173 . . . . 0.0 111.468 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.7 t -61.58 -43.39 98.95 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.746 -0.465 . . . . 0.0 109.746 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.488 ' O ' HG23 ' A' ' 43' ' ' VAL . 92.4 mt -64.84 -52.53 56.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.998 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.5 mt -55.84 -37.63 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.177 -177.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -57.27 -47.71 80.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.857 0.361 . . . . 0.0 110.96 177.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -68.62 -38.57 80.66 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.5 t -60.31 -43.27 93.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.865 178.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -57.42 -53.41 58.43 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 120.737 0.303 . . . . 0.0 110.437 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -54.22 -45.7 72.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.34 0.59 . . . . 0.0 111.07 176.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.558 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 26.3 t30 -71.62 -45.95 60.56 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.012 -0.994 . . . . 0.0 112.045 -170.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -72.9 -31.19 64.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.481 0.182 . . . . 0.0 111.297 -175.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -71.67 -26.99 62.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.904 0.383 . . . . 0.0 110.497 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -89.18 -5.23 57.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.882 0.372 . . . . 0.0 110.494 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 t70 67.44 16.26 9.97 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.438 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -91.96 8.79 35.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.718 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.558 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 24.5 t70 -51.44 110.87 0.5 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.006 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 67.7 p-90 -123.97 8.22 8.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.22 -170.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -158.02 143.55 16.94 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.063 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.43 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -125.44 124.37 41.28 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 173.889 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.493 HD23 ' HA3' ' A' ' 67' ' ' GLY . 65.5 mt -135.69 133.65 38.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.0 111.621 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -138.31 157.18 46.75 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 171.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.536 ' HB3' ' CE2' ' A' ' 65' ' ' TRP . 30.9 p -103.67 164.78 11.45 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 120.661 0.267 . . . . 0.0 110.41 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -79.88 -179.14 6.8 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 171.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -68.83 -21.05 64.32 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.818 -171.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -88.25 -21.81 24.29 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.795 0.331 . . . . 0.0 110.818 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.63 2.09 84.5 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.127 -0.558 . . . . 0.0 112.407 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.49 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . 20.8 p -90.45 -7.25 53.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.756 0.312 . . . . 0.0 111.493 -177.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -136.41 129.63 31.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.039 0.447 . . . . 0.0 110.891 173.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.536 ' CE2' ' HB3' ' A' ' 58' ' ' SER . 38.3 m95 -112.87 138.03 50.33 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.747 176.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -137.87 145.06 41.74 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.01 -178.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.493 ' HA3' HD23 ' A' ' 56' ' ' LEU . . . -177.8 -150.69 8.72 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.183 -1.008 . . . . 0.0 112.651 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -147.1 139.21 24.5 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -174.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 23.2 p -125.84 138.31 53.81 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 175.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 13.9 p90 -157.4 135.74 11.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.812 0.339 . . . . 0.0 110.378 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -145.76 151.42 37.94 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.1 mm -88.24 121.4 38.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.019 0.438 . . . . 0.0 110.759 -175.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -129.69 112.52 13.74 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.031 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 0.8 OUTLIER 59.11 38.36 23.84 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.546 0.528 . . . . 0.0 111.229 179.508 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.4 mm? 75.4 -6.95 1.87 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.238 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.8 mt -79.98 107.49 12.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.914 0.388 . . . . 0.0 110.018 177.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -89.73 108.34 19.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.823 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -130.99 151.22 51.64 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.686 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -134.58 150.61 50.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.335 -178.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -131.99 119.84 21.62 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.032 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -72.16 119.06 15.81 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 172.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.488 HG22 HG22 ' A' ' 99' ' ' VAL . 30.7 pt -118.06 143.52 28.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 121.12 0.486 . . . . 0.0 111.819 -172.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -135.14 166.39 23.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.442 172.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.574 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 49.1 p90 -166.18 145.24 5.88 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.023 173.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -103.18 152.66 21.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.159 0.504 . . . . 0.0 110.664 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.49 ' HB ' ' HA ' ' A' ' 63' ' ' THR . 49.1 mm -104.37 90.82 3.47 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.855 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -62.54 166.63 13.0 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.671 2.247 . . . . 0.0 112.319 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.417 ' HA ' ' HD2' ' A' ' 22' ' ' PRO . 34.1 mt -70.1 -9.94 13.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.66 0.743 . . . . 0.0 110.582 -178.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.8 p -86.43 -13.62 45.68 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.332 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.533 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 72.2 t80 -73.51 143.5 82.48 Favored Pre-proline 0 C--N 1.326 -0.42 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.533 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 10.9 Cg_endo -94.1 14.96 44.12 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 124.703 -0.957 . . . . 0.0 113.172 0.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.5 m -65.81 -30.34 70.95 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.583 0.706 . . . . 0.0 109.738 177.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.3 m -122.06 150.64 41.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.521 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.24 144.68 92.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.427 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -77.61 156.23 31.82 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.66 2.24 . . . . 0.0 111.872 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -93.06 109.82 21.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.097 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.574 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 52.9 mt -76.01 128.82 37.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 177.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.38 -62.72 1.25 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.991 -173.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.488 HG22 HG22 ' A' ' 82' ' ' ILE . 21.2 t 60.39 83.15 0.21 Allowed Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.151 -173.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.17 -20.93 71.56 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.015 2.477 . . . . 0.0 113.462 -173.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -71.79 -25.32 61.96 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.858 0.361 . . . . 0.0 111.19 -178.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 86.8 mt -97.3 16.41 20.07 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.246 -0.284 . . . . 0.0 110.895 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -59.89 92.62 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.476 -177.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 68.44 21.86 74.57 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.939 -0.573 . . . . 0.0 113.346 174.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -98.56 -45.69 6.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.94 0.37 . . . . 0.0 110.821 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.438 HG23 HD11 ' A' ' 153' ' ' LEU . 33.6 m . . . . . 0 C--N 1.326 -0.418 0 CA-C-O 121.502 0.668 . . . . 0.0 110.524 178.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.63 0 N-CA-C 112.363 -0.295 . . . . 0.0 112.363 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -124.24 142.49 51.2 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.2 pt -80.48 159.15 4.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.917 0.389 . . . . 0.0 111.221 -177.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 20.8 p -99.94 118.81 37.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.501 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.4 mt -86.74 176.35 7.78 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.552 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.448 HG23 ' HB2' ' A' ' 121' ' ' PHE . 8.7 t -71.59 149.67 45.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.398 179.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -64.5 -38.33 90.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.362 -175.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -71.75 -9.35 58.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.457 -177.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.448 ' HB2' HG23 ' A' ' 118' ' ' THR . 70.6 t80 -69.72 -34.69 74.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.736 0.303 . . . . 0.0 111.036 -178.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.41 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 14.5 mmmm -61.94 -53.58 58.59 Favored Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -177.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.53 ' O ' ' HG3' ' A' ' 127' ' ' ARG . 19.7 Cg_endo -61.61 -37.09 71.95 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 121.701 1.601 . . . . 0.0 111.8 174.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 63.9 tp -57.2 -47.03 82.32 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.921 0.391 . . . . 0.0 110.589 178.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.549 ' O ' HG23 ' A' ' 129' ' ' VAL . 29.5 t-105 -60.29 -53.06 62.17 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.001 177.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -58.06 -38.87 77.12 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.319 -175.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.53 ' HG3' ' O ' ' A' ' 123' ' ' PRO . 98.1 mtt180 -63.24 -26.69 68.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.685 0.278 . . . . 0.0 111.581 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -108.85 21.71 16.87 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.121 0.486 . . . . 0.0 111.053 -174.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.549 HG23 ' O ' ' A' ' 125' ' ' TRP . 68.8 t -107.77 136.43 19.69 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.959 175.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.432 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 1.4 Cg_endo -86.35 -158.3 1.36 Allowed 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 124.193 -1.169 . . . . 0.0 112.948 0.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.555 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 55.5 mttp 75.77 -0.55 3.17 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.168 0.987 . . . . 0.0 111.956 -177.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . 0.441 ' HZ ' HD12 ' A' ' 140' ' ' LEU . 4.3 t80 -72.53 163.95 27.2 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -151.67 165.38 30.54 Favored Glycine 0 C--O 1.236 0.265 0 C-N-CA 120.209 -0.996 . . . . 0.0 112.801 -174.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.44 HD23 HD11 ' A' ' 39' ' ' LEU . 48.2 tp -58.01 -46.74 84.76 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.52 0.728 . . . . 0.0 112.595 -172.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.46 -30.02 51.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.323 0.583 . . . . 0.0 111.8 -177.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -71.13 -31.23 67.47 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.566 -178.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 35.7 tp -58.79 -47.48 84.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.026 0.441 . . . . 0.0 110.815 178.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . 0.471 ' HA ' ' HB3' ' A' ' 142' ' ' LEU . 1.3 mpt? -67.01 -39.35 87.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.903 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -69.86 -42.08 73.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.176 -177.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.441 HD12 ' HZ ' ' A' ' 132' ' ' PHE . 84.0 mt -95.01 -24.29 16.99 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -173.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -119.66 -63.69 0.27 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.098 -1.048 . . . . 0.0 113.755 -174.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.471 ' HB3' ' HA ' ' A' ' 138' ' ' MET . 1.4 tm? -57.99 -51.94 67.57 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -172.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.84 -61.17 7.75 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 121.312 -0.471 . . . . 0.0 113.134 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . 0.501 ' O ' HG23 ' A' ' 148' ' ' VAL . 77.3 Cg_exo -52.36 -36.58 69.31 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.884 2.389 . . . . 0.0 113.14 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -62.99 -49.0 76.42 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.788 0.328 . . . . 0.0 110.344 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 91.6 mt -60.1 -41.79 93.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.537 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.04 -8.61 46.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.316 -176.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 144' ' ' PRO . 94.7 t -106.44 -55.59 5.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.651 0.263 . . . . 0.0 111.362 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -79.84 -42.83 23.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.907 -170.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.564 ' O ' HG13 ' A' ' 154' ' ' ILE . 49.0 mm -59.66 -52.67 72.34 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -172.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.535 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 70.3 Cg_exo -53.45 -34.56 72.23 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.349 2.033 . . . . 0.0 113.488 -178.068 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.6 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 9.2 m-20 -86.26 -27.07 24.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.947 0.403 . . . . 0.0 110.875 178.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.652 ' HG ' ' HB ' ' A' ' 158' ' ' VAL . 15.7 tp -70.5 -26.79 63.76 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.146 0.498 . . . . 0.0 110.193 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 150' ' ' ILE . 69.1 mt -66.05 -49.56 75.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.736 175.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 1.4 pp0? -69.92 -20.17 63.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.188 -176.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 67.6 mttm -77.11 -16.64 59.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.077 0.465 . . . . 0.0 110.269 174.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 90.45 17.15 53.72 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.851 177.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . 0.652 ' HB ' ' HG ' ' A' ' 153' ' ' LEU . 58.7 t -88.71 -40.46 13.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.797 0.332 . . . . 0.0 110.705 -178.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.549 HD11 HD23 ' A' ' 153' ' ' LEU . 48.1 mm . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.325 178.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.56 0.219 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.437 ' O ' HG23 ' A' ' 10' ' ' VAL . 25.7 m -64.13 -35.63 81.41 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.576 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -62.42 -39.88 94.74 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 120.855 0.359 . . . . 0.0 110.285 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.427 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 44.0 ttt85 -65.7 -38.17 88.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.686 178.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 5' ' ' ALA . 97.5 t -60.48 -41.03 86.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.937 0.399 . . . . 0.0 110.546 177.138 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 6' ' ' THR . 59.7 t -69.16 -27.17 33.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 121.099 0.476 . . . . 0.0 110.354 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.3 t -73.55 -32.47 64.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.231 177.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 8' ' ' ARG . 44.3 mt-10 -81.49 -28.26 34.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.877 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.401 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 51.0 mt -104.73 87.56 1.86 Allowed Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 174.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.8 Cg_endo -50.18 141.71 30.22 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.884 3.056 . . . . 0.0 113.636 -169.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.4 m -69.33 149.53 10.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.369 177.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.556 HD21 ' HA ' ' A' ' 35' ' ' GLU . 6.4 mp -99.98 153.95 18.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.196 0.522 . . . . 0.0 111.571 -175.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.2 mttt -98.22 -49.67 4.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.619 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.4 m -75.17 108.05 7.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.606 -170.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -105.7 90.41 3.39 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.404 ' O ' ' HD3' ' A' ' 91' ' ' PRO . . . -145.04 145.63 31.55 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.492 -177.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.1 167.49 41.75 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.149 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.28 -13.47 38.33 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 123.217 2.611 . . . . 0.0 113.088 -176.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -74.14 -24.6 59.44 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.801 0.334 . . . . 0.0 110.869 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -89.4 94.27 9.83 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 25' ' ' ARG . 43.3 mtm105 -60.11 -51.58 69.02 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -164.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -73.75 -29.94 62.51 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.496 -175.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -76.6 -26.52 55.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.904 0.383 . . . . 0.0 110.199 175.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.531 ' CH2' HG21 ' A' ' 86' ' ' ILE . 55.3 t-105 -64.2 -44.73 91.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.982 175.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.52 -41.35 81.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.353 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.698 ' HG3' ' HE3' ' A' ' 33' ' ' LYS . 53.5 tt0 -64.63 -44.0 91.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.308 177.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.537 HH22 HD22 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -54.52 -45.08 73.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.721 177.16 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.6 mp -62.88 -46.24 88.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.592 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.698 ' HE3' ' HG3' ' A' ' 30' ' ' GLN . 20.7 pttp -68.26 -38.88 82.23 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.904 -176.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 6.6 mm-40 -68.26 -45.13 74.0 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.712 0.292 . . . . 0.0 110.634 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.556 ' HA ' HD21 ' A' ' 16' ' ' LEU . 10.0 tp10 -61.91 -42.51 99.17 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.084 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -63.84 -30.55 71.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.49 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.684 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 81.8 mm-40 -62.32 -49.51 75.33 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 m -63.72 -38.15 90.04 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.897 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.462 ' O ' HG23 ' A' ' 43' ' ' VAL . 92.8 mt -61.22 -55.92 26.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 177.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 87.2 mt -62.27 -36.22 73.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.78 -178.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -55.24 -47.17 75.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.991 175.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -72.45 -41.03 66.56 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.354 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.6 t -59.54 -39.05 78.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 120.736 0.303 . . . . 0.0 110.804 178.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -55.14 -54.83 38.31 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.4 -46.6 83.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.31 178.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -56.07 -51.41 67.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.623 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -63.16 -32.57 73.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.627 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -65.34 -36.73 84.9 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.006 0.431 . . . . 0.0 110.59 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -85.68 2.42 45.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.802 178.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.1 t70 64.51 23.02 12.83 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.844 0.831 . . . . 0.0 110.866 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -114.08 76.62 1.0 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.502 177.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -72.91 104.7 4.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.277 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.494 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -75.53 -61.22 1.99 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.458 -168.645 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.494 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 3.3 p90 -162.48 172.34 15.65 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.794 -173.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.506 ' NH2' ' HH2' ' A' ' 70' ' ' TRP . 4.5 ptp180 -141.79 133.32 26.82 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.5 tp -121.23 123.48 42.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.164 0.507 . . . . 0.0 110.545 -173.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -109.23 164.42 12.47 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.658 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.9 m -141.93 156.2 45.49 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 179.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -74.57 162.93 28.3 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 168.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -70.63 -4.8 25.16 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -171.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -98.57 -16.13 19.24 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.142 0.496 . . . . 0.0 110.471 173.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.69 15.61 75.75 Favored Glycine 0 CA--C 1.52 0.392 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.597 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.3 p -86.33 -3.37 58.97 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -158.76 120.31 3.44 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -105.22 145.59 30.43 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -178.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 83' ' ' GLU . 45.8 p90 -153.34 158.92 42.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.457 -176.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 166.83 -150.53 17.61 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.564 -0.826 . . . . 0.0 112.078 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.579 ' HD3' ' HB2' ' A' ' 79' ' ' GLU . 38.9 ttmt -133.21 140.95 47.82 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 -178.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.5 t -134.56 138.12 44.34 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.782 ' HB3' ' HA ' ' A' ' 79' ' ' GLU . 22.5 p90 -148.12 159.4 43.97 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.225 -0.59 . . . . 0.0 111.06 178.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 64.3 t80 -124.34 129.47 50.77 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.877 -176.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 49.9 mm -100.01 118.56 46.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 179.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 82.4 t60 -146.5 119.1 8.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.07 -0.513 . . . . 0.0 109.646 -178.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.465 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 0.9 OUTLIER 63.84 31.93 13.72 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.418 0.449 . . . . 0.0 110.151 -175.687 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.2 mm? 71.84 -3.75 2.11 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.43 -176.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 73' ' ' HIS . 93.1 mt -65.12 123.75 20.34 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.726 0.298 . . . . 0.0 110.417 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -114.01 108.38 16.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.296 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.495 ' CE1' HG21 ' A' ' 150' ' ' ILE . 0.5 OUTLIER -129.94 109.83 11.19 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.22 177.368 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.782 ' HA ' ' HB3' ' A' ' 70' ' ' TRP . 11.4 pt-20 -96.64 143.71 27.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.091 -176.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -132.96 136.68 46.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.041 177.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -82.19 127.61 33.33 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 176.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 48.0 pt -126.52 158.38 36.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.121 0.486 . . . . 0.0 111.284 -175.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 66' ' ' PHE . 7.3 pt-20 -159.26 170.16 22.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.793 174.535 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.553 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 39.4 p90 -167.93 146.59 4.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.118 0.485 . . . . 0.0 110.411 173.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -89.76 167.11 13.13 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.342 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.531 HG21 ' CH2' ' A' ' 28' ' ' TRP . 47.2 mm -114.36 89.46 17.87 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.572 -177.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -63.2 163.46 22.97 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.802 2.335 . . . . 0.0 111.925 175.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.402 ' N ' HD12 ' A' ' 88' ' ' ILE . 2.0 mp -62.31 -23.79 33.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-O 121.145 0.498 . . . . 0.0 110.938 -178.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.534 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 1.3 p -72.79 -12.75 61.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -178.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -73.02 141.0 81.02 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.404 ' HD3' ' O ' ' A' ' 20' ' ' ALA . 63.6 Cg_endo -97.55 8.63 36.05 Favored 'Cis proline' 0 N--CA 1.458 -0.564 0 C-N-CA 124.437 -1.068 . . . . 0.0 112.895 -0.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 25.2 m -60.6 -32.92 72.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.409 0.623 . . . . 0.0 110.429 -178.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.534 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 29.6 m -126.3 132.58 51.61 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 172.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.3 144.74 97.43 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.693 0.282 . . . . 0.0 111.509 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -82.51 158.35 16.81 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.693 2.262 . . . . 0.0 112.24 177.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -83.31 115.83 22.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.223 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.553 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 5.0 mp -73.9 131.38 35.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.294 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.445 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -100.72 123.0 44.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.933 0.396 . . . . 0.0 110.904 -179.022 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.0 t -129.33 87.09 54.56 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.37 178.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.75 -19.37 45.94 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 123.273 2.648 . . . . 0.0 113.917 -173.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.457 ' O ' ' HD3' ' A' ' 105' ' ' LYS . 7.8 tp10 -84.53 3.86 34.6 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.971 0.415 . . . . 0.0 110.985 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.7 mt -123.38 22.01 9.37 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 122.161 -0.337 . . . . 0.0 111.005 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -69.29 89.32 0.47 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.113 0.483 . . . . 0.0 111.146 -177.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 60.49 25.44 63.05 Favored Glycine 0 CA--C 1.52 0.358 0 CA-C-N 115.395 -0.821 . . . . 0.0 113.915 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' ' 101' ' ' GLU . 19.8 ptmt -116.08 13.41 15.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.178 0.489 . . . . 0.0 111.835 -177.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.2 t . . . . . 0 C--N 1.325 -0.488 0 CA-C-O 121.095 0.474 . . . . 0.0 110.118 172.57 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.407 0 N-CA-C 111.859 -0.496 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 98' ' ' ALA . 17.5 ptpt -105.06 140.32 38.41 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 178.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.42 HD11 ' HB ' ' A' ' 97' ' ' ILE . 2.8 pp -101.03 161.58 3.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.516 -179.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 73.3 m -138.47 161.93 35.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.019 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.4 mt -103.75 167.74 9.59 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.795 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.0 t -57.81 156.52 8.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.143 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -50.8 -36.33 36.6 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.282 -178.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.427 ' O ' ' HD2' ' A' ' 123' ' ' PRO . 19.4 m170 -67.06 -21.58 65.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.591 -172.046 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -68.65 -36.55 78.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.217 -178.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.58 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 26.8 ttpp -60.97 -49.52 88.74 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -174.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.58 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 20.7 Cg_exo -66.82 -39.41 14.86 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 121.662 1.575 . . . . 0.0 112.19 174.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 51.4 tp -59.69 -49.28 78.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.129 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.42 ' O ' HG23 ' A' ' 129' ' ' VAL . 58.9 t-105 -57.62 -52.21 66.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.908 -176.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.09 -13.29 62.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.597 -176.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -91.82 -26.73 18.38 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.944 0.402 . . . . 0.0 110.376 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -85.35 -44.46 12.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.209 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.552 HG13 ' HA ' ' A' ' 130' ' ' PRO . 91.9 t -51.97 138.9 34.07 Favored Pre-proline 0 N--CA 1.471 0.577 0 O-C-N 123.704 0.627 . . . . 0.0 111.093 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.552 ' HA ' HG13 ' A' ' 129' ' ' VAL . 4.7 Cg_exo -81.48 -152.38 0.78 Allowed 'Cis proline' 0 C--N 1.353 0.814 0 C-N-CA 124.574 -1.011 . . . . 0.0 113.118 3.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm 76.02 -20.67 0.35 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.657 0.783 . . . . 0.0 111.322 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.8 -179.28 7.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.74 0.305 . . . . 0.0 110.546 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -179.86 -179.57 48.79 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.14 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.457 HD21 ' HZ ' ' A' ' 84' ' ' PHE . 55.5 tp -66.75 -37.21 84.19 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 122.625 0.37 . . . . 0.0 111.204 -176.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.31 -38.8 77.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.406 0.622 . . . . 0.0 110.404 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -71.67 -32.45 67.89 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.009 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 57.5 tp -66.55 -45.57 78.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.454 -179.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -35.94 74.77 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.119 -177.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -76.63 -50.47 13.69 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 86.9 mt -89.58 -14.06 35.89 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -173.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -108.16 -63.42 0.56 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.632 -179.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.505 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 60.9 tp -67.59 -40.83 84.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.471 0.177 . . . . 0.0 111.462 -175.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.08 -61.48 6.52 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.24 -0.505 . . . . 0.0 113.259 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . 0.439 ' O ' HG23 ' A' ' 148' ' ' VAL . 45.0 Cg_exo -59.17 -33.76 98.3 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.58 2.186 . . . . 0.0 112.568 177.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -62.7 -41.74 99.29 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.036 0.446 . . . . 0.0 110.424 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 97.9 mt -59.72 -36.14 75.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.628 177.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.79 -9.7 58.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.556 -178.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 144' ' ' PRO . 60.4 t -91.82 -56.04 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.668 0.271 . . . . 0.0 111.135 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -89.63 -41.59 11.88 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -172.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.563 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.9 mm -56.2 -52.86 69.53 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -172.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.563 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 51.0 Cg_exo -55.44 -40.87 83.13 Favored 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.04 1.827 . . . . 0.0 112.356 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -68.79 -39.99 79.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.234 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.561 HD12 ' HD2' ' A' ' 156' ' ' LYS . 21.7 tp -64.41 -28.93 70.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.983 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 150' ' ' ILE . 78.8 mt -63.92 -53.28 46.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.571 177.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -69.64 -14.43 62.81 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.175 0.512 . . . . 0.0 110.22 -178.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . 0.561 ' HD2' HD12 ' A' ' 153' ' ' LEU . 28.1 ttmt -69.03 -13.55 62.51 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.769 -178.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 91.6 -16.7 58.54 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.275 173.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.9 p -73.45 -31.58 33.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.701 0.286 . . . . 0.0 110.932 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.556 HD11 HD23 ' A' ' 153' ' ' LEU . 57.4 mt . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.496 178.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.434 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 120.726 0.298 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.482 ' O ' HG23 ' A' ' 10' ' ' VAL . 22.2 m -57.78 -54.74 43.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.355 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -62.53 -36.41 82.5 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.496 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.2 tpm_? -61.34 -44.5 97.08 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.794 0.331 . . . . 0.0 110.435 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.464 ' O ' HG13 ' A' ' 13' ' ' ILE . 92.0 t -67.5 -46.58 82.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.818 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 6' ' ' THR . 88.7 t -58.01 -45.28 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.885 -177.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.2 m -65.7 -19.37 65.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -103.59 13.22 33.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.655 0.264 . . . . 0.0 111.266 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 9' ' ' VAL . 52.1 mt -122.4 89.53 49.3 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.04 161.06 5.34 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.549 2.833 . . . . 0.0 113.723 -175.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.433 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 35.6 m -97.56 179.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.983 -179.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.999 HD21 ' HB3' ' A' ' 35' ' ' GLU . 7.1 mp -108.1 154.08 22.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.271 -176.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.555 ' HG2' ' OE1' ' A' ' 34' ' ' GLU . 36.1 mmtm -78.85 -66.47 0.86 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.536 0.684 . . . . 0.0 109.176 171.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.4 m -75.68 126.64 31.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.686 -176.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -120.77 81.82 1.82 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.415 0.626 . . . . 0.0 109.887 171.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -125.83 -173.38 2.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.895 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -127.27 -177.19 14.75 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.204 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.473 ' HD2' ' O ' ' A' ' 88' ' ' ILE . 39.3 Cg_exo -61.94 -5.4 6.11 Favored 'Trans proline' 0 CA--C 1.533 0.45 0 C-N-CA 123.265 2.644 . . . . 0.0 113.254 -179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.3 mtm105 -67.22 -41.64 85.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.305 0.574 . . . . 0.0 110.015 175.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.546 ' HB3' HD23 ' A' ' 27' ' ' LEU . 5.6 m-20 -92.44 95.11 9.46 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.102 177.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -58.69 -47.17 85.44 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -170.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -72.33 -38.69 68.57 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.085 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.546 HD23 ' HB3' ' A' ' 24' ' ' ASP . 3.6 mm? -68.58 -29.19 67.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.003 0.43 . . . . 0.0 110.252 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.49 ' O ' HD23 ' A' ' 32' ' ' LEU . 63.3 t-105 -62.24 -47.69 83.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.978 175.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 50.7 t -57.26 -35.1 47.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.644 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.401 HE21 ' HB3' ' A' ' 30' ' ' GLN . 23.8 mt-30 -70.2 -39.01 75.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.911 176.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.691 ' NH2' ' HG3' ' A' ' 91' ' ' PRO . 27.5 ttt-85 -64.26 -39.78 94.65 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.054 -0.351 . . . . 0.0 110.054 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.49 HD23 ' O ' ' A' ' 28' ' ' TRP . 4.0 mm? -52.72 -58.48 6.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.002 177.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -61.7 -35.48 78.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 121.248 -0.181 . . . . 0.0 111.105 -177.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.555 ' OE1' ' HG2' ' A' ' 17' ' ' LYS . 46.0 mm-40 -62.34 -54.63 37.68 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.484 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.999 ' HB3' HD21 ' A' ' 16' ' ' LEU . 15.5 pt-20 -77.57 -27.08 51.33 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.515 -177.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.551 ' O ' HG13 ' A' ' 40' ' ' ILE . 2.0 m-85 -55.06 -45.0 75.26 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 169.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -59.98 -41.58 92.31 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.86 0.362 . . . . 0.0 110.598 176.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.3 t -60.81 -43.7 97.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.938 176.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.481 ' O ' HG23 ' A' ' 43' ' ' VAL . 79.2 mt -61.35 -49.97 74.81 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.878 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.0 mt -53.1 -43.36 48.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.58 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.87 -44.26 97.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.682 0.277 . . . . 0.0 110.49 -179.297 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -66.8 -41.3 87.79 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.854 0.359 . . . . 0.0 110.204 177.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.509 HG12 ' HE2' ' A' ' 47' ' ' LYS . 80.4 t -59.92 -42.93 91.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.731 178.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 44.0 mt-10 -55.83 -54.08 48.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.506 177.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -61.13 -50.26 73.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.662 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.65 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 10.5 t30 -72.39 -32.46 66.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.285 -169.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.509 ' HE2' HG12 ' A' ' 43' ' ' VAL . 42.8 mtmt -71.33 -45.53 62.78 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.845 176.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -69.61 -18.73 63.63 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.236 0.541 . . . . 0.0 110.226 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.13 -2.3 47.88 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.806 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.5 t70 59.62 37.7 22.39 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.842 0.829 . . . . 0.0 109.329 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -133.44 29.29 3.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.135 -173.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.65 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 9.6 p-10 -69.16 105.34 2.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.691 0.758 . . . . 0.0 110.012 178.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 43.5 p-90 -108.94 10.43 26.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.309 -170.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 37.2 p90 -158.05 156.93 31.94 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.651 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.426 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 21.6 mmm180 -130.08 123.77 31.23 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.99 -1.004 . . . . 0.0 108.934 171.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 52.0 mt -123.56 124.62 43.22 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.149 0.5 . . . . 0.0 110.63 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -116.6 150.17 38.48 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.3 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.4 m -106.77 147.63 29.43 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.059 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -77.78 172.33 13.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 172.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -62.06 -23.45 66.5 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -175.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -91.99 -20.68 21.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.694 -177.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.66 16.9 80.01 Favored Glycine 0 C--O 1.228 -0.223 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.588 -175.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.0 p -98.79 -16.72 18.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.969 0.414 . . . . 0.0 111.367 -176.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -136.99 125.85 24.12 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.497 179.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 34.1 m95 -109.42 137.65 46.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.1 p90 -145.08 160.26 41.68 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.463 -176.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.426 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 162.75 -159.33 31.68 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.33 -0.938 . . . . 0.0 112.51 178.079 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -121.23 146.83 46.4 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.898 0.38 . . . . 0.0 110.972 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 51.1 t -112.34 123.96 51.42 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 168.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.456 ' HD1' ' HG2' ' A' ' 79' ' ' GLU . 6.9 m0 -106.02 122.07 45.41 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.788 -177.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -118.74 118.66 32.22 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 176.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 30.8 mm -99.88 119.95 48.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -127.62 115.34 18.62 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.04 -176.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.473 ' C ' HD22 ' A' ' 75' ' ' LEU . 39.7 m-20 67.65 -85.8 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 124.027 0.829 . . . . 0.0 110.432 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.473 HD22 ' C ' ' A' ' 74' ' ' ASP . 3.0 mm? -137.04 0.63 2.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.882 0.372 . . . . 0.0 110.108 178.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.8 mt -108.69 149.61 28.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.335 -170.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -110.19 119.64 39.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.784 179.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -110.06 115.13 29.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.456 ' HG2' ' HD1' ' A' ' 70' ' ' TRP . 30.5 mt-10 -100.63 136.56 40.32 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.635 -175.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -128.93 116.76 19.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.814 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.73 131.83 36.74 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 176.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.461 HG22 HG22 ' A' ' 99' ' ' VAL . 23.3 pt -126.21 147.9 30.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.909 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -155.09 141.6 18.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.761 178.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.605 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 44.7 p90 -156.25 147.29 22.18 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.362 0.601 . . . . 0.0 111.652 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.544 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 5.2 p-10 -92.26 156.29 17.39 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.433 178.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.7 mm -104.88 90.87 3.83 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.403 179.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.544 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 71.5 Cg_exo -48.53 148.78 7.7 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.3 2.667 . . . . 0.0 113.189 -178.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.473 ' O ' ' HD2' ' A' ' 22' ' ' PRO . 50.3 mm -58.43 -27.54 33.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.1 -178.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.758 HG22 ' HB ' ' A' ' 92' ' ' THR . 4.1 m -93.52 17.58 11.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.964 0.411 . . . . 0.0 111.588 -178.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 91' ' ' PRO . 87.4 t80 -68.56 138.24 91.07 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 174.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.691 ' HG3' ' NH2' ' A' ' 31' ' ' ARG . 35.7 Cg_endo -97.83 12.35 33.59 Favored 'Cis proline' 0 C--N 1.346 0.446 0 C-N-CA 124.377 -1.093 . . . . 0.0 113.096 -1.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.758 ' HB ' HG22 ' A' ' 89' ' ' THR . 24.3 m -56.38 -35.82 68.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.401 0.619 . . . . 0.0 109.805 177.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 52.5 m -117.86 125.31 50.27 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.368 -0.833 . . . . 0.0 108.761 171.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.402 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -67.76 144.75 97.67 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-O 120.779 0.323 . . . . 0.0 111.528 -174.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 9.4 Cg_exo -71.52 124.91 10.72 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.777 2.318 . . . . 0.0 111.8 177.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.713 ' HB3' ' HD2' ' A' ' 114' ' ' LYS . 36.9 mt-10 -75.94 103.42 6.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.792 178.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.605 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 58.3 mt -70.01 136.36 26.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.626 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -112.96 130.1 56.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.686 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.461 HG22 HG22 ' A' ' 82' ' ' ILE . 36.3 t -121.56 88.18 46.3 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.944 179.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -55.6 -29.53 70.54 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.999 2.466 . . . . 0.0 113.308 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -66.73 -36.25 82.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.777 0.322 . . . . 0.0 111.315 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 85.3 mt -90.96 1.06 57.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.972 0.415 . . . . 0.0 111.059 -177.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -65.24 109.58 2.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.821 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 98.58 -27.57 18.98 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.363 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -80.67 -12.41 59.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.888 0.375 . . . . 0.0 111.71 -175.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 C--N 1.322 -0.596 0 CA-C-O 120.923 0.392 . . . . 0.0 110.427 177.9 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.685 0 N-CA-C 112.437 -0.265 . . . . 0.0 112.437 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.713 ' HD2' ' HB3' ' A' ' 96' ' ' GLU . 71.3 mmtt -85.68 137.99 32.44 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.598 0.237 . . . . 0.0 110.625 -176.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.465 ' CD1' ' HB ' ' A' ' 97' ' ' ILE . 46.7 pt -76.83 157.61 5.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.428 0.633 . . . . 0.0 111.918 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 49.5 t -125.29 113.53 17.73 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.1 173.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 88.3 mt -81.9 -82.2 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.984 -176.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.6 t -163.39 154.42 16.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.368 -177.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -62.54 -30.03 71.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.504 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.6 t60 -73.4 -20.05 60.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.215 -175.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -68.54 -40.01 80.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.892 -174.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -61.35 -55.05 47.09 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -174.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.11 -32.77 83.35 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.702 1.601 . . . . 0.0 112.164 175.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.53 -43.51 76.58 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.892 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.534 ' O ' HG23 ' A' ' 129' ' ' VAL . 70.0 t-105 -61.56 -57.48 11.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.53 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.36 -30.06 68.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.929 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -77.7 -23.04 49.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.814 0.34 . . . . 0.0 111.529 -177.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.405 ' HB2' ' HE2' ' A' ' 132' ' ' PHE . 34.0 m-80 -106.0 10.29 32.29 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 125' ' ' TRP . 97.6 t -87.63 139.68 31.5 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.454 ' HA ' HG13 ' A' ' 129' ' ' VAL . 64.8 Cg_endo -95.6 -146.19 0.16 OUTLIER 'Cis proline' 0 C--N 1.353 0.77 0 C-N-CA 124.972 -0.845 . . . . 0.0 113.781 5.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.433 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 49.3 mtmt 75.07 11.06 3.63 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.698 -176.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . 0.405 ' HE2' ' HB2' ' A' ' 128' ' ' ASN . 0.2 OUTLIER -91.64 144.61 25.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.985 -179.863 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -146.57 167.42 28.09 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 178.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 43.6 tp -55.24 -33.13 62.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.143 0.471 . . . . 0.0 111.692 -177.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.87 -47.27 77.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.987 0.422 . . . . 0.0 111.43 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -71.29 -38.45 71.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.463 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.406 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 67.2 tp -65.33 -44.57 87.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.43 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 15.8 tpt -66.56 -47.97 71.12 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.927 0.394 . . . . 0.0 110.916 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.417 ' O ' ' HD3' ' A' ' 144' ' ' PRO . . . -71.2 -44.8 64.7 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.131 -175.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.8 mt -94.74 -0.24 54.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.796 0.331 . . . . 0.0 111.665 -174.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -113.24 -75.12 0.69 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.282 -0.961 . . . . 0.0 112.722 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.45 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 9.8 tt -67.49 -36.56 81.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.676 0.274 . . . . 0.0 110.832 -175.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.67 -61.85 6.86 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.177 -0.535 . . . . 0.0 113.274 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . 0.444 ' O ' HG23 ' A' ' 148' ' ' VAL . 32.9 Cg_exo -60.14 -33.04 95.32 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.549 2.166 . . . . 0.0 112.53 177.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 60.3 t90 -60.08 -39.55 86.48 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.903 0.383 . . . . 0.0 110.747 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 95.2 mt -58.04 -41.81 84.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.751 178.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.57 -15.06 63.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.819 -176.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 144' ' ' PRO . 56.3 t -88.06 -42.49 14.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.469 -177.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -104.02 -44.38 5.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -173.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.551 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.3 mm -55.99 -52.74 70.17 Favored Pre-proline 0 CA--C 1.54 0.562 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -170.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.551 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 51.8 Cg_exo -56.46 -31.62 86.47 Favored 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 122.01 1.807 . . . . 0.0 112.929 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -86.96 -26.72 23.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.833 0.349 . . . . 0.0 110.731 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.501 HD23 HD11 ' A' ' 159' ' ' ILE . 24.8 tp -70.21 -40.52 74.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.998 178.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 73.6 mt -63.19 -44.51 99.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.229 176.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.463 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . 6.3 tp60 -69.44 -22.94 63.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.06 -177.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -83.19 -2.21 54.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.169 0.509 . . . . 0.0 110.303 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 72.05 24.18 76.88 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 115.817 -0.629 . . . . 0.0 113.025 175.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 40.2 t -84.53 -31.34 7.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.216 0.531 . . . . 0.0 110.722 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.501 HD11 HD23 ' A' ' 153' ' ' LEU . 53.8 mt . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.53 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.457 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 CA--C 1.529 0.166 0 CA-C-O 120.723 0.297 . . . . 0.0 111.395 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.7 m -64.0 -36.67 84.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.054 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.17 -37.17 72.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.008 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -61.46 -38.84 88.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.894 0.378 . . . . 0.0 110.416 175.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 5' ' ' ALA . 88.5 t -57.28 -52.73 52.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.414 176.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 65.0 t -64.52 -35.32 74.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.504 -177.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.6 m -70.45 -36.28 73.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.801 -177.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.431 ' HB3' HD21 ' A' ' 45' ' ' ASN . 43.8 mt-10 -96.52 -16.93 20.84 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -176.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.446 HD12 HG13 ' A' ' 9' ' ' VAL . 25.6 mt -108.56 90.21 7.0 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 177.059 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -40.12 128.24 2.15 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.959 3.106 . . . . 0.0 113.872 -174.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.5 m -76.26 146.03 9.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.654 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mp -100.94 131.64 46.72 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.109 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -110.7 -29.38 8.03 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.16 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.6 m -68.32 97.17 0.71 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.455 175.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -134.76 128.41 32.82 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.809 0.337 . . . . 0.0 110.588 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -146.97 -37.39 0.22 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.514 178.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.47 161.36 10.89 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.935 -0.65 . . . . 0.0 111.599 178.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -69.47 -7.45 20.99 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.73 2.286 . . . . 0.0 112.303 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.43 ' CG ' HG23 ' A' ' 88' ' ' ILE . 22.8 mmm180 -88.6 -3.01 58.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.718 178.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -112.76 103.55 11.56 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.607 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -61.09 -52.18 66.01 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -170.28 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.607 ' HG3' HD22 ' A' ' 27' ' ' LEU . 11.0 pt-20 -72.87 -38.92 66.85 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.576 -0.45 . . . . 0.0 112.018 -171.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.607 HD22 ' HG3' ' A' ' 26' ' ' GLU . 4.0 mm? -71.98 -31.15 65.98 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.682 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 -68.21 -33.0 73.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.131 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 25' ' ' ARG . 67.0 t -58.2 -49.98 79.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.641 177.007 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -61.08 -47.25 87.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.784 0.326 . . . . 0.0 110.549 178.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.566 HH22 ' HA2' ' A' ' 133' ' ' GLY . 45.9 ttt-85 -64.44 -35.24 80.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -176.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.419 HD22 ' HA ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -60.59 -53.17 60.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.81 -177.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? -67.06 -41.14 86.96 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.046 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -64.71 -38.06 89.7 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.868 -179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -66.85 -36.32 82.07 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.442 ' O ' HG13 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -65.0 -46.94 79.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.25 178.731 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -63.03 -34.75 78.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.814 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -60.16 -46.64 88.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.866 174.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.524 ' O ' HG23 ' A' ' 43' ' ' VAL . 84.1 mt -61.02 -51.5 68.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.807 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.461 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 80.5 mt -56.81 -40.84 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.339 -178.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -45.6 87.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.037 0.446 . . . . 0.0 110.304 178.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -67.63 -34.97 78.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.341 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 39' ' ' LEU . 84.1 t -62.35 -40.78 89.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.319 175.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 49.3 mt-10 -58.78 -48.75 80.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.906 0.384 . . . . 0.0 110.198 175.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.431 HD21 ' HB3' ' A' ' 12' ' ' GLU . 6.5 m-20 -57.48 -40.25 78.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.837 177.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.52 -51.99 65.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.795 176.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.45 ' HE2' HG12 ' A' ' 43' ' ' VAL . 65.3 mttm -64.29 -28.86 70.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.384 -176.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -59.17 -41.03 87.44 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.638 175.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -90.56 -1.53 57.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.143 0.496 . . . . 0.0 110.49 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.0 t70 69.38 10.54 7.78 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.853 -178.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -95.76 68.17 2.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.521 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -81.67 86.6 6.38 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -97.85 -2.76 40.13 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -165.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -159.13 153.27 23.64 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.777 -0.769 . . . . 0.0 111.666 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -134.62 128.54 33.34 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 171.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.9 tp -131.08 125.13 32.38 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.58 -173.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -136.3 169.14 18.13 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.406 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 61.5 p -152.25 177.9 10.07 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.126 -179.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.466 ' OD1' ' HB2' ' A' ' 61' ' ' GLU . 4.2 p30 -71.52 163.89 26.88 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 168.569 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -73.38 -9.89 59.16 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.787 0.327 . . . . 0.0 111.737 -174.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.466 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 9.1 mm-40 -74.57 -36.43 63.06 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 171.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.99 20.97 69.11 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.509 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.3 p -90.74 -15.13 30.77 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.872 0.368 . . . . 0.0 111.556 -178.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 43.4 mtm180 -146.31 126.17 13.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.219 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.406 ' CD2' ' HB3' ' A' ' 58' ' ' SER . 50.0 m95 -114.26 158.27 21.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.693 -175.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -154.95 152.72 30.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.317 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.41 -162.61 29.47 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.336 178.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.413 ' HE3' ' HB2' ' A' ' 68' ' ' LYS . 35.6 ttmt -152.63 147.0 25.63 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.946 -0.391 . . . . 0.0 109.946 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 58.8 m -118.41 135.23 54.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.357 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 31.3 m-90 -114.52 121.69 44.28 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 176.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 47.8 t80 -120.66 122.95 41.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.195 0.521 . . . . 0.0 110.56 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 27.8 mm -102.87 114.14 41.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.557 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 14.5 t60 -130.21 105.23 7.78 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.137 179.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.3 t70 48.08 74.07 0.18 Allowed 'General case' 0 N--CA 1.465 0.297 0 O-C-N 124.307 1.004 . . . . 0.0 111.914 177.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 72.65 -33.52 0.27 Allowed 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.276 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.5 mt -74.87 123.56 25.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.032 0.444 . . . . 0.0 111.19 -178.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -115.66 119.01 34.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.213 177.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.417 ' CE1' ' HD2' ' A' ' 71' ' ' TYR . 7.1 p90 -140.03 144.96 37.17 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.503 177.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.04 148.8 50.12 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.333 -174.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -120.61 126.08 49.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.672 -177.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -88.2 114.85 25.23 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 99' ' ' VAL . 47.9 pt -124.89 150.07 29.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.282 0.563 . . . . 0.0 112.137 -172.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -156.18 159.58 39.1 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.649 175.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.506 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 43.7 p90 -165.13 163.61 20.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.92 0.39 . . . . 0.0 110.741 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -112.16 157.6 20.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.654 -178.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.438 ' HA ' ' HD2' ' A' ' 87' ' ' PRO . 49.5 mm -107.26 90.32 5.57 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.657 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.438 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 19.8 Cg_endo -56.37 157.86 17.06 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 122.996 2.464 . . . . 0.0 112.948 -177.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.43 HG23 ' CG ' ' A' ' 23' ' ' ARG . 70.1 mt -61.85 -26.41 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.289 -179.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.7 p -81.41 9.24 7.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.112 -0.494 . . . . 0.0 112.228 -176.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.418 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 67.5 t80 -72.93 141.18 81.48 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.418 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 97.0 Cg_endo -96.68 14.23 36.98 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.335 -1.111 . . . . 0.0 113.53 1.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.6 m -64.6 -35.53 81.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.372 0.606 . . . . 0.0 110.343 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.0 m -111.99 131.34 55.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 174.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.461 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -77.59 143.29 67.62 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 120.634 0.254 . . . . 0.0 111.166 -178.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 5.9 Cg_exo -79.97 123.51 5.19 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.208 2.606 . . . . 0.0 111.357 176.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 1.019 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 1.4 mp0 -84.59 126.16 33.09 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.178 -179.096 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.506 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 61.7 mt -72.86 134.6 29.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.459 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.436 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -105.89 128.93 54.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.721 0.296 . . . . 0.0 110.358 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.525 HG22 HG22 ' A' ' 82' ' ' ILE . 14.3 t -128.41 86.44 57.8 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.404 -178.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.8 -27.03 83.99 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 122.911 2.408 . . . . 0.0 112.814 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -65.11 -27.37 68.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.122 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 72.7 mt -96.87 2.94 52.31 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.689 -176.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -64.15 118.76 9.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.792 0.329 . . . . 0.0 110.746 178.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 85.78 -21.94 13.17 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.995 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -74.61 -45.87 42.19 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -179.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.7 t . . . . . 0 C--N 1.325 -0.476 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.628 176.331 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.429 0 CA-C-O 120.48 -0.067 . . . . 0.0 112.987 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 1.019 ' HD3' ' HB2' ' A' ' 96' ' ' GLU . 92.8 mttt -100.42 158.14 16.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.107 0.48 . . . . 0.0 111.211 -177.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 39.5 pt -78.96 176.57 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.846 -176.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 48.3 t -124.46 154.31 40.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.018 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 89.7 mt -124.97 -171.14 2.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.475 -176.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 7.1 t -89.91 158.48 17.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.919 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -62.93 -32.54 73.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.879 -177.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -73.95 -18.29 60.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.252 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -71.57 -38.27 70.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.344 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.465 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 73.4 mmtt -55.67 -58.76 13.97 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -176.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.465 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 38.2 Cg_endo -66.7 -34.61 31.22 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 121.744 1.629 . . . . 0.0 111.871 178.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.4 tp -60.83 -46.34 90.95 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.595 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.516 ' CZ3' HD13 ' A' ' 137' ' ' LEU . 40.8 t-105 -57.83 -57.08 14.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.698 178.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.87 -24.23 67.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.258 -174.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 -85.28 -20.52 29.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.714 0.292 . . . . 0.0 110.975 -177.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -105.81 36.53 2.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.125 0.488 . . . . 0.0 111.465 -177.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 98.2 t -116.77 130.96 24.18 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.469 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 89.6 Cg_endo -85.03 -149.64 0.49 Allowed 'Cis proline' 0 C--N 1.348 0.505 0 C-N-CA 123.973 -1.261 . . . . 0.0 113.267 1.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 99.3 mttt 75.98 9.16 3.41 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.862 0.865 . . . . 0.0 111.027 -174.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -114.94 165.6 12.69 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.566 ' HA2' HH22 ' A' ' 31' ' ' ARG . . . -163.15 175.17 39.49 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.957 -178.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 44.6 tp -67.61 -38.79 84.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.724 0.297 . . . . 0.0 110.606 -177.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.7 -35.94 77.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.399 0.618 . . . . 0.0 110.415 176.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -71.55 -33.5 69.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.305 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.516 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 54.8 tp -64.21 -35.62 81.39 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.844 177.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.1 mmt -69.8 -45.03 68.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.919 0.39 . . . . 0.0 110.873 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.59 -44.12 67.98 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.856 -177.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.3 mt -96.42 0.85 51.06 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -174.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.54 -68.78 0.22 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.812 -178.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 58.6 tp -65.38 -41.0 94.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.663 0.268 . . . . 0.0 111.104 -176.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.0 -61.9 6.46 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.413 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . 0.488 ' O ' HG23 ' A' ' 148' ' ' VAL . 24.0 Cg_endo -64.19 -30.37 64.71 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.492 2.128 . . . . 0.0 112.728 177.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 85.4 t90 -59.66 -45.93 90.56 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.016 0.436 . . . . 0.0 110.479 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 96.7 mt -58.53 -35.36 72.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.953 179.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.28 0.41 32.9 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -176.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 144' ' ' PRO . 89.6 t -95.0 -55.39 6.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.893 0.378 . . . . 0.0 111.098 178.208 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -96.26 -41.3 8.74 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -173.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.554 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 44.6 mm -55.96 -53.61 61.32 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -169.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.554 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 50.9 Cg_exo -54.88 -42.73 66.13 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.853 1.702 . . . . 0.0 112.302 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -74.44 -29.59 61.55 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.476 0.655 . . . . 0.0 110.441 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.54 ' HB3' HD11 ' A' ' 159' ' ' ILE . 13.9 tp -69.1 -34.15 74.63 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.642 178.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 150' ' ' ILE . 79.8 mt -63.98 -43.21 97.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.375 175.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -66.11 -28.05 68.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.187 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . 0.52 ' HE2' HD12 ' A' ' 153' ' ' LEU . 37.2 mtmm -76.72 -20.6 56.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.816 0.341 . . . . 0.0 110.73 177.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 92.86 -8.02 76.58 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.916 -0.659 . . . . 0.0 114.045 170.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.4 p -67.06 -30.61 50.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 117.012 0.406 . . . . 0.0 111.642 -175.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.54 HD11 ' HB3' ' A' ' 153' ' ' LEU . 36.3 mt . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.518 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.473 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 120.642 0.258 . . . . 0.0 111.281 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.508 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.7 OUTLIER -66.54 -46.89 74.63 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -175.938 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -66.27 -28.0 68.37 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.044 0.45 . . . . 0.0 110.203 -179.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -67.7 -43.54 79.85 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.154 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 5' ' ' ALA . 86.2 t -63.41 -40.72 90.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.462 177.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 6' ' ' THR . 91.6 t -64.12 -27.29 42.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.95 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.6 m -69.12 -26.68 65.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.737 0.303 . . . . 0.0 110.832 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -94.12 -7.82 41.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.772 0.32 . . . . 0.0 111.843 176.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.448 HG12 ' HB2' ' A' ' 42' ' ' TYR . 45.6 mt -118.55 86.75 29.68 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 175.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.656 ' HD2' ' HA ' ' A' ' 38' ' ' SER . 73.2 Cg_exo -49.3 151.99 6.04 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.71 2.94 . . . . 0.0 113.878 -172.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.605 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 30.2 m -85.15 151.83 3.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.414 178.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.506 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 7.1 mp -86.81 134.57 33.54 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.316 -179.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -91.41 -44.15 9.31 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.064 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 m -66.13 -74.8 0.1 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.627 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.459 ' OD1' ' HG3' ' A' ' 91' ' ' PRO . 38.8 t30 45.83 43.66 10.19 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.333 176.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.59 -84.49 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.378 -176.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 167.12 172.54 34.45 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.86 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -71.0 -11.34 29.09 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 123.184 2.589 . . . . 0.0 112.464 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 mtp-105 -66.94 -48.6 68.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.616 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.497 ' HB3' HD23 ' A' ' 27' ' ' LEU . 15.0 m-20 -84.31 104.9 14.72 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.567 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 72.5 mtm180 -58.12 -51.8 68.19 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.551 ' HG2' HD22 ' A' ' 27' ' ' LEU . 1.4 pm0 -72.83 -26.28 61.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.642 0.258 . . . . 0.0 111.405 -177.059 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.551 HD22 ' HG2' ' A' ' 26' ' ' GLU . 3.9 mm? -80.29 -30.95 38.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.709 0.29 . . . . 0.0 110.653 178.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.43 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 60.5 t-105 -67.35 -46.83 72.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.167 177.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 90.9 t -60.74 -38.36 78.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.943 0.402 . . . . 0.0 110.445 177.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -70.55 -32.89 70.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.901 0.382 . . . . 0.0 110.161 177.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 67.0 ttt-85 -69.21 -33.16 72.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.123 177.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 90.5 mt -58.39 -42.48 87.18 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.975 174.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -59.55 -47.52 85.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.282 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -54.94 -48.37 73.23 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.945 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -61.84 -48.2 81.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.084 178.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -65.11 -32.3 73.93 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -178.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -58.96 -45.3 90.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.228 0.537 . . . . 0.0 109.994 174.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.656 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 8.3 m -70.77 -44.22 67.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.57 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.448 ' O ' HG23 ' A' ' 43' ' ' VAL . 80.1 mt -60.17 -55.35 34.86 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.25 -179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 85.9 mt -58.05 -46.52 88.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.72 -176.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -58.81 -49.03 79.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.649 -0.25 . . . . 0.0 110.786 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.448 ' HB2' HG12 ' A' ' 13' ' ' ILE . 67.6 t80 -63.06 -49.85 72.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.711 0.291 . . . . 0.0 111.106 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.623 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 93.8 t -59.49 -45.69 93.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.904 -177.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -67.29 -35.0 78.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.667 0.27 . . . . 0.0 111.109 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -60.14 -39.9 87.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.749 0.309 . . . . 0.0 110.256 173.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.443 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 4.9 m-20 -71.65 -32.44 67.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.856 177.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.623 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 34.0 mmtp -57.79 -43.86 85.9 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.209 0.528 . . . . 0.0 110.047 174.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -72.76 -21.46 61.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.933 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -91.72 2.17 56.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.361 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.7 t70 63.43 23.76 13.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.583 0.706 . . . . 0.0 110.874 178.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.443 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 16.9 t30 -125.3 66.52 1.14 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.691 0.758 . . . . 0.0 110.48 -178.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -86.27 106.45 17.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.283 -0.871 . . . . 0.0 108.882 174.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 45.9 p-90 -120.61 6.85 10.52 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -168.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 69' ' ' CYS . 13.8 p90 -162.83 154.23 17.65 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.826 -0.75 . . . . 0.0 112.157 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -138.54 124.4 19.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.003 167.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.7 tp -117.13 124.54 49.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.709 -177.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -131.55 155.56 47.27 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.841 -174.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.6 t -149.12 176.99 10.01 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.105 0.479 . . . . 0.0 110.827 -177.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -86.11 176.73 7.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.463 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 41.5 mmtm -66.53 -19.94 65.9 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -174.753 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -87.36 -17.58 32.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.714 0.292 . . . . 0.0 110.408 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.13 28.63 73.17 Favored Glycine 0 C--N 1.332 0.354 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.552 -179.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.5 p -85.83 -33.1 21.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.04 0.448 . . . . 0.0 111.812 -177.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -129.18 116.1 18.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.661 -179.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -102.33 128.19 49.0 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -136.5 159.46 41.72 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.978 -176.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 172.34 -165.75 38.39 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 119.867 -1.159 . . . . 0.0 112.372 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.5 pttm -142.38 139.74 31.82 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.041 0.448 . . . . 0.0 110.624 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 54' ' ' PHE . 45.7 m -112.49 153.31 27.63 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.263 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 26.0 m-90 -117.67 123.57 46.43 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.025 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -117.96 120.56 38.21 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 177.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.9 mm -88.21 114.71 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.892 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -148.35 110.63 4.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.401 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.7 t70 66.83 62.93 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.338 175.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.3 mt 68.57 -13.12 0.33 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.143 -0.935 . . . . 0.0 113.158 173.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 78.9 mt -109.06 136.67 48.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.259 0.552 . . . . 0.0 111.869 -175.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -93.44 112.22 24.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.287 174.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -97.86 130.26 44.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.715 -0.22 . . . . 0.0 111.043 -178.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -96.97 136.1 38.02 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -126.19 123.93 39.3 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -88.82 131.3 35.14 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.144 0.497 . . . . 0.0 110.054 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.52 HG22 HG22 ' A' ' 99' ' ' VAL . 46.5 pt -131.78 151.37 35.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.602 -178.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -153.22 155.33 36.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.83 174.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 35.3 p90 -159.05 152.73 23.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.4 176.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.54 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 2.2 p30 -97.94 155.24 17.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.673 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.6 mm -106.25 91.12 5.3 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.979 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.54 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 51.4 Cg_exo -54.75 153.89 22.81 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.882 2.388 . . . . 0.0 112.373 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 43.4 mt -61.25 -24.93 34.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.179 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.2 p -88.83 13.32 12.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.049 -178.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.542 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 61.4 t80 -77.59 145.65 71.78 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 176.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.542 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 50.2 Cg_endo -91.45 14.25 50.44 Favored 'Cis proline' 0 C--N 1.349 0.571 0 C-N-CA 124.305 -1.123 . . . . 0.0 114.072 0.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 86.4 m -62.02 -44.65 96.25 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.02 0.438 . . . . 0.0 110.128 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 39.2 m -102.64 119.39 38.75 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.036 174.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.71 144.48 91.05 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -78.81 172.73 14.6 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 122.9 2.4 . . . . 0.0 112.868 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.611 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 19.5 mt-10 -107.75 122.18 46.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.197 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.418 ' O ' HG12 ' A' ' 115' ' ' ILE . 34.8 mm -75.55 124.38 33.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.508 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.578 ' HB2' ' HG2' ' A' ' 114' ' ' LYS . . . -109.38 129.53 55.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.928 0.394 . . . . 0.0 111.162 179.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.52 HG22 HG22 ' A' ' 82' ' ' ILE . 21.9 t -123.52 86.58 52.39 Favored Pre-proline 0 C--O 1.237 0.401 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.832 178.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.69 -31.36 94.7 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.289 2.659 . . . . 0.0 113.753 -173.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -68.58 -28.8 67.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.842 0.353 . . . . 0.0 110.973 -177.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 82.4 mt -97.42 13.26 30.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.666 0.269 . . . . 0.0 111.175 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.75 106.39 0.4 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.715 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 88.8 -1.15 83.26 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.974 178.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -93.55 -16.0 24.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.887 0.375 . . . . 0.0 110.842 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.521 ' HB ' HD21 ' A' ' 153' ' ' LEU . 3.3 t . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.098 -178.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.471 0 N-CA-C 112.192 -0.363 . . . . 0.0 112.192 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.611 ' HD3' ' HB2' ' A' ' 96' ' ' GLU . 84.5 mttt -86.31 124.4 32.63 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.084 0.469 . . . . 0.0 110.419 177.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.418 HG12 ' O ' ' A' ' 97' ' ' ILE . 37.4 pt -76.73 158.01 5.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.227 -176.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 25.8 p -91.94 124.04 35.75 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.604 178.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 89.0 mt -86.71 161.1 18.61 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.3 173.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.405 ' O ' ' HB3' ' A' ' 121' ' ' PHE . 6.1 t -69.95 153.51 43.15 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.002 0.43 . . . . 0.0 111.268 -173.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -58.13 -49.62 76.32 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.883 -177.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -68.61 -4.07 14.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.69 -176.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.405 ' HB3' ' O ' ' A' ' 118' ' ' THR . 75.5 t80 -66.13 -47.39 74.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.863 -0.153 . . . . 0.0 110.96 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.535 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 39.6 mmtm -59.65 -51.97 77.29 Favored Pre-proline 0 CA--C 1.537 0.449 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.52 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.535 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 50.0 Cg_exo -56.44 -41.4 76.57 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 121.941 1.761 . . . . 0.0 112.193 174.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 45.4 tp -67.14 -38.04 84.83 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.01 0.433 . . . . 0.0 110.673 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.401 ' O ' HG23 ' A' ' 129' ' ' VAL . 66.8 t-105 -59.07 -57.44 13.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.294 178.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.21 -21.7 65.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.562 -178.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 123' ' ' PRO . 48.5 ttt180 -71.54 -29.34 64.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.482 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -98.61 -39.61 8.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.503 -177.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.644 HG13 ' HA ' ' A' ' 130' ' ' PRO . 70.5 t -57.52 142.84 76.35 Favored Pre-proline 0 CA--C 1.533 0.319 0 O-C-N 123.373 0.421 . . . . 0.0 110.261 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.644 ' HA ' HG13 ' A' ' 129' ' ' VAL . 5.0 Cg_exo -79.12 -163.07 3.21 Favored 'Cis proline' 0 C--N 1.355 0.872 0 C-N-CA 125.008 -0.83 . . . . 0.0 113.838 2.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.605 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 96.7 mttt 72.81 -18.53 0.35 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.545 0.738 . . . . 0.0 111.611 -178.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . 0.417 ' H ' ' C ' ' A' ' 130' ' ' PRO . 8.8 t80 -77.01 158.51 30.55 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.131 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -159.63 -179.59 34.54 Favored Glycine 0 C--O 1.236 0.235 0 C-N-CA 119.999 -1.096 . . . . 0.0 112.84 -174.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.427 HD12 HD23 ' A' ' 137' ' ' LEU . 58.8 tp -64.38 -37.48 87.67 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 122.999 0.52 . . . . 0.0 111.195 -175.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.63 -40.68 75.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.523 0.678 . . . . 0.0 110.66 177.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -71.32 -35.37 71.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.968 178.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.427 HD23 HD12 ' A' ' 134' ' ' LEU . 50.2 tp -66.07 -37.12 85.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.167 178.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . 0.468 ' HA ' ' CE ' ' A' ' 138' ' ' MET . 17.9 mmt -62.21 -48.18 81.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.865 0.364 . . . . 0.0 110.441 177.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.89 -49.12 49.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.086 -177.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.4 10.18 37.3 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -172.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -124.23 -67.19 0.2 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.295 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.596 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 53.7 tp -65.79 -42.51 90.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.788 -0.206 . . . . 0.0 111.038 -177.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.43 -61.44 6.99 Favored Glycine 0 CA--C 1.525 0.662 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.627 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . 0.431 ' O ' HG23 ' A' ' 148' ' ' VAL . 17.0 Cg_endo -59.59 -37.38 88.75 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.555 2.17 . . . . 0.0 112.799 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 68.6 t90 -61.44 -44.38 97.21 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.963 0.411 . . . . 0.0 110.248 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 94.2 mt -59.04 -36.19 74.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.007 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.0 -15.64 61.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.85 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 144' ' ' PRO . 61.4 t -93.02 -53.96 7.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.282 -178.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -90.75 -43.53 10.04 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -171.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.479 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.3 mm -59.51 -49.91 89.82 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -169.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.511 ' HD3' ' O ' ' A' ' 146' ' ' LEU . 50.5 Cg_exo -56.06 -30.81 80.27 Favored 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 122.105 1.87 . . . . 0.0 112.879 -178.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -87.26 -37.87 16.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 109.994 177.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.611 HD22 ' HD3' ' A' ' 156' ' ' LYS . 0.2 OUTLIER -59.24 -42.76 91.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.554 -179.865 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 72.0 mt -64.47 -39.63 86.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.018 0.437 . . . . 0.0 110.353 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -66.09 -27.31 67.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.026 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . 0.611 ' HD3' HD22 ' A' ' 153' ' ' LEU . 59.6 mtpt -63.93 -22.25 66.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.788 175.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 72.74 16.45 77.95 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.409 178.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 17.0 m -92.46 -6.18 10.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.072 0.463 . . . . 0.0 111.308 -178.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.469 HD11 HD12 ' A' ' 153' ' ' LEU . 55.6 mt . . . . . 0 C--N 1.322 -0.606 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.125 175.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.469 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.249 0 CA-C-O 120.53 0.205 . . . . 0.0 110.969 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.452 ' O ' HG23 ' A' ' 10' ' ' VAL . 6.0 m -56.5 -54.52 44.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.097 -178.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -64.91 -31.89 73.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.091 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -64.3 -44.36 91.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.606 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 5' ' ' ALA . 66.0 t -62.86 -38.51 82.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.469 179.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 6' ' ' THR . 61.6 t -62.66 -33.1 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.178 179.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -69.92 -25.66 63.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.479 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.428 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 42.6 mt-10 -93.63 -13.07 28.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.882 0.373 . . . . 0.0 111.227 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.7 mt -113.76 87.06 11.63 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.428 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 50.9 Cg_exo -54.58 147.04 50.44 Favored 'Trans proline' 0 C--O 1.237 0.463 0 C-N-CA 123.453 2.768 . . . . 0.0 113.175 -173.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.48 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.7 m -72.34 161.38 4.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.192 176.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.719 HD23 ' HG3' ' A' ' 31' ' ' ARG . 10.2 mp -79.97 134.7 36.27 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.114 0.483 . . . . 0.0 111.532 -173.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.477 ' HB3' ' HG3' ' A' ' 34' ' ' GLU . 59.6 tttm -60.25 -44.08 95.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.852 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.547 HG21 HD12 ' A' ' 27' ' ' LEU . 31.7 m -129.38 130.02 45.49 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.946 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.67 ' HA ' ' HD3' ' A' ' 31' ' ' ARG . 16.8 m120 -120.43 119.63 33.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.752 0.311 . . . . 0.0 110.519 174.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -153.75 170.7 20.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.084 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.45 167.19 42.64 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.291 -178.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -72.56 3.65 4.1 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.397 2.732 . . . . 0.0 113.027 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.613 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 1.1 mmp_? -94.17 -26.24 16.77 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.308 0.575 . . . . 0.0 109.903 174.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -83.43 75.87 9.96 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 172.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -53.98 -41.95 68.45 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -169.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -58.25 -52.1 67.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.212 0.53 . . . . 0.0 110.911 179.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.547 HD12 HG21 ' A' ' 18' ' ' THR . 3.1 mm? -76.7 -23.51 53.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.743 -177.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.559 ' CH2' HG21 ' A' ' 86' ' ' ILE . 28.5 t-105 -64.29 -52.1 60.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.462 175.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.5 t -63.5 -33.71 63.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.084 0.468 . . . . 0.0 110.054 178.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -70.28 -42.81 71.6 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.495 178.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.719 ' HG3' HD23 ' A' ' 16' ' ' LEU . 51.5 ttp85 -64.54 -42.96 95.38 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 176.32 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -54.53 -50.01 68.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.722 -177.74 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.04 -33.13 71.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.532 0.206 . . . . 0.0 111.143 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.477 ' HG3' ' HB3' ' A' ' 17' ' ' LYS . 71.0 mm-40 -70.23 -45.63 66.12 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.286 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.565 ' HB3' HD21 ' A' ' 16' ' ' LEU . 15.3 pt-20 -75.01 -27.46 60.13 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.161 177.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.524 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -55.28 -44.27 75.53 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 169.445 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -63.96 -38.81 92.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.691 176.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.9 t -61.44 -40.23 93.71 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.031 -0.532 . . . . 0.0 109.711 174.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.426 ' O ' HG23 ' A' ' 43' ' ' VAL . 52.7 mt -63.31 -40.51 97.54 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.659 174.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 36' ' ' TYR . 77.4 mt -61.43 -35.56 67.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.868 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' A' ' 44' ' ' GLU . 0.5 OUTLIER -66.75 -36.33 82.19 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.115 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -68.74 -47.74 65.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.928 176.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 39' ' ' LEU . 87.4 t -62.05 -32.6 54.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.328 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.448 ' HB3' ' O ' ' A' ' 41' ' ' ARG . 28.1 tt0 -52.89 -59.21 4.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.361 176.188 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -57.21 -36.77 71.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.289 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -64.02 -43.82 94.42 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.679 176.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.516 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 7.6 mmpt? -68.52 -37.01 79.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.78 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -57.9 -35.3 70.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.98 0.419 . . . . 0.0 110.47 177.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -96.23 -2.29 46.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.091 178.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.9 t70 60.36 20.93 10.49 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.907 0.861 . . . . 0.0 110.442 -177.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -112.87 60.15 0.64 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.59 -177.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -85.9 86.15 7.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 122.045 0.926 . . . . 0.0 109.902 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -83.22 -7.37 59.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.06 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.47 ' HZ ' HD22 ' A' ' 56' ' ' LEU . 60.6 t80 -115.49 122.39 45.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.829 -173.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.68 124.48 38.01 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 176.185 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.47 HD22 ' HZ ' ' A' ' 54' ' ' PHE . 19.3 tp -144.94 124.95 13.53 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.772 -175.176 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -109.09 159.6 16.74 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.031 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 m -132.88 161.74 33.41 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.636 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -93.53 171.74 8.71 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 173.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -62.0 -28.3 69.48 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 -175.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.0 -23.7 48.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.791 0.329 . . . . 0.0 110.607 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.21 7.88 84.96 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.954 -0.641 . . . . 0.0 111.584 -172.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.9 p -83.24 -14.85 52.34 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -174.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -134.11 130.54 37.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.064 0.459 . . . . 0.0 111.029 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 46.0 m95 -118.65 126.29 51.62 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.342 175.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -139.82 140.3 36.57 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.088 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -175.68 -160.35 23.16 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.216 -0.993 . . . . 0.0 112.554 -178.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.537 ' HG2' ' HA ' ' A' ' 81' ' ' ASP . 96.7 mttt -144.19 154.93 43.64 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.956 0.408 . . . . 0.0 110.769 -176.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 62.6 m -112.35 132.13 55.16 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.795 175.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.512 ' CD1' ' HG2' ' A' ' 79' ' ' GLU . 3.2 m-90 -107.58 122.59 46.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.213 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -130.45 120.03 23.57 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.058 0.456 . . . . 0.0 109.823 172.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.445 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.7 mp -98.53 117.29 43.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.639 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.441 ' HB3' ' HE2' ' A' ' 78' ' ' TYR . 39.3 t60 -139.06 117.97 12.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.99 -176.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 60.34 52.21 4.95 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.812 0.695 . . . . 0.0 111.037 176.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.0 mt 70.62 1.96 3.91 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.631 176.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.1 mt -111.08 128.71 55.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.088 0.471 . . . . 0.0 111.512 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -93.24 107.22 19.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.424 174.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.441 ' HE2' ' HB3' ' A' ' 73' ' ' HIS . 77.8 m-85 -89.93 123.37 33.8 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.512 ' HG2' ' CD1' ' A' ' 70' ' ' TRP . 33.1 mt-10 -111.08 134.92 52.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.809 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -132.93 117.72 18.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.537 ' HA ' ' HG2' ' A' ' 68' ' ' LYS . 5.7 p-10 -87.84 136.91 32.75 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.156 0.503 . . . . 0.0 111.031 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.499 HG22 ' HB ' ' A' ' 99' ' ' VAL . 37.0 pt -136.22 149.66 27.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.486 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.48 153.04 37.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.351 0.596 . . . . 0.0 110.938 173.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -161.7 158.2 25.58 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.109 177.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -107.16 173.29 6.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.143 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.559 HG21 ' CH2' ' A' ' 28' ' ' TRP . 50.4 mm -111.81 89.22 10.92 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.922 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 32.3 Cg_endo -63.89 162.61 28.18 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.446 2.097 . . . . 0.0 111.905 177.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.439 HD12 ' N ' ' A' ' 88' ' ' ILE . 3.0 mp -61.97 -23.41 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.271 -177.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.545 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 12.1 p -68.36 -18.74 64.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.873 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.597 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 62.8 t80 -77.02 141.32 67.46 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.597 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 83.7 Cg_endo -95.44 11.39 44.44 Favored 'Cis proline' 0 N--CA 1.458 -0.595 0 C-N-CA 124.454 -1.061 . . . . 0.0 113.749 2.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 33.3 m -60.77 -42.17 96.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.428 0.632 . . . . 0.0 110.18 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.545 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 31.9 m -121.7 125.98 47.88 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.464 175.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.68 144.0 98.75 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.605 -0.271 . . . . 0.0 110.713 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.414 ' HD3' ' CD1' ' A' ' 90' ' ' TYR . 82.6 Cg_endo -82.0 150.18 15.9 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.65 2.234 . . . . 0.0 112.135 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -79.94 100.35 8.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.911 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.541 ' HB ' HD11 ' A' ' 115' ' ' ILE . 56.6 mt -67.38 130.75 32.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.18 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -105.19 137.47 42.91 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.947 0.403 . . . . 0.0 110.711 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.499 ' HB ' HG22 ' A' ' 82' ' ' ILE . 3.8 p -128.8 88.09 52.91 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-O 121.478 0.656 . . . . 0.0 110.431 177.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 99' ' ' VAL . 16.1 Cg_endo -56.29 -30.47 80.69 Favored 'Trans proline' 0 CA--C 1.529 0.255 0 C-N-CA 123.258 2.638 . . . . 0.0 113.496 -174.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -67.79 -40.4 83.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.906 0.384 . . . . 0.0 111.183 -179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.486 HD23 ' HG3' ' A' ' 105' ' ' LYS . 87.7 mt -85.99 5.47 33.16 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -174.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.17 -17.12 62.55 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.081 0.467 . . . . 0.0 110.673 -176.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -128.43 11.54 6.39 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.125 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.486 ' HG3' HD23 ' A' ' 102' ' ' LEU . 75.3 mmtt -95.63 -53.16 3.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.261 0.553 . . . . 0.0 109.627 179.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.539 ' HB ' HD13 ' A' ' 153' ' ' LEU . 13.3 t . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.529 -176.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.587 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 42.1 mttm -131.89 122.76 26.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.823 -0.189 . . . . 0.0 111.197 -172.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.541 HD11 ' HB ' ' A' ' 97' ' ' ILE . 46.2 pt -113.65 143.71 22.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 172.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 49.4 t -119.44 125.86 49.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.777 0.322 . . . . 0.0 110.206 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.565 HD13 ' HA3' ' A' ' 141' ' ' GLY . 47.5 mt -77.65 -80.4 0.11 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.198 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.554 ' OG1' ' HB2' ' A' ' 121' ' ' PHE . 24.0 p -141.85 156.75 45.53 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.67 -43.0 77.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.902 0.382 . . . . 0.0 110.613 -177.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . 0.442 ' C ' ' HD2' ' A' ' 123' ' ' PRO . 5.9 p80 -76.63 -5.54 48.23 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.56 -176.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.554 ' HB2' ' OG1' ' A' ' 118' ' ' THR . 56.4 t80 -71.22 -34.61 70.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.077 0.465 . . . . 0.0 109.868 176.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.639 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 16.6 mtpp -60.56 -52.28 73.86 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.787 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.639 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 31.6 Cg_exo -60.2 -41.25 52.73 Favored 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 121.769 1.646 . . . . 0.0 112.113 172.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 52.1 tp -61.31 -44.0 97.93 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.97 -177.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.463 ' O ' HG23 ' A' ' 129' ' ' VAL . 50.4 t-105 -61.42 -57.16 13.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.319 179.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.01 -29.43 69.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.954 -0.567 . . . . 0.0 112.037 -176.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -66.01 -43.07 88.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.507 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . 0.525 ' HB2' ' CE2' ' A' ' 132' ' ' PHE . 55.5 m-80 -97.41 -0.11 46.82 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -168.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 125' ' ' TRP . 97.7 t -55.67 136.19 71.37 Favored Pre-proline 0 N--CA 1.466 0.346 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 174.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.487 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 70.3 Cg_endo -97.11 -142.25 0.14 OUTLIER 'Cis proline' 0 C--N 1.352 0.712 0 C-N-CA 124.73 -0.946 . . . . 0.0 113.589 4.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.487 ' H ' ' HB2' ' A' ' 130' ' ' PRO . 35.8 mtmm 75.53 1.4 3.61 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.875 0.87 . . . . 0.0 111.119 -176.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . 0.525 ' CE2' ' HB2' ' A' ' 128' ' ' ASN . 11.3 m-85 -79.95 160.39 25.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.675 175.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -166.01 170.41 40.71 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 -178.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 33.4 tp -59.57 -35.23 73.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.952 0.376 . . . . 0.0 111.306 -174.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.05 -41.31 83.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.06 0.457 . . . . 0.0 110.969 177.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -71.75 -37.1 70.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.506 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 63.7 tp -65.53 -46.53 79.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.245 -178.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 24.2 mmt -67.45 -39.61 85.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.295 -178.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.49 -47.53 60.08 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -176.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.8 mt -83.45 -16.44 45.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.314 -175.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.565 ' HA3' HD13 ' A' ' 117' ' ' LEU . . . -112.32 -74.88 0.71 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.316 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 40.6 tp -61.02 -41.96 97.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.77 -62.87 5.77 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 121.074 -0.584 . . . . 0.0 113.423 -177.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -66.2 -27.42 48.74 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.285 1.99 . . . . 0.0 112.285 178.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 59.1 t90 -63.52 -52.56 60.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.284 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 91.2 mt -61.62 -32.8 72.96 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.623 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.13 -15.78 63.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.484 -178.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 92.5 t -106.58 -45.23 7.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.792 0.33 . . . . 0.0 110.727 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 23.1 tp10 -67.53 -52.57 37.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.74 -175.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.479 ' O ' HG13 ' A' ' 154' ' ' ILE . 46.3 mm -55.92 -54.35 53.12 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -172.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 17.4 Cg_endo -58.35 -39.56 83.15 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 121.84 1.694 . . . . 0.0 112.257 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -68.23 -38.3 81.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.272 0.558 . . . . 0.0 110.246 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.601 HD12 ' HD3' ' A' ' 156' ' ' LYS . 31.1 tp -70.14 -36.03 74.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.948 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 150' ' ' ILE . 77.2 mt -64.25 -41.93 93.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.991 0.424 . . . . 0.0 110.33 176.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -67.1 -13.93 62.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.545 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . 0.601 ' HD3' HD12 ' A' ' 153' ' ' LEU . 21.4 mtpp -69.17 -16.93 63.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.687 0.279 . . . . 0.0 110.939 174.098 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 81.0 7.49 88.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.366 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . 0.714 HG23 HG13 ' A' ' 159' ' ' ILE . 27.7 m -88.31 -15.39 9.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.155 0.502 . . . . 0.0 110.437 178.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.714 HG13 HG23 ' A' ' 158' ' ' VAL . 56.8 mt . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.562 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.444 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 120.899 0.381 . . . . 0.0 109.988 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.7 m -59.18 -49.57 77.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.331 -179.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.45 ' HD3' ' N ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -68.9 -23.63 64.21 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.533 -177.875 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' A' ' 8' ' ' ARG . 10.2 ttp180 -71.92 -39.13 69.71 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.835 0.35 . . . . 0.0 110.188 177.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 5' ' ' ALA . 95.0 t -61.56 -45.2 99.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.591 177.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.9 t -67.17 -33.5 63.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.024 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -73.37 -41.76 63.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.39 -175.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -87.78 -0.76 57.37 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -175.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.427 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 57.8 mt -115.06 89.07 18.75 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 173.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.2 Cg_endo -49.99 151.22 8.92 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.951 3.101 . . . . 0.0 113.904 -172.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.7 m -83.39 157.83 3.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.744 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.428 HD12 ' N ' ' A' ' 16' ' ' LEU . 6.2 mp -100.48 147.63 25.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.509 -177.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -83.07 -39.61 20.96 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 175.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.9 m -87.59 121.4 29.97 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.738 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -145.72 120.65 9.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.784 172.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -159.07 -55.17 0.06 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.17 -178.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 121.82 -169.19 14.64 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.721 -0.752 . . . . 0.0 111.94 177.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -72.75 5.13 3.08 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.102 2.535 . . . . 0.0 112.04 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -74.23 -30.97 62.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.184 178.67 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.562 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 1.4 t0 -120.38 104.39 9.98 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 79.1 mtp180 -61.83 -40.92 96.98 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -170.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -66.09 -43.51 87.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.146 0.498 . . . . 0.0 110.244 179.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.562 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 3.8 mm? -74.05 -23.53 59.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.668 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 46.5 t-105 -63.65 -39.05 93.36 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.452 174.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.415 HG12 ' HE3' ' A' ' 33' ' ' LYS . 60.0 t -64.5 -41.99 93.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.008 175.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.2 mm100 -59.17 -44.99 92.17 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.522 175.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.522 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 25.1 tpt180 -60.3 -44.71 95.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.546 178.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 1.4 mm? -58.41 -49.29 77.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.061 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 15.2 ptpt -70.76 -38.07 73.45 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.882 -175.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -66.95 -43.3 83.5 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.363 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.579 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 11.4 tp10 -68.88 -30.54 69.07 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.229 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.428 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.2 t80 -64.31 -43.48 94.54 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -60.14 -43.44 95.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.316 0.579 . . . . 0.0 109.858 174.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.424 ' HB3' ' O ' ' A' ' 35' ' ' GLU . 16.9 t -56.38 -46.57 80.04 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.848 175.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.651 HD23 ' HB2' ' A' ' 135' ' ' ALA . 82.2 mt -61.6 -55.34 31.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.913 178.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 36' ' ' TYR . 89.7 mt -52.22 -43.78 39.91 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.098 -178.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -45.28 91.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.86 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -71.3 -42.43 68.66 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.049 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.507 HG12 ' HE3' ' A' ' 47' ' ' LYS . 88.8 t -61.17 -44.31 98.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.767 0.317 . . . . 0.0 110.385 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.3 -38.6 85.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.626 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -57.65 -40.48 79.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.45 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.525 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 96.1 m-20 -62.24 -44.65 96.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.818 0.342 . . . . 0.0 110.487 177.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.507 ' HE3' HG12 ' A' ' 43' ' ' VAL . 89.4 mttt -64.64 -37.36 87.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.107 0.479 . . . . 0.0 110.647 178.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -70.68 -19.94 62.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.018 178.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -97.23 -1.38 44.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.287 175.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 65.27 30.69 11.1 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.994 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 8.2 t30 -131.52 93.52 3.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.925 0.393 . . . . 0.0 111.016 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -99.35 110.33 22.84 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 176.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 51.8 p-90 -124.24 -0.12 8.32 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -172.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.439 ' HA ' ' HA ' ' A' ' 69' ' ' CYS . 11.0 p90 -161.14 141.49 11.05 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.382 177.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -135.12 129.81 34.48 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 174.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.4 tp -147.23 126.52 13.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.931 -168.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -111.74 163.51 14.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.798 0.332 . . . . 0.0 110.28 176.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.458 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 10.9 p -125.41 157.34 37.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.109 -178.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -68.92 167.94 14.68 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.75 171.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -70.24 -19.15 63.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.393 0.616 . . . . 0.0 109.37 173.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -72.46 -32.94 66.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.16 173.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.8 8.85 84.91 Favored Glycine 0 C--N 1.333 0.411 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.079 -174.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.0 p -89.56 -30.21 18.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.028 0.442 . . . . 0.0 111.308 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 64' ' ' ARG . 65.9 mtt180 -114.77 133.8 55.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.58 179.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.458 ' CD2' ' HB3' ' A' ' 58' ' ' SER . 49.9 m95 -124.12 126.65 46.55 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.004 175.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -136.04 148.23 48.27 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.036 -174.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.89 -144.18 8.36 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.183 -0.767 . . . . 0.0 111.183 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.3 ptpp? -159.77 150.69 19.33 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 117.037 0.419 . . . . 0.0 110.959 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 54' ' ' PHE . 25.0 p -116.06 147.67 41.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.379 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.566 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 29.5 m-90 -115.15 129.16 56.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.351 179.202 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -118.53 124.21 46.98 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.3 mm -86.0 120.2 35.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.155 178.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -124.28 108.42 12.21 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.732 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.3 t0 64.44 -85.02 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.197 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 75' ' ' LEU . 2.3 mm? -132.64 6.61 4.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.751 0.31 . . . . 0.0 111.218 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.8 mp -112.38 147.25 36.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.17 0.51 . . . . 0.0 111.21 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -116.54 98.19 6.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.578 -177.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.527 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 74.8 m-85 -93.14 133.22 36.55 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.301 -175.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.566 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 0.8 OUTLIER -110.28 136.54 49.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.409 0.623 . . . . 0.0 110.861 175.567 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.485 ' O ' HG23 ' A' ' 82' ' ' ILE . 91.4 m-85 -122.12 117.02 25.27 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.347 175.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.85 117.65 9.25 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.485 HG23 ' O ' ' A' ' 80' ' ' PHE . 36.8 pt -118.51 161.64 17.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.475 0.655 . . . . 0.0 111.855 -171.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -165.42 161.83 19.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.007 175.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.597 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 55.6 p90 -162.64 167.16 23.62 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 123.182 0.301 . . . . 0.0 110.339 173.057 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -119.02 158.42 25.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.404 -178.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.1 mm -106.93 90.4 5.27 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.828 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -60.14 160.95 20.86 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.579 2.186 . . . . 0.0 112.087 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 27.2 mt -73.84 -5.2 6.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.475 0.655 . . . . 0.0 110.727 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.83 8.4 17.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.291 176.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 91' ' ' PRO . 76.3 t80 -77.64 142.0 65.58 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 174.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.404 ' HA ' ' HA ' ' A' ' 90' ' ' TYR . 98.1 Cg_endo -97.31 16.72 32.57 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.229 -1.155 . . . . 0.0 113.043 -1.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.2 m -59.56 -37.81 79.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.463 0.649 . . . . 0.0 110.453 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.9 m -122.66 142.26 50.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.606 176.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.81 144.8 96.32 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.823 178.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.0 144.7 99.44 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.87 2.38 . . . . 0.0 112.364 177.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.23 104.54 14.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.517 -176.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.597 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 58.8 mt -72.7 131.4 34.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.424 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.461 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -92.62 -74.81 0.51 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.103 -173.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.455 HG22 HG22 ' A' ' 82' ' ' ILE . 17.7 t 61.49 82.38 0.22 Allowed Pre-proline 0 N--CA 1.466 0.369 0 CA-C-O 121.249 0.547 . . . . 0.0 110.233 -174.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.71 -14.51 42.03 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 123.263 2.642 . . . . 0.0 113.74 -170.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -79.36 -31.41 42.94 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.718 0.294 . . . . 0.0 111.12 -177.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.7 mt -83.5 -7.67 59.49 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.726 -174.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -61.81 124.0 19.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.735 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 89.97 -8.3 80.08 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.552 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -101.08 -55.28 2.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.91 0.386 . . . . 0.0 110.259 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.1 t . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.84 -178.307 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . 0.461 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . . . . . . 0 N--CA 1.445 -0.749 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -147.1 116.73 7.09 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 177.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 39.7 pt -75.92 153.86 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.002 0.43 . . . . 0.0 111.202 -177.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 27.4 t -105.1 123.76 48.37 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.044 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.9 mt -71.58 161.86 30.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.261 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.3 p -67.88 159.74 29.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.025 0.441 . . . . 0.0 111.568 -176.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -61.51 -24.94 66.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.335 -0.848 . . . . 0.0 112.125 -173.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -93.39 -37.29 12.06 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.989 -0.285 . . . . 0.0 111.18 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -71.94 -35.84 69.73 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 -173.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.423 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 63.2 tttm -57.97 -52.28 75.62 Favored Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -177.064 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.423 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 56.6 Cg_endo -72.23 -25.44 18.81 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 121.826 1.684 . . . . 0.0 112.396 175.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 53.1 tp -62.44 -38.18 88.77 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.686 178.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.467 ' O ' HG23 ' A' ' 129' ' ' VAL . 57.1 t-105 -54.53 -55.44 29.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.941 0.401 . . . . 0.0 110.557 177.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -71.52 -14.19 62.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.163 -177.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.436 ' HD3' ' O ' ' A' ' 127' ' ' ARG . 3.3 tmt_? -80.54 -28.24 37.37 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -88.14 -39.14 14.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.572 -177.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.482 HG13 ' HA ' ' A' ' 130' ' ' PRO . 95.6 t -49.67 135.53 19.12 Favored Pre-proline 0 N--CA 1.472 0.653 0 O-C-N 123.512 0.508 . . . . 0.0 111.198 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.482 ' HA ' HG13 ' A' ' 129' ' ' VAL . 59.7 Cg_endo -86.51 -146.61 0.32 Allowed 'Cis proline' 0 C--N 1.353 0.77 0 C-N-CA 124.425 -1.073 . . . . 0.0 113.48 5.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 42.9 mmtm 72.89 -37.61 0.39 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.32 0.648 . . . . 0.0 112.035 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.97 158.05 26.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.007 0.432 . . . . 0.0 111.215 -178.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.522 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -141.66 175.16 22.65 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.753 -175.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.42 ' H ' ' CD ' ' A' ' 35' ' ' GLU . 53.0 tp -72.29 -39.7 68.1 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.724 0.409 . . . . 0.0 111.33 -174.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.651 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -60.72 -30.82 70.21 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.481 0.657 . . . . 0.0 110.444 177.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -67.68 -32.98 74.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.055 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.422 ' HB2' ' CZ3' ' A' ' 125' ' ' TRP . 59.4 tp -68.6 -36.72 79.07 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.914 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 59.5 mtt -65.73 -42.01 91.52 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.309 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -77.82 -50.32 12.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.227 -177.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.7 mt -93.62 -6.14 47.16 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -171.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -117.02 -67.56 0.38 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.263 -0.97 . . . . 0.0 112.753 -177.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.421 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 58.8 tp -60.33 -48.93 79.63 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 122.154 0.182 . . . . 0.0 111.482 -175.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.74 -61.64 6.87 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 121.256 -0.497 . . . . 0.0 113.143 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . 0.422 ' O ' HG23 ' A' ' 148' ' ' VAL . 50.8 Cg_exo -56.08 -37.71 95.92 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.629 2.219 . . . . 0.0 112.797 177.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 64.8 t90 -61.99 -46.69 88.11 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.914 0.388 . . . . 0.0 110.569 -179.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 97.2 mt -61.7 -37.69 85.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.187 0.518 . . . . 0.0 110.647 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.13 -9.72 56.5 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.798 -178.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 144' ' ' PRO . 85.0 t -70.53 -55.98 12.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.648 -179.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -141.81 11.16 2.03 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -175.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.494 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 29.7 mm -69.3 -50.75 19.12 Favored Pre-proline 0 CA--C 1.535 0.404 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.502 174.018 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 15.0 Cg_endo -59.12 -31.23 95.09 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.763 1.642 . . . . 0.0 111.189 171.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 30.0 t70 -66.39 -45.0 81.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.402 178.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.598 ' HA ' ' HD3' ' A' ' 156' ' ' LYS . 41.0 tp -56.01 -38.81 71.0 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.518 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 62.7 mt -68.19 -44.41 84.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.669 177.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -69.98 -23.07 63.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.356 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . 0.598 ' HD3' ' HA ' ' A' ' 153' ' ' LEU . 28.8 mtpp -65.67 -18.19 65.14 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.849 176.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 85.8 26.1 36.08 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.67 -177.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 54.6 t -86.52 -43.85 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.976 0.417 . . . . 0.0 110.14 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 60.6 mt . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.48 -179.841 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.409 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.85 0.357 . . . . 0.0 110.814 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.494 ' O ' HG23 ' A' ' 10' ' ' VAL . 28.1 m -60.54 -53.84 52.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.433 -179.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.419 ' HD3' ' N ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -64.65 -28.9 69.92 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.807 0.337 . . . . 0.0 111.325 -176.063 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.419 ' N ' ' HD3' ' A' ' 7' ' ' ARG . 54.3 mtp180 -70.5 -36.56 73.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.679 0.276 . . . . 0.0 110.912 178.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 5' ' ' ALA . 99.5 t -72.88 -44.08 58.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.389 176.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 6' ' ' THR . 44.4 t -68.0 -14.36 18.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.196 0.522 . . . . 0.0 110.711 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.2 t -69.09 -34.33 74.94 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.127 174.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -96.65 -21.29 17.71 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.985 0.421 . . . . 0.0 110.369 178.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.3 mt -117.42 81.81 14.4 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 174.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -76.81 174.25 13.16 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 123.142 2.561 . . . . 0.0 113.852 -168.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.1 m -79.66 152.3 4.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.308 176.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.45 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 9.4 mp -86.9 134.66 33.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.771 -177.189 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.528 ' HD2' ' N ' ' A' ' 17' ' ' LYS . 12.2 mptt -87.2 -31.61 20.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.049 0.452 . . . . 0.0 110.238 -178.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.453 ' O ' ' HG3' ' A' ' 31' ' ' ARG . 11.6 m -93.64 105.76 17.78 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.603 176.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -125.24 133.36 52.73 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.803 0.335 . . . . 0.0 111.27 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -165.63 167.62 17.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.088 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.76 170.67 23.18 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.685 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -61.85 -10.62 17.86 Favored 'Trans proline' 0 N--CA 1.476 0.465 0 C-N-CA 123.232 2.621 . . . . 0.0 112.999 -177.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.856 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 0.4 OUTLIER -69.24 -27.02 65.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.953 177.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -112.91 97.52 6.59 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 29' ' ' VAL . 37.3 mtt180 -66.8 -29.68 69.69 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -176.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -62.68 -53.36 55.58 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.086 0.47 . . . . 0.0 110.195 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 27' ' ' LEU . 4.3 mm? -75.62 -26.74 58.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.829 178.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.473 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 74.7 t-105 -64.42 -46.5 82.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.768 177.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 25' ' ' ARG . 68.1 t -60.03 -40.9 84.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 120.743 0.306 . . . . 0.0 110.455 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -67.42 -42.69 82.81 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.67 177.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 18' ' ' THR . 38.6 ttt-85 -65.18 -34.45 78.4 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.532 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -63.56 -43.92 95.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.567 -178.237 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.5 ' HB3' ' NZ ' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -74.32 -26.92 60.46 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.933 179.778 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -71.57 -35.91 70.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.141 0.496 . . . . 0.0 109.858 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.427 ' CD ' ' H ' ' A' ' 134' ' ' LEU . 10.1 tp10 -64.42 -40.73 96.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.395 174.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.41 ' HD2' ' HA ' ' A' ' 33' ' ' LYS . 5.3 m-85 -55.03 -40.39 70.16 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.913 175.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 71.8 mm-40 -58.71 -49.26 78.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.208 0.528 . . . . 0.0 110.261 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.6 t -62.16 -39.56 93.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.656 179.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.536 HD23 ' HB2' ' A' ' 135' ' ' ALA . 94.4 mt -65.09 -54.94 22.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.155 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 83.6 mt -54.13 -45.32 65.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.061 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -43.99 97.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.035 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -65.12 -43.69 91.16 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.745 0.307 . . . . 0.0 110.906 -179.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 39' ' ' LEU . 55.3 t -73.39 -43.0 56.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.475 -176.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.63 -29.01 64.18 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -178.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -65.63 -31.38 72.38 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 174.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.585 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 13.1 m-80 -71.49 -39.34 70.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.319 175.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.401 ' NZ ' HG12 ' A' ' 43' ' ' VAL . 59.0 mttp -62.6 -33.28 74.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.049 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -66.82 -14.8 63.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 111.07 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -106.04 5.03 29.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.326 175.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.8 t70 63.33 27.7 15.44 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.99 0.9 . . . . 0.0 109.985 -176.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.585 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 11.9 t30 -122.07 72.06 1.02 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.692 -175.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -92.56 88.99 6.54 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 9.6 p-90 -99.89 -8.15 24.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.498 -0.773 . . . . 0.0 112.363 -170.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -161.43 144.88 12.68 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.707 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 55' ' ' ARG . 37.2 mtm180 -143.16 124.31 14.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.066 171.511 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.494 HD21 ' HB3' ' A' ' 65' ' ' TRP . 5.1 tt -131.05 127.81 39.0 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.439 -169.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -121.41 177.06 5.35 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.121 -175.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.448 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 78.6 p -146.26 174.72 11.09 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.518 ' OD1' ' HB2' ' A' ' 61' ' ' GLU . 4.8 p30 -73.12 166.57 22.86 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 167.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.681 ' HA ' ' HE3' ' A' ' 60' ' ' LYS . 0.3 OUTLIER -76.12 -5.57 47.25 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.026 0.441 . . . . 0.0 111.264 -175.31 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.518 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 6.7 mm-40 -78.89 -32.68 45.93 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 171.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.34 13.39 83.63 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.662 177.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -92.26 -5.53 52.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.861 0.363 . . . . 0.0 111.791 -177.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.473 ' HB3' HD21 ' A' ' 59' ' ' ASN . 15.3 ttm180 -151.2 128.01 10.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.016 177.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.494 ' HB3' HD21 ' A' ' 56' ' ' LEU . 46.6 m95 -115.37 149.57 37.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.368 -176.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -156.11 140.65 16.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.473 -178.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.488 ' HA3' ' HA ' ' A' ' 56' ' ' LEU . . . -175.41 -174.91 42.4 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 119.897 -1.144 . . . . 0.0 112.637 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.7 mttp -117.8 145.25 44.66 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.9 0.381 . . . . 0.0 110.735 -178.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 48.5 t -130.75 127.5 38.89 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.528 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . 0.565 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 7.8 p90 -130.28 132.77 46.07 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.66 -178.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -118.29 143.71 46.38 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 42.8 mm -105.24 116.15 48.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 120.842 0.353 . . . . 0.0 110.829 -175.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -127.47 106.6 9.3 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 5.1 m-20 52.22 58.49 5.37 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.918 0.761 . . . . 0.0 111.247 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.2 mm? 73.34 -22.46 0.23 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.44 176.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.22 118.07 14.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.713 0.292 . . . . 0.0 110.404 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -105.96 135.7 46.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.204 178.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.418 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 7.4 p90 -143.74 114.73 7.81 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.688 179.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.565 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 0.6 OUTLIER -106.09 136.43 45.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.559 177.914 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -117.04 139.19 51.0 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.469 178.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -93.15 115.62 28.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.175 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 pt -127.13 152.34 35.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.483 -178.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.11 161.71 42.22 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.992 0.425 . . . . 0.0 110.303 176.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.575 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 48.0 p90 -160.09 152.06 20.34 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.44 -179.47 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.524 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 7.2 p-10 -100.8 167.91 9.99 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.978 0.418 . . . . 0.0 110.14 178.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.1 mm -109.2 89.5 6.99 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.399 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.524 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 37.1 Cg_exo -56.55 164.11 6.05 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 123.095 2.53 . . . . 0.0 112.529 -178.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 35.0 mt -74.36 -10.96 14.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.365 0.603 . . . . 0.0 110.226 -178.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.1 p -80.91 -6.82 59.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.948 176.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.515 ' CG ' ' HA ' ' A' ' 91' ' ' PRO . 51.2 t80 -75.86 144.15 75.78 Favored Pre-proline 0 C--N 1.328 -0.352 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.515 ' HA ' ' CG ' ' A' ' 90' ' ' TYR . 24.2 Cg_endo -94.04 11.82 49.31 Favored 'Cis proline' 0 N--CA 1.458 -0.614 0 C-N-CA 124.244 -1.148 . . . . 0.0 113.937 2.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 19.1 m -65.04 -36.11 83.32 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.175 0.512 . . . . 0.0 110.355 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 49.9 m -113.43 140.56 47.97 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.739 175.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.52 146.24 95.99 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.752 179.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.53 153.91 76.27 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.646 2.231 . . . . 0.0 112.5 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -81.66 90.74 6.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.956 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.575 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 65.3 mt -74.9 119.84 23.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.263 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -107.06 130.75 54.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.787 0.327 . . . . 0.0 111.505 -176.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 19.7 t -130.55 77.27 76.16 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 173.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -66.25 -21.79 54.34 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 123.073 2.515 . . . . 0.0 112.538 -176.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -57.88 -33.33 68.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.894 0.378 . . . . 0.0 111.272 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 87.5 mt -86.72 1.97 50.23 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -173.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.18 -16.14 63.87 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.39 0.614 . . . . 0.0 110.772 -176.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -131.21 26.3 3.96 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.631 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -117.88 -59.33 1.92 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.123 0.487 . . . . 0.0 109.876 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.438 179.69 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.396 0 CA-C-O 120.77 0.095 . . . . 0.0 113.126 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -86.99 149.49 24.73 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 42.9 pt -73.05 146.23 10.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.489 . . . . 0.0 111.362 -175.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 33.8 m -100.02 128.4 46.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.53 -179.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 91.9 mt -120.61 159.8 24.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.535 -178.095 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.0 t -65.0 150.13 48.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.632 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.16 -21.39 59.31 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.25 176.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -66.54 -30.26 70.53 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.945 0.402 . . . . 0.0 110.802 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -68.96 -34.7 75.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.331 -175.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.523 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 50.1 mtpt -58.66 -58.65 17.64 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.752 -174.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.523 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 43.2 Cg_endo -69.06 -31.09 24.39 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.796 1.664 . . . . 0.0 112.075 176.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 55.6 tp -60.42 -49.38 77.79 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.479 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.539 ' O ' HG23 ' A' ' 129' ' ' VAL . 51.2 t-105 -60.03 -56.38 22.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.687 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.05 -24.73 68.05 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -174.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -78.77 -26.11 44.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.961 0.41 . . . . 0.0 110.759 -179.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -96.07 5.4 51.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.042 -177.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 125' ' ' TRP . 86.3 t -96.15 138.11 21.64 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 174.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.473 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 63.0 Cg_endo -90.8 -160.92 1.28 Allowed 'Cis proline' 0 C--N 1.347 0.463 0 C-N-CA 124.302 -1.124 . . . . 0.0 113.49 4.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 53.8 mttp 75.09 5.14 4.27 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.999 0.812 . . . . 0.0 111.861 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -90.82 134.66 34.27 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -108.21 155.42 16.2 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.402 -177.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.427 ' H ' ' CD ' ' A' ' 35' ' ' GLU . 52.7 tp -64.34 -37.85 88.97 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 122.824 0.45 . . . . 0.0 111.39 -174.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.536 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -54.66 -30.32 55.04 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.393 0.616 . . . . 0.0 111.337 179.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -67.66 -31.26 71.12 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.385 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 58.7 tp -65.15 -35.38 80.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.715 178.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -65.61 -44.8 85.46 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.97 0.414 . . . . 0.0 110.522 176.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -73.61 -41.12 63.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.254 -176.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.0 mt -98.1 -6.94 30.6 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -173.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -129.29 -63.69 0.11 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.174 -1.012 . . . . 0.0 113.203 -177.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.6 tp -57.82 -50.97 71.51 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -175.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.55 -62.0 6.79 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.16 -0.543 . . . . 0.0 113.598 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . 0.405 ' O ' HG23 ' A' ' 148' ' ' VAL . 12.3 Cg_endo -58.47 -31.69 94.77 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.498 2.132 . . . . 0.0 113.107 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 51.1 t90 -65.9 -50.08 65.75 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.044 0.45 . . . . 0.0 110.033 179.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.11 -37.92 89.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.668 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.25 -14.25 60.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.185 -176.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 144' ' ' PRO . 96.1 t -105.45 -50.54 8.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.8 0.333 . . . . 0.0 111.689 -179.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -81.68 -32.76 31.62 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -171.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.498 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 38.7 mm -67.2 -54.32 20.23 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -175.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.4 Cg_endo -52.45 -41.02 70.04 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 122.446 2.097 . . . . 0.0 112.8 -178.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 156' ' ' LYS . 32.2 t70 -67.89 -37.16 81.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.577 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.476 ' HG ' HG13 ' A' ' 159' ' ' ILE . 30.9 tp -69.62 -31.41 69.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.696 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 150' ' ' ILE . 72.2 mt -67.19 -53.82 29.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.41 176.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -70.42 -15.98 62.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.4 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 152' ' ' ASP . 20.3 ttmm -68.64 -18.18 64.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.921 175.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 87.83 21.32 47.25 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.281 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 51.7 t -99.96 -44.95 11.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.731 0.301 . . . . 0.0 111.115 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . 0.476 HG13 ' HG ' ' A' ' 153' ' ' LEU . 52.2 mt . . . . . 0 C--N 1.326 -0.43 0 CA-C-O 121.378 0.608 . . . . 0.0 110.458 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.466 ' O ' HG23 ' A' ' 9' ' ' VAL . . . . . . . . 0 N--CA 1.454 -0.261 0 CA-C-O 120.875 0.369 . . . . 0.0 110.495 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.471 ' O ' HG23 ' A' ' 10' ' ' VAL . 88.8 m -58.77 -48.39 81.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.384 179.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.0 ppt_? -70.08 -20.22 63.22 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.104 -178.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -71.23 -46.09 61.84 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 171.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 5' ' ' ALA . 83.7 t -57.21 -45.05 84.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.419 176.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 6' ' ' THR . 85.6 t -57.73 -43.18 83.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.643 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.4 p -70.29 -20.64 63.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.795 0.331 . . . . 0.0 111.542 -178.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -97.55 0.72 47.94 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.118 0.485 . . . . 0.0 110.584 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 9' ' ' VAL . 60.3 mt -113.74 88.57 14.12 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 115.409 -0.814 . . . . 0.0 108.82 173.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.437 ' HD2' ' HA ' ' A' ' 38' ' ' SER . 78.0 Cg_exo -47.16 141.96 12.37 Favored 'Trans proline' 0 C--O 1.237 0.431 0 C-N-CA 123.605 2.87 . . . . 0.0 113.798 -171.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.7 m -82.61 165.71 2.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.735 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.847 HD21 ' HB3' ' A' ' 35' ' ' GLU . 7.6 mp -101.76 134.89 44.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.97 -176.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -87.81 -34.01 18.42 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.584 0.707 . . . . 0.0 109.64 174.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.547 HG21 ' HB3' ' A' ' 30' ' ' GLN . 19.7 m -110.82 118.78 37.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.233 -177.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.437 ' HA ' ' CG ' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -152.89 136.81 16.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.27 0.557 . . . . 0.0 111.674 176.382 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -157.13 173.15 17.43 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.154 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.0 161.31 52.06 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.211 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.15 3.32 1.68 Allowed 'Trans proline' 0 N--CA 1.473 0.273 0 C-N-CA 123.074 2.516 . . . . 0.0 112.554 -178.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -72.61 -23.83 60.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.864 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -112.24 108.91 18.3 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.514 ' O ' HG23 ' A' ' 29' ' ' VAL . 64.0 mtt180 -69.66 -36.24 75.87 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -173.412 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -71.96 -46.09 58.68 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.091 -175.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 27' ' ' LEU . 4.5 mm? -69.42 -25.88 64.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 177.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 64.0 t-105 -69.3 -45.3 69.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.385 176.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 25' ' ' ARG . 73.1 t -60.75 -42.47 92.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 110.718 177.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.547 ' HB3' HG21 ' A' ' 18' ' ' THR . 9.8 tt0 -70.12 -31.82 69.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.135 0.493 . . . . 0.0 110.032 178.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.598 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 2.9 tmt_? -61.44 -40.07 93.13 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 174.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 6.5 mp -62.43 -41.74 98.93 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.894 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 7.7 ptmm? -66.31 -33.3 75.41 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.597 -178.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 21.6 mm-40 -64.6 -51.83 60.65 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.166 0.508 . . . . 0.0 110.385 177.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.847 ' HB3' HD21 ' A' ' 16' ' ' LEU . 17.2 pt-20 -75.34 -29.19 59.89 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.503 -176.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.436 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -60.36 -43.58 96.39 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 176.481 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -62.04 -38.13 87.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.403 175.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.437 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 8.8 t -62.71 -46.76 86.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.202 176.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.476 HD22 ' HZ ' ' A' ' 54' ' ' PHE . 66.2 mt -60.12 -55.61 31.71 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.083 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 77.9 mt -59.19 -39.21 78.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.15 -176.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.0 tpp180 -63.12 -45.53 91.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.479 -178.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -67.22 -44.55 79.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.956 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 39' ' ' LEU . 93.5 t -61.89 -42.45 94.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.254 178.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -57.67 -49.31 76.92 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.57 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -54.11 -45.36 71.85 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.322 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -77.33 -28.47 53.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.879 0.371 . . . . 0.0 110.67 -177.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -61.66 -26.58 68.1 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.657 174.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -65.8 -17.62 64.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.932 177.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -99.95 11.0 40.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.211 176.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.4 t70 68.83 15.54 8.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.115 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -120.24 99.75 6.77 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.408 179.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -76.49 124.6 27.82 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 175.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.522 ' HE3' ' HB3' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -63.56 -58.66 6.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.269 -171.433 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.522 ' HB3' ' HE3' ' A' ' 53' ' ' TRP . 35.7 p90 -154.57 161.21 41.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.019 0.438 . . . . 0.0 110.914 -174.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.0 mtt180 -134.0 121.78 22.09 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.62 HD21 ' HB3' ' A' ' 65' ' ' TRP . 5.7 tt -157.3 137.73 12.92 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -167.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.427 ' N ' HD23 ' A' ' 56' ' ' LEU . 17.6 mm-40 -126.16 168.99 13.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.853 0.359 . . . . 0.0 110.391 -175.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.0 t -143.67 172.46 12.79 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.197 -178.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -68.04 173.71 4.38 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.468 174.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -72.91 -27.01 61.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.114 0.483 . . . . 0.0 109.732 177.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -79.64 -14.02 59.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.396 172.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.74 32.59 84.69 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.739 -179.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.4 p -89.28 -29.15 19.4 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -176.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 -130.46 123.49 29.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.62 ' HB3' HD21 ' A' ' 56' ' ' LEU . 47.3 m95 -109.61 132.91 53.7 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.129 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -143.39 139.12 29.84 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.445 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.431 ' HA3' ' HA ' ' A' ' 56' ' ' LEU . . . 172.17 -166.98 39.89 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.118 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.483 ' HZ1' ' HB2' ' A' ' 81' ' ' ASP . 23.0 mtpp -133.65 156.28 48.17 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -178.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.663 ' SG ' ' HB2' ' A' ' 80' ' ' PHE . 5.1 p -118.65 149.64 41.06 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.214 175.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 11.8 m-90 -120.97 138.59 54.07 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -176.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -146.23 120.09 9.31 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.008 0.432 . . . . 0.0 110.332 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.415 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.6 mp -95.62 127.84 47.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 175.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -130.07 108.35 10.01 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -179.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 64.53 -85.95 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.639 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -123.57 -11.63 7.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.192 -176.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.8 mt -103.27 145.84 29.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.17 0.51 . . . . 0.0 111.64 -174.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.421 ' HE3' ' HB3' ' A' ' 77' ' ' LYS . 1.1 tmmt? -128.52 120.99 27.82 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -132.42 153.12 51.14 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.958 0.409 . . . . 0.0 111.152 -176.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -116.79 139.21 50.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.698 -176.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.663 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . 46.7 m-85 -121.51 117.37 26.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.855 0.36 . . . . 0.0 110.477 175.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.486 ' H ' ' CB ' ' A' ' 101' ' ' GLU . 9.6 t70 -83.18 130.86 35.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.082 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.507 HG22 HG22 ' A' ' 99' ' ' VAL . 23.2 pt -133.92 147.47 30.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.946 -177.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -154.75 151.84 29.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.61 176.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.436 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 50.3 p90 -167.93 170.31 10.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.186 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -114.15 166.4 11.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.415 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 46.2 mm -107.12 90.23 5.31 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.696 178.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.33 164.47 17.54 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.86 2.374 . . . . 0.0 112.697 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.1 mm -63.74 -27.35 42.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.892 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . 0.46 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 3.7 p -75.69 -14.02 60.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.998 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.488 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 73.3 t80 -78.11 143.58 65.78 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.488 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.4 Cg_endo -95.63 9.73 45.03 Favored 'Cis proline' 0 C--N 1.35 0.641 0 C-N-CA 124.488 -1.047 . . . . 0.0 113.509 1.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.411 ' HA ' HG11 ' A' ' 129' ' ' VAL . 21.5 m -61.03 -31.02 70.66 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.392 0.615 . . . . 0.0 110.201 178.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.46 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 22.9 m -126.33 144.3 50.86 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.195 173.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.83 143.95 82.09 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 120.54 0.21 . . . . 0.0 111.2 -178.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -86.73 171.88 6.91 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.993 2.462 . . . . 0.0 112.421 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . 0.806 ' HB3' ' HD3' ' A' ' 114' ' ' LYS . 40.6 mt-10 -101.5 113.53 26.73 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.625 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.436 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 57.7 mt -92.79 141.42 14.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.726 -177.451 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -118.27 140.31 50.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.733 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.507 HG22 HG22 ' A' ' 82' ' ' ILE . 27.6 t -119.57 86.43 34.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.851 0.357 . . . . 0.0 110.288 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.65 -18.51 48.26 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 123.184 2.589 . . . . 0.0 113.138 -175.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.486 ' CB ' ' H ' ' A' ' 81' ' ' ASP . 4.7 tp10 -74.83 -19.0 60.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.036 0.446 . . . . 0.0 110.9 -177.064 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.8 mt -97.66 14.47 26.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.239 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -58.89 131.52 51.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.178 -176.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 61.5 23.73 63.03 Favored Glycine 0 C--N 1.334 0.435 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.51 176.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -133.85 -38.0 0.9 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.984 0.421 . . . . 0.0 110.436 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.7 t . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.837 176.871 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.239 0 N-CA-C 112.366 -0.294 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.806 ' HD3' ' HB3' ' A' ' 96' ' ' GLU . 53.8 mttp -93.56 156.5 16.7 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.486 HD12 HD21 ' A' ' 117' ' ' LEU . 30.3 pt -74.25 139.11 19.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.041 0.448 . . . . 0.0 111.401 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 18.6 t -94.11 109.06 20.86 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.486 HD21 HD12 ' A' ' 115' ' ' ILE . 96.0 mt -91.19 175.62 6.87 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.23 -177.252 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.565 HG23 ' HB2' ' A' ' 121' ' ' PHE . 4.7 t -71.98 146.2 47.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.904 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . 0.463 ' HA ' ' HE3' ' A' ' 122' ' ' LYS . 13.4 t70 -65.49 -30.26 71.01 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.621 -176.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -80.03 -15.57 56.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.753 -172.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.565 ' HB2' HG23 ' A' ' 118' ' ' THR . 49.1 t80 -70.93 -34.15 71.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.006 -176.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.53 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 42.3 mttt -57.81 -58.67 16.87 Favored Pre-proline 0 CA--C 1.539 0.522 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.085 -176.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.53 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 29.0 Cg_endo -64.37 -34.87 53.04 Favored 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 121.83 1.687 . . . . 0.0 111.976 178.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 42.3 tp -61.62 -45.24 94.92 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.837 0.351 . . . . 0.0 110.349 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.47 ' O ' HG23 ' A' ' 129' ' ' VAL . 57.2 t-105 -59.23 -57.26 13.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.587 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.03 -32.17 71.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.884 -175.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -70.36 -36.56 74.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.903 0.382 . . . . 0.0 111.169 -178.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -89.36 -31.16 17.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.061 -173.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.562 HG13 ' HA ' ' A' ' 130' ' ' PRO . 51.2 t -53.64 138.95 51.05 Favored Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 176.128 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.562 ' HA ' HG13 ' A' ' 129' ' ' VAL . 6.9 Cg_endo -88.59 -151.64 0.52 Allowed 'Cis proline' 0 C--N 1.349 0.591 0 C-N-CA 124.727 -0.947 . . . . 0.0 114.453 6.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 9.4 mtmp? 75.24 36.66 0.5 Allowed 'General case' 0 C--N 1.343 0.309 0 C-N-CA 123.759 0.823 . . . . 0.0 110.427 -172.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -128.01 152.9 47.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.828 -179.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.598 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -146.1 175.17 25.72 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 47.6 tp -58.45 -38.25 77.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 117.355 0.578 . . . . 0.0 111.497 -176.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.12 -43.85 70.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.732 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 29.5 m80 -70.33 -36.61 74.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.682 0.277 . . . . 0.0 110.73 -178.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.75 -50.57 62.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.283 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 21.8 ptm -71.69 -31.67 67.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.55 -175.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -73.22 -45.35 56.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.682 0.277 . . . . 0.0 111.418 -179.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.2 mt -85.72 -15.98 40.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.569 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -98.79 -69.44 0.93 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.433 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' LEU . . . . . 0.589 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 94.9 mt -65.97 -38.69 89.19 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -176.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.32 -62.28 6.15 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 121.086 -0.578 . . . . 0.0 113.352 -177.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -64.4 -31.17 62.38 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.55 2.167 . . . . 0.0 112.414 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 38.3 t90 -62.57 -39.51 93.9 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.009 0.433 . . . . 0.0 110.621 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.624 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 98.7 mt -60.1 -34.52 73.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.876 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.02 -4.89 41.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.759 -176.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 61.4 t -85.47 -56.12 5.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.702 -0.226 . . . . 0.0 111.511 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -107.07 -29.49 9.36 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -172.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . 0.624 ' HB ' ' O ' ' A' ' 146' ' ' LEU . 1.7 mp -57.91 -48.7 96.67 Favored Pre-proline 0 CA--C 1.541 0.622 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -175.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' PRO . . . . . 0.448 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 54.3 Cg_exo -54.59 -37.87 90.65 Favored 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 121.79 1.66 . . . . 0.0 112.346 175.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.31 -44.4 87.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.401 179.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.84 -36.9 80.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.887 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 150' ' ' ILE . 64.9 mt -66.48 -41.18 88.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.816 178.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 151' ' ' PRO . 52.8 mt-30 -62.89 -39.06 93.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.023 0.439 . . . . 0.0 111.326 178.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -85.98 -5.58 59.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.633 -178.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 71.8 38.31 60.78 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.06 -0.591 . . . . 0.0 112.781 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 5.4 t -91.07 4.17 6.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.546 0.689 . . . . 0.0 110.105 -178.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.8 mm . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.174 179.245 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.681 0.277 . . . . 0.0 110.984 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.73 -161.02 0.81 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.0 t70 65.52 23.98 11.83 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.883 0.849 . . . . 0.0 110.432 175.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -66.9 -37.96 85.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.089 -175.745 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.58 -41.55 86.01 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.884 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.462 ' O ' HG23 ' A' ' 10' ' ' VAL . 11.0 m -59.57 -47.41 85.68 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.597 178.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 -67.08 -29.59 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.013 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.564 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 96.0 mtt180 -60.63 -50.79 72.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.95 0.405 . . . . 0.0 110.067 175.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.37 -42.5 95.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.88 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.5 HG21 HD21 ' A' ' 140' ' ' LEU . 64.7 t -62.52 -32.35 55.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.911 0.386 . . . . 0.0 110.589 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.4 t -69.54 -21.89 63.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.695 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.07 -3.31 54.4 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.06 0.457 . . . . 0.0 110.129 177.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.421 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 42.6 mt -108.35 88.46 4.97 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.57 175.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 10.3 Cg_endo -49.1 147.89 10.43 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 123.588 2.859 . . . . 0.0 113.318 -173.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.528 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 29.5 m -79.17 142.36 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.503 178.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.624 HD23 ' HG2' ' A' ' 31' ' ' ARG . 7.3 mp -81.33 134.16 35.53 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HD3' ' H ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -106.23 -4.43 20.19 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.748 -173.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.1 m -87.55 -53.98 4.51 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 173.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.8 t30 46.25 81.13 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.52 0 O-C-N 124.037 0.836 . . . . 0.0 112.276 175.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.71 165.43 23.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.946 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -100.67 177.97 28.41 Favored Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.938 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.45 5.76 2.21 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 123.399 2.733 . . . . 0.0 113.238 -176.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.526 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 3.4 mmp_? -84.14 -48.0 10.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.828 0.347 . . . . 0.0 110.86 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -91.66 92.59 8.52 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 176.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.55 ' O ' HG23 ' A' ' 29' ' ' VAL . 61.4 mtt85 -59.9 -31.26 69.65 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -175.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -64.26 -52.16 60.03 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.603 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 12.3 mt -72.82 -28.57 62.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.716 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.546 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 67.9 t-105 -60.87 -49.54 77.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.463 175.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 25' ' ' ARG . 86.4 t -61.55 -30.5 48.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.927 178.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.453 HE21 ' HB3' ' A' ' 30' ' ' GLN . 11.2 mt-30 -68.85 -49.94 54.11 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.84 0.352 . . . . 0.0 110.568 175.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.624 ' HG2' HD23 ' A' ' 16' ' ' LEU . 16.3 ttp180 -63.36 -32.16 73.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.063 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.415 HD22 ' HA ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -59.47 -48.47 81.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.683 -179.405 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.5 ptpp? -72.16 -34.89 68.83 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.248 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 30' ' ' GLN . 49.3 mt-10 -60.02 -46.92 87.92 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.718 0.77 . . . . 0.0 109.485 174.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -67.02 -42.45 84.91 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.614 -1.176 . . . . 0.0 111.028 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.24 -45.1 95.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.946 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -60.77 -39.2 87.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.955 177.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.4 m -62.89 -39.29 94.04 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.348 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.424 ' O ' HG23 ' A' ' 43' ' ' VAL . 96.1 mt -65.34 -47.78 75.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.584 177.546 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 74.3 mt -62.63 -43.32 98.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.681 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.4 tpp180 -56.2 -47.19 78.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.737 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.413 ' HD2' ' HE1' ' A' ' 54' ' ' PHE . 43.1 t80 -65.06 -45.58 84.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.724 -178.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.71 HG21 HH21 ' A' ' 55' ' ' ARG . 98.2 t -63.01 -45.16 99.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.107 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -59.94 -50.4 73.92 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.555 0.693 . . . . 0.0 110.137 177.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -53.64 -40.94 66.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.54 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.652 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 91.8 m-20 -68.49 -44.53 74.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.175 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -62.99 -31.9 73.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.284 -179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -64.24 -36.1 82.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 0.0 110.199 176.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.17 0.43 40.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.859 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.9 t70 74.02 12.12 4.29 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.291 177.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.652 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 5.3 t30 -119.82 92.78 3.87 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.12 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.89 146.86 35.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.692 0.282 . . . . 0.0 110.703 -176.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.779 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -104.94 -68.69 0.84 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -171.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.779 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 26.5 p90 -160.65 165.91 29.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.733 0.777 . . . . 0.0 112.923 -165.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.71 HH21 HG21 ' A' ' 43' ' ' VAL . 2.4 mmp_? -131.44 121.84 25.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.641 -1.163 . . . . 0.0 108.898 166.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.514 HD21 HD11 ' A' ' 82' ' ' ILE . 0.9 OUTLIER -134.11 125.32 27.73 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 -177.004 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -131.93 168.77 17.31 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.844 0.354 . . . . 0.0 110.321 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.465 ' OG ' ' HA2' ' A' ' 62' ' ' GLY . 6.3 t -130.48 178.2 6.79 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.31 -0.404 . . . . 0.0 109.948 -175.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -84.43 -177.98 6.78 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.4 ptpp? -60.66 -28.43 68.58 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -93.59 -10.9 33.12 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.592 0.234 . . . . 0.0 111.092 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.465 ' HA2' ' OG ' ' A' ' 58' ' ' SER . . . 71.48 13.31 74.1 Favored Glycine 0 CA--C 1.52 0.38 0 C-N-CA 120.913 -0.66 . . . . 0.0 113.047 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.8 p -80.64 -15.92 55.36 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -174.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.516 ' HA ' ' HA ' ' A' ' 85' ' ' ASP . 32.1 ttm180 -143.65 122.1 12.41 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 55.3 m95 -103.12 139.03 39.16 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.361 -178.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 p90 -146.0 146.43 30.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.93 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.54 -153.51 21.94 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.836 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.601 ' HG3' ' HZ3' ' A' ' 70' ' ' TRP . 5.5 ptpp? -151.23 143.81 24.31 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.098 0.475 . . . . 0.0 110.987 -178.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 15.9 p -122.79 141.23 52.05 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.561 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.659 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 2.9 p90 -122.7 137.06 55.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.462 0.649 . . . . 0.0 110.877 -178.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -117.89 123.27 45.44 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.708 -176.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 34.7 mm -87.59 126.71 41.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.117 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.422 ' HB3' ' HE1' ' A' ' 78' ' ' TYR . 11.8 t60 -140.59 124.76 17.51 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 176.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.443 ' C ' HD22 ' A' ' 75' ' ' LEU . 39.1 t70 68.3 -85.95 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.93 0.769 . . . . 0.0 110.422 -179.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.737 ' HB2' ' HB2' ' A' ' 172' ' ' HIS . 2.2 mm? -142.03 5.62 1.72 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 175.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 82.0 mt -111.47 153.67 25.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.898 0.38 . . . . 0.0 111.116 -172.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -116.68 129.01 55.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.958 176.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.422 ' HE1' ' HB3' ' A' ' 73' ' ' HIS . 43.0 m-85 -115.74 101.21 8.62 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.837 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.659 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 1.1 pm0 -96.2 135.76 37.58 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.092 0.473 . . . . 0.0 110.926 177.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.404 ' HD1' ' HG2' ' A' ' 101' ' ' GLU . 60.9 m-85 -124.75 138.76 54.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.919 -179.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -93.93 124.58 38.03 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.514 HD11 HD21 ' A' ' 56' ' ' LEU . 39.5 pt -130.8 160.32 42.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.927 0.394 . . . . 0.0 111.608 -173.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -154.14 153.39 31.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.398 177.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -172.55 162.31 5.16 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.516 ' HA ' ' HA ' ' A' ' 64' ' ' ARG . 5.6 p-10 -115.64 176.1 5.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.625 0.25 . . . . 0.0 110.504 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.405 HG21 ' CH2' ' A' ' 28' ' ' TRP . 50.6 mm -114.34 89.05 16.62 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.227 -175.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 20.6 Cg_endo -61.05 165.4 12.41 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.596 2.197 . . . . 0.0 112.122 177.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 55.6 mt -64.32 -21.84 29.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.256 0.551 . . . . 0.0 110.974 -178.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.16 -20.11 64.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.293 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.656 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 49.6 t80 -88.31 144.51 34.18 Favored Pre-proline 0 C--N 1.326 -0.425 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.656 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.2 Cg_endo -95.5 17.67 36.31 Favored 'Cis proline' 0 N--CA 1.459 -0.531 0 C-N-CA 124.495 -1.044 . . . . 0.0 113.822 3.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 10.3 m -65.24 -38.45 90.39 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.51 0.671 . . . . 0.0 110.186 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -129.18 141.73 51.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.612 175.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.44 144.48 91.78 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.636 -0.257 . . . . 0.0 111.256 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.416 ' HD3' ' CD1' ' A' ' 90' ' ' TYR . 95.2 Cg_endo -92.98 -171.9 0.33 Allowed 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 123.159 2.572 . . . . 0.0 112.39 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -106.71 123.21 47.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.392 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.86 126.22 41.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.581 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -92.24 117.64 30.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.116 -178.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.459 HG22 HG22 ' A' ' 82' ' ' ILE . 25.6 t -119.96 87.24 38.19 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.439 178.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -68.74 -6.5 18.1 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.867 2.378 . . . . 0.0 113.008 -176.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.404 ' HG2' ' HD1' ' A' ' 80' ' ' PHE . 14.6 tp10 -78.87 -43.25 25.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.046 0.45 . . . . 0.0 110.53 178.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.8 HD22 ' HG ' ' A' ' 153' ' ' LEU . 86.7 mt -86.76 -35.11 19.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.977 -175.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.0 128.67 38.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.364 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 95.86 -29.36 10.0 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.147 -177.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -92.34 4.59 53.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.914 0.388 . . . . 0.0 111.392 -177.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.9 t -150.09 151.84 33.82 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 175.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -82.94 -21.66 34.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.174 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -89.31 81.3 6.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.217 0.532 . . . . 0.0 110.381 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 7.6 tpt -135.06 136.44 42.05 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.487 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -61.53 -53.93 49.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.213 0.53 . . . . 0.0 110.657 -178.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -163.3 157.88 20.73 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -48.95 96.56 0.01 OUTLIER Glycine 0 CA--C 1.521 0.417 0 O-C-N 123.696 0.623 . . . . 0.0 114.013 -176.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . 0.581 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . 113.89 -23.92 12.5 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.079 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -96.51 131.19 43.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.941 0.401 . . . . 0.0 111.652 -173.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 33.3 pt -75.86 170.75 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.688 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 35.1 m -111.14 93.7 4.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.13 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 93.5 mt -74.28 157.32 36.02 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.722 0.296 . . . . 0.0 110.859 179.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.457 HG23 ' HB2' ' A' ' 121' ' ' PHE . 2.6 t -72.37 151.97 42.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.029 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -67.06 -25.38 66.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.601 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -78.56 -20.03 51.51 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.428 -176.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.457 ' HB2' HG23 ' A' ' 118' ' ' THR . 56.3 t80 -71.44 -34.43 70.26 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.953 -177.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.58 -53.53 63.63 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.009 -176.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.43 ' O ' ' HG3' ' A' ' 127' ' ' ARG . 37.0 Cg_endo -67.47 -34.17 27.07 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.529 1.486 . . . . 0.0 112.227 175.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.3 tp -60.35 -45.56 93.06 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.859 0.362 . . . . 0.0 110.462 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.539 ' O ' HG23 ' A' ' 129' ' ' VAL . 41.6 t-105 -59.91 -54.88 40.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.143 177.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.95 -34.68 68.26 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.413 -175.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.43 ' HG3' ' O ' ' A' ' 123' ' ' PRO . 97.0 mtt180 -69.15 -30.12 68.29 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -178.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -95.62 -21.8 18.0 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -172.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 125' ' ' TRP . 89.3 t -46.22 129.96 7.58 Favored Pre-proline 0 N--CA 1.473 0.678 0 O-C-N 123.446 0.466 . . . . 0.0 111.542 -178.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 129' ' ' VAL . 72.0 Cg_endo -96.72 -120.08 0.0 OUTLIER 'Cis proline' 0 CA--C 1.536 0.59 0 C-N-CA 124.016 -1.243 . . . . 0.0 113.156 2.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.528 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 64.8 mttm 67.42 22.37 9.41 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.331 175.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -91.84 -178.95 5.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.587 0.708 . . . . 0.0 112.151 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -178.31 157.71 21.87 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.393 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.6 tp -54.19 -40.24 67.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.792 0.296 . . . . 0.0 111.618 -177.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.43 -38.26 74.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.061 0.458 . . . . 0.0 111.015 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -71.87 -45.85 59.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.161 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.3 tp -59.19 -46.81 87.43 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.343 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . 0.41 ' HE1' ' CD2' ' A' ' 42' ' ' TYR . 7.8 tmm? -62.38 -47.69 83.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.215 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.75 -38.79 73.51 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -176.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.5 HD21 HG21 ' A' ' 10' ' ' VAL . 95.9 mt -86.87 -17.95 32.09 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -175.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -112.55 -66.63 0.5 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.296 -0.954 . . . . 0.0 113.041 -177.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.603 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 54.9 tp -66.45 -42.85 87.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.664 0.269 . . . . 0.0 111.031 -175.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -51.75 -61.94 6.0 Favored Glycine 0 CA--C 1.523 0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.63 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . 0.476 ' O ' HG23 ' A' ' 148' ' ' VAL . 33.9 Cg_endo -65.63 -31.86 49.05 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.314 2.009 . . . . 0.0 112.702 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 33.5 t90 -64.5 -33.74 76.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.694 0.283 . . . . 0.0 111.0 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 90.4 mt -58.55 -40.65 83.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.953 0.406 . . . . 0.0 110.167 177.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.0 -2.12 29.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.306 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 144' ' ' PRO . 90.8 t -104.85 -55.19 5.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.529 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -95.74 -32.48 12.71 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -173.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.607 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 40.2 mm -56.45 -41.19 89.88 Favored Pre-proline 0 CA--C 1.54 0.565 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -176.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.607 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 1.2 Cg_endo -46.18 -40.56 21.59 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 122.395 2.063 . . . . 0.0 112.792 171.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -61.93 -49.31 76.65 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.041 0.448 . . . . 0.0 110.097 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.8 ' HG ' HD22 ' A' ' 102' ' ' LEU . 3.7 mm? -60.52 -42.81 97.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.086 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 71.7 mt -67.94 -53.3 31.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.038 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -65.31 -36.34 83.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.389 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . 0.431 ' HZ3' ' HB3' ' A' ' 156' ' ' LYS . 5.8 ttpm? -70.99 -16.53 62.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.986 0.422 . . . . 0.0 110.42 -178.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.71 17.69 63.19 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.333 172.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 29.1 m -87.54 -19.99 7.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.861 0.331 . . . . 0.0 110.969 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.519 HG13 ' HB3' ' A' ' 153' ' ' LEU . 44.5 mt -83.82 121.88 37.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 175.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -80.65 66.16 6.06 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.46 0.648 . . . . 0.0 110.051 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . 0.507 ' HB2' HG22 ' A' ' 159' ' ' ILE . 42.3 m80 -152.24 41.41 0.64 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.535 -178.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -69.45 -22.68 63.64 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.029 0.443 . . . . 0.0 110.937 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -143.06 174.95 10.23 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -121.52 -24.66 5.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.018 0.437 . . . . 0.0 110.589 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . 0.628 ' SG ' ' HB2' ' A' ' 168' ' ' LEU . 12.7 t -137.82 -43.23 0.53 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.556 -176.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 8.5 t30 59.68 95.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.872 -0.604 . . . . 0.0 112.274 178.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.457 ' HA ' ' OE1' ' A' ' 167' ' ' GLN . 14.3 mm-40 72.49 -29.98 0.2 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 171.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.628 ' HB2' ' SG ' ' A' ' 165' ' ' CYS . 11.2 mp -60.61 -71.0 0.15 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.714 0.293 . . . . 0.0 110.572 179.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -84.76 -75.31 0.36 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.961 0.41 . . . . 0.0 110.26 175.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -165.45 152.55 10.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 -175.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -69.27 155.15 40.89 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 174.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . 0.737 ' HB2' ' HB2' ' A' ' 75' ' ' LEU . 10.4 p80 -64.68 93.61 0.11 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 122.426 1.108 . . . . 0.0 108.512 170.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 21.5 t-160 -172.65 99.07 0.14 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.276 -1.329 . . . . 0.0 107.598 -168.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . 0.454 ' HB2' HD21 ' A' ' 75' ' ' LEU . 1.6 t-80 -85.7 -15.03 43.58 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -166.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 58.5 m170 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.202 175.782 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.3 mtp . . . . . 0 N--CA 1.481 1.112 0 CA-C-O 120.602 0.239 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.78 -11.48 20.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.482 0.658 . . . . 0.0 109.83 173.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -85.57 20.31 2.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.528 -177.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 44.9 mt-10 -55.33 -41.42 72.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.989 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.491 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -60.54 -44.1 96.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.981 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.2 m -61.12 -42.63 98.88 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.517 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -64.41 -38.35 90.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.442 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 21.9 mtp180 -62.97 -40.37 97.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.06 178.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 5' ' ' ALA . 96.3 t -58.53 -47.36 88.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 120.93 0.395 . . . . 0.0 110.448 178.012 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.2 t -67.17 -25.72 34.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.868 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.6 m -81.71 -40.71 22.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.375 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.498 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 34.9 mt-10 -79.1 -12.21 60.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.655 0.264 . . . . 0.0 111.372 -179.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.7 mt -105.35 89.76 3.44 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 172.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.498 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 87.8 Cg_exo -45.52 151.2 1.15 Allowed 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 124.058 3.172 . . . . 0.0 114.25 -172.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.585 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 20.0 m -86.05 145.21 8.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.716 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.742 HD21 ' HG2' ' A' ' 35' ' ' GLU . 8.2 mp -85.11 134.58 34.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.893 -178.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -82.07 -32.87 30.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.721 0.772 . . . . 0.0 109.545 174.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.494 HG23 HD12 ' A' ' 27' ' ' LEU . 25.4 m -85.03 135.21 34.11 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.427 -175.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -135.24 93.23 2.96 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.388 178.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -162.42 161.38 27.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.516 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -103.77 -176.61 25.85 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.397 -179.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.51 -6.54 13.86 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 123.454 2.769 . . . . 0.0 113.051 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.438 ' HG3' HG23 ' A' ' 88' ' ' ILE . 45.7 mtp180 -71.31 -24.63 62.16 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.566 0.222 . . . . 0.0 111.239 178.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -113.83 96.42 5.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.526 ' O ' HG23 ' A' ' 29' ' ' VAL . 87.6 mtm180 -64.44 -32.95 74.78 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -173.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -68.41 -45.53 72.39 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.418 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.494 HD12 HG23 ' A' ' 18' ' ' THR . 4.5 mm? -71.7 -26.95 62.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.208 0.528 . . . . 0.0 110.203 174.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.531 ' HH2' HG21 ' A' ' 86' ' ' ILE . 63.7 t-105 -64.1 -41.84 97.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.297 178.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 25' ' ' ARG . 96.5 t -60.08 -37.84 74.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 121.158 0.504 . . . . 0.0 110.174 175.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 38.7 mt-30 -67.07 -43.49 82.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.14 178.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.469 HH11 ' HG3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -62.41 -30.51 71.27 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.35 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.494 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 2.1 mm? -65.29 -49.45 69.48 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.225 177.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.442 ' HG2' ' HA ' ' A' ' 30' ' ' GLN . 19.7 ptpt -66.37 -38.59 87.92 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 120.826 -0.349 . . . . 0.0 110.961 -178.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.534 ' HB3' ' HG ' ' A' ' 16' ' ' LEU . 26.4 mm-40 -61.88 -51.1 69.57 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.973 0.416 . . . . 0.0 110.392 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.742 ' HG2' HD21 ' A' ' 16' ' ' LEU . 6.0 mm-40 -63.36 -42.06 98.85 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.578 177.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.494 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -58.85 -45.02 91.06 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.281 -178.241 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 84.3 mm-40 -58.99 -43.09 91.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.027 0.442 . . . . 0.0 110.438 178.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.448 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 18.0 m -66.54 -40.58 89.16 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.763 177.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 35' ' ' GLU . 95.9 mt -62.95 -49.01 76.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.014 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 36' ' ' TYR . 85.8 mt -55.59 -47.44 78.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 O-C-N 123.163 0.289 . . . . 0.0 110.582 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -61.52 -41.07 96.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.375 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.484 ' HE2' ' HZ ' ' A' ' 54' ' ' PHE . 80.0 t80 -72.1 -46.21 57.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.22 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.44 ' O ' ' HG3' ' A' ' 47' ' ' LYS . 85.3 t -62.91 -37.34 78.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.068 0.461 . . . . 0.0 110.295 179.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.7 -50.56 70.65 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 175.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -53.72 -48.66 69.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.52 177.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -62.49 -39.36 93.21 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -178.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 43' ' ' VAL . 32.2 mtmm -68.88 -37.28 78.93 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.312 177.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -66.5 -34.91 78.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.713 177.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -85.86 -1.61 57.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.256 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.9 t70 61.62 29.68 18.3 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.667 0.746 . . . . 0.0 110.48 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -122.9 55.1 1.2 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.575 -175.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -93.7 106.59 18.55 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 65.0 p-90 -125.5 5.16 7.6 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -174.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.484 ' HZ ' ' HE2' ' A' ' 42' ' ' TYR . 19.7 p90 -154.64 147.0 23.91 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.077 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.53 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 23.0 tpt180 -126.57 123.32 37.42 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.575 178.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.1 mt -121.52 124.6 44.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.002 0.43 . . . . 0.0 110.112 175.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -134.78 152.37 51.7 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.178 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.6 m -126.23 159.35 33.27 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 120.771 0.32 . . . . 0.0 111.553 -171.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -75.74 173.2 11.41 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 170.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -69.14 -12.73 61.94 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -170.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -85.35 -25.53 27.04 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.831 0.348 . . . . 0.0 110.373 175.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.39 17.74 77.85 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.984 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.9 p -83.73 -30.28 26.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.953 0.406 . . . . 0.0 111.757 -177.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 64' ' ' ARG . 50.3 mtp180 -128.72 128.32 43.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.239 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -110.91 126.43 54.71 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.436 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.456 ' HA ' ' HA ' ' A' ' 83' ' ' GLU . 39.7 p90 -136.46 167.05 22.08 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.53 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 168.33 -138.77 5.31 Favored Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.011 -1.09 . . . . 0.0 112.544 178.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 81' ' ' ASP . 20.7 ttmm -153.03 134.73 14.53 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -172.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 64.5 m -119.67 122.66 42.0 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 174.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.585 ' HB3' ' HG2' ' A' ' 79' ' ' GLU . 41.5 p90 -124.43 129.98 51.65 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.284 0.564 . . . . 0.0 110.399 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -121.01 133.96 55.28 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 -179.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 43.3 mm -96.9 121.47 47.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.411 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -147.15 116.87 7.12 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.035 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 57.24 58.4 3.93 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.918 0.761 . . . . 0.0 111.224 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.1 mt 72.65 -38.64 0.42 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.385 0.674 . . . . 0.0 112.641 175.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.35 137.14 55.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.318 0.58 . . . . 0.0 112.068 -175.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -108.55 102.37 11.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.667 175.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 17.8 p90 -104.6 119.71 39.62 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.185 0.517 . . . . 0.0 110.6 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.585 ' HG2' ' HB3' ' A' ' 70' ' ' TRP . 57.4 mt-10 -105.77 136.44 45.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.328 -178.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -121.25 112.57 18.79 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.507 ' HA ' ' HA ' ' A' ' 68' ' ' LYS . 2.3 m-20 -83.34 112.97 20.39 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 38.2 pt -114.62 173.76 3.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.266 -173.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.456 ' HA ' ' HA ' ' A' ' 66' ' ' PHE . 10.0 pt-20 -162.44 157.71 22.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.785 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.583 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 36.0 p90 -160.91 148.15 15.43 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.084 0.469 . . . . 0.0 111.077 176.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -93.34 164.0 13.38 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.831 177.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.531 HG21 ' HH2' ' A' ' 28' ' ' TRP . 39.7 mm -107.45 91.98 7.75 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.631 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 1.3 Cg_endo -40.79 148.22 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 124.181 3.254 . . . . 0.0 113.807 -178.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.438 HG23 ' HG3' ' A' ' 23' ' ' ARG . 50.2 mm -58.52 -39.42 75.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.957 -174.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.3 p -83.19 40.5 0.71 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.213 0.53 . . . . 0.0 112.064 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.534 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 25.0 t80 -77.76 147.65 74.75 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.483 177.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.534 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 19.9 Cg_endo -94.76 13.35 44.72 Favored 'Cis proline' 0 N--CA 1.453 -0.856 0 C-N-CA 124.513 -1.036 . . . . 0.0 112.883 -2.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 22.5 m -62.28 -35.84 80.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.33 0.586 . . . . 0.0 110.191 178.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.6 m -105.77 119.66 39.71 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.641 173.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -81.41 152.05 69.79 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.528 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.563 ' HG2' HD13 ' A' ' 134' ' ' LEU . 50.9 Cg_exo -55.31 136.47 73.66 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.891 2.394 . . . . 0.0 112.163 174.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.486 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 19.9 mt-10 -79.74 -22.68 42.98 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.201 -173.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.583 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 62.8 mt 65.95 116.24 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-O 121.363 0.601 . . . . 0.0 111.665 -178.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.738 ' HB2' ' HG2' ' A' ' 114' ' ' LYS . . . -119.62 138.38 53.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.357 0.599 . . . . 0.0 111.84 -177.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.524 ' HB ' ' HE1' ' A' ' 109' ' ' MET . 16.7 t -124.43 86.18 55.26 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.713 176.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.91 -21.71 65.6 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.333 2.689 . . . . 0.0 114.138 -172.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.65 -29.81 56.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.208 0.528 . . . . 0.0 110.375 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.836 ' HB2' ' HE1' ' A' ' 109' ' ' MET . 75.2 mt -89.92 4.05 51.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.309 -176.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -62.26 110.57 1.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 87.02 -2.55 87.08 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.26 -178.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.482 ' HD2' HD23 ' A' ' 102' ' ' LEU . 4.2 ttmp? -101.9 -5.87 24.2 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 121.433 0.635 . . . . 0.0 110.045 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 t -153.02 163.47 39.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.648 177.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -113.41 14.22 19.1 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.099 0.476 . . . . 0.0 110.447 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -96.19 35.81 1.4 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.781 -177.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.836 ' HE1' ' HB2' ' A' ' 102' ' ' LEU . 59.8 mtt -139.24 164.68 29.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.055 0.455 . . . . 0.0 111.759 -176.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -90.76 179.4 5.8 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.584 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -64.37 112.34 3.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.917 177.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 126.5 -16.05 6.67 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.536 177.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.81 12.93 42.01 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.229 -179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.738 ' HG2' ' HB2' ' A' ' 98' ' ' ALA . 95.0 mttt -91.8 137.54 32.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 176.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.5 pt -82.13 167.55 2.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.376 0.607 . . . . 0.0 112.32 -168.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 17.6 p -114.27 116.71 29.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.054 176.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.8 mt -85.7 -175.14 5.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.183 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.454 HG22 ' H ' ' A' ' 120' ' ' HIS . 31.5 m -59.86 131.93 52.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.092 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -63.57 -32.33 73.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.82 -177.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.454 ' H ' HG22 ' A' ' 118' ' ' THR . 25.2 m80 -75.18 -22.11 58.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.09 -179.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -71.5 -33.57 69.36 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.35 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.434 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 28.1 ttpp -55.69 -56.75 26.46 Favored Pre-proline 0 CA--C 1.542 0.647 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.975 -178.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.434 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 36.3 Cg_endo -67.28 -31.28 35.75 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.589 1.526 . . . . 0.0 112.104 175.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 54.5 tp -61.33 -44.8 96.59 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.414 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.549 ' O ' HG23 ' A' ' 129' ' ' VAL . 49.9 t-105 -59.84 -54.61 44.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.309 178.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.12 -16.13 63.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.968 -176.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -86.35 -21.6 27.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.958 0.408 . . . . 0.0 110.591 178.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -110.11 25.61 11.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.972 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.549 HG23 ' O ' ' A' ' 125' ' ' TRP . 87.2 t -102.13 135.23 19.69 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.641 174.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.484 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 88.3 Cg_endo -89.05 -153.33 0.64 Allowed 'Cis proline' 0 N--CA 1.462 -0.344 0 C-N-CA 124.085 -1.215 . . . . 0.0 112.851 1.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.585 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 53.5 mtmt 76.28 7.1 3.54 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.836 0.855 . . . . 0.0 111.759 -176.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.2 171.25 7.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 173.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -169.94 176.02 43.85 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.43 -0.89 . . . . 0.0 112.244 -174.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.563 HD13 ' HG2' ' A' ' 95' ' ' PRO . 60.9 tp -61.97 -37.09 83.46 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 122.784 0.433 . . . . 0.0 111.49 -174.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.54 -39.58 76.93 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.403 0.62 . . . . 0.0 110.591 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -69.93 -36.1 75.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.065 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.501 HD22 ' HD2' ' A' ' 95' ' ' PRO . 57.3 tp -66.42 -53.49 35.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.414 -179.087 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.2 ptt? -62.18 -35.64 79.44 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.522 -175.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.34 -41.76 69.4 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.7 mt -95.61 -12.12 26.15 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -172.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -112.91 -53.9 0.47 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.155 -1.022 . . . . 0.0 113.739 -175.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.501 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 52.0 tp -64.36 -42.54 96.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.715 0.258 . . . . 0.0 111.479 -173.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.05 -61.69 7.22 Favored Glycine 0 CA--C 1.522 0.471 0 C-N-CA 121.244 -0.503 . . . . 0.0 113.068 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -58.38 -29.01 86.92 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.733 2.288 . . . . 0.0 113.081 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -66.87 -37.46 84.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.744 0.307 . . . . 0.0 110.818 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 91.8 mt -55.21 -38.13 68.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.316 -178.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.57 -6.11 46.66 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 57.5 t -82.14 -40.1 17.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 120.734 0.302 . . . . 0.0 111.584 -177.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -125.01 -39.78 2.22 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -173.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.469 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 48.2 mm -55.02 -52.56 70.0 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -169.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.6 Cg_endo -54.27 -33.86 77.38 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.102 1.868 . . . . 0.0 112.921 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.506 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 20.7 t70 -87.14 -29.67 21.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.9 0.381 . . . . 0.0 110.371 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.624 ' HA ' ' HE2' ' A' ' 156' ' ' LYS . 24.2 tp -56.96 -39.65 74.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.589 179.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 60.4 mt -64.18 -40.32 88.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.361 176.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -66.93 -34.62 78.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.223 -178.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . 0.624 ' HE2' ' HA ' ' A' ' 153' ' ' LEU . 54.4 mttm -55.6 -30.76 61.45 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.087 0.47 . . . . 0.0 110.962 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.88 13.64 71.69 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.688 -0.768 . . . . 0.0 111.756 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 28.7 m -79.7 -17.12 12.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.136 0.494 . . . . 0.0 110.78 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 61.8 mt -91.95 125.84 44.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.007 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 19.6 tm0? -71.15 130.56 41.79 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . 0.488 ' HD2' ' HD2' ' A' ' 164' ' ' LYS . 13.5 p-80 -67.44 95.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.177 0.513 . . . . 0.0 111.301 -178.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -94.95 -167.52 1.65 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.595 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 67.39 6.66 5.03 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.679 174.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.488 ' HD2' ' HD2' ' A' ' 161' ' ' HIS . 27.2 mtpp -75.27 -42.46 54.88 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 40.6 t -71.82 129.14 37.91 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 174.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -78.06 93.89 4.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.961 0.41 . . . . 0.0 110.745 -176.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -105.73 136.67 44.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.867 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 49.0 tp -120.91 137.01 54.8 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 177.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.04 149.3 25.92 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 58.2 t60 -129.21 88.67 2.74 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -86.77 110.1 19.69 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.025 -177.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 70.4 t60 -58.17 117.86 4.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.102 -178.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 37.6 m80 -87.1 175.2 8.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.094 177.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 11.6 p80 -71.62 -16.16 62.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.185 0.517 . . . . 0.0 109.915 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 . . . . . 0 C--O 1.246 0.909 0 CA-C-O 117.983 -1.008 . . . . 0.0 109.253 -178.23 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ptm . . . . . 0 N--CA 1.481 1.103 0 CA-C-O 120.53 0.205 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.39 82.45 7.21 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.743 0.306 . . . . 0.0 110.871 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 58.4 73.16 0.49 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.757 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -67.52 -30.19 69.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.171 -176.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.421 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -60.63 -43.11 97.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.106 0.479 . . . . 0.0 109.856 176.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 25.0 m -66.94 -43.5 83.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.42 177.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.08 -49.19 78.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.696 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.445 ' HG3' ' N ' ' A' ' 9' ' ' VAL . 12.4 ptm180 -65.44 -45.3 84.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.437 -175.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.445 ' N ' ' HG3' ' A' ' 8' ' ' ARG . 88.4 t -61.73 -43.65 97.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 C-N-CA 121.124 -0.231 . . . . 0.0 111.047 -177.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 94.7 t -63.96 -31.35 52.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.915 0.388 . . . . 0.0 110.696 178.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.1 m -83.18 -17.33 43.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.257 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -93.08 -4.3 52.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.328 0.585 . . . . 0.0 110.095 175.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.1 mt -116.63 89.07 26.82 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.619 176.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -40.67 139.52 1.24 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.058 3.172 . . . . 0.0 113.687 -176.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.599 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.5 m -81.23 151.46 4.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.325 -177.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.6 mp -83.98 169.53 14.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.436 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.405 ' N ' ' HD2' ' A' ' 17' ' ' LYS . 2.6 mptp? -122.64 -48.39 2.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.959 0.409 . . . . 0.0 110.235 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.8 m -84.32 95.54 8.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.407 0.623 . . . . 0.0 110.957 -177.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -89.22 79.46 7.11 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.444 0.64 . . . . 0.0 110.089 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -122.68 168.23 12.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.075 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.53 ' HA3' ' O ' ' A' ' 90' ' ' TYR . . . -125.38 177.89 16.79 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.247 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.551 ' HB2' HG23 ' A' ' 88' ' ' ILE . 18.0 Cg_exo -66.45 -4.46 10.81 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 123.317 2.678 . . . . 0.0 112.959 -175.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.465 ' HD2' HG22 ' A' ' 88' ' ' ILE . 15.0 mmm180 -64.65 -35.44 81.02 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.946 0.403 . . . . 0.0 109.948 174.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -110.25 106.41 15.8 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.59 ' O ' HG23 ' A' ' 29' ' ' VAL . 74.6 mtm180 -61.6 -39.46 91.32 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.807 -173.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -70.02 -47.47 61.97 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.899 0.38 . . . . 0.0 110.958 -175.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 27' ' ' LEU . 4.4 mm? -67.96 -28.43 67.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.373 177.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 59.6 t-105 -64.59 -39.46 93.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.891 174.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.59 HG23 ' O ' ' A' ' 25' ' ' ARG . 72.4 t -55.8 -44.27 76.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.489 175.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -64.46 -50.74 66.31 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.369 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.417 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 22.8 ttt180 -62.47 -36.59 82.95 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.07 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.81 -40.86 69.95 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 178.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.547 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 66.9 mttm -65.86 -44.65 84.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.3 177.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -64.71 -41.46 95.97 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.531 -178.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -58.87 -43.33 90.82 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.2 0.524 . . . . 0.0 109.661 175.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -65.74 -31.35 72.3 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.451 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.547 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 28.9 mm-40 -61.01 -47.44 86.45 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.806 0.336 . . . . 0.0 110.419 178.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.0 m -63.04 -40.62 98.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.491 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.483 ' O ' HG23 ' A' ' 43' ' ' VAL . 95.7 mt -63.78 -55.43 23.13 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.229 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 97.9 mt -56.63 -43.08 78.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 O-C-N 123.29 0.368 . . . . 0.0 111.267 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 22.1 tpp85 -57.99 -47.19 83.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.605 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -69.82 -37.69 76.31 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.782 -177.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 39' ' ' LEU . 75.3 t -60.56 -40.24 83.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.878 0.37 . . . . 0.0 110.675 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.591 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 40.7 mt-10 -70.32 -37.86 74.81 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.979 177.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -57.69 -42.61 83.99 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.426 0.631 . . . . 0.0 109.698 172.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.606 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 15.3 m-20 -62.55 -57.56 10.68 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.708 -1.133 . . . . 0.0 112.008 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.591 ' HG2' ' HA ' ' A' ' 44' ' ' GLU . 21.7 ptmt -66.6 -25.64 66.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.483 -175.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 -76.42 -21.02 56.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.951 0.405 . . . . 0.0 110.692 176.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -97.95 4.04 49.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.059 175.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.4 t70 60.06 26.38 15.71 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.956 0.884 . . . . 0.0 110.908 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -134.67 87.55 2.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.005 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.606 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 41.9 t0 -83.06 156.71 23.21 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.053 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.566 ' HB3' ' CD2' ' A' ' 54' ' ' PHE . 1.2 m95 -100.25 -56.9 2.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.863 -170.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.566 ' CD2' ' HB3' ' A' ' 53' ' ' TRP . 44.5 p90 -161.51 157.52 25.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.327 0.584 . . . . 0.0 111.87 -172.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.449 ' HD2' ' HA ' ' A' ' 55' ' ' ARG . 19.7 tpt180 -108.46 123.72 49.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 168.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.0 tp -130.92 124.12 30.41 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.061 0.458 . . . . 0.0 110.683 -173.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -101.9 158.51 16.08 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.465 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.2 m -141.84 149.92 40.93 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.753 0.311 . . . . 0.0 110.687 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.0 p-10 -79.27 169.97 17.33 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 172.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.662 ' HD3' ' H ' ' A' ' 60' ' ' LYS . 1.9 mppt? -63.31 -24.04 67.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.764 0.316 . . . . 0.0 111.534 -175.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -82.0 -22.41 36.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.911 -177.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.25 21.93 79.26 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.783 -174.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.518 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . 15.4 p -99.42 -28.09 13.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.176 0.512 . . . . 0.0 111.182 -177.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.733 HH22 ' HB3' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -119.27 109.11 15.44 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.462 -178.399 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.99 ' HB2' ' HB2' ' A' ' 84' ' ' PHE . 27.1 m95 -107.51 140.18 40.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.138 177.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -152.35 142.42 22.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.789 0.328 . . . . 0.0 110.687 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 173.71 -149.82 11.33 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -142.02 138.61 31.95 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.894 0.347 . . . . 0.0 110.596 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.445 ' HA ' ' HB3' ' A' ' 54' ' ' PHE . 49.0 t -122.34 150.93 41.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.008 -178.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.722 ' HB3' ' HA ' ' A' ' 79' ' ' GLU . 47.5 p90 -159.9 159.98 33.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.817 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -149.2 139.64 22.44 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 172.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 26.1 mm -84.03 114.4 24.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.011 0.434 . . . . 0.0 110.938 -173.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -127.11 122.19 33.55 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.476 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 62.3 34.07 16.09 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 123.667 0.604 . . . . 0.0 110.075 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.664 HD12 ' HA ' ' A' ' 164' ' ' LYS . 1.8 tm? 75.36 -20.03 0.37 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.927 -178.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.4 mt -66.2 115.79 6.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.737 0.303 . . . . 0.0 110.86 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -94.34 106.97 18.95 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.478 ' HD1' ' HE1' ' A' ' 80' ' ' PHE . 6.7 p90 -121.8 117.69 27.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.129 0.49 . . . . 0.0 110.432 177.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.722 ' HA ' ' HB3' ' A' ' 70' ' ' TRP . 0.9 OUTLIER -110.72 138.98 46.42 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.867 -177.424 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.478 ' HE1' ' HD1' ' A' ' 78' ' ' TYR . 65.5 m-85 -127.83 129.79 47.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.63 -177.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -73.65 125.0 27.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.226 0.536 . . . . 0.0 110.206 174.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.509 HG22 HG13 ' A' ' 99' ' ' VAL . 38.3 pt -127.92 155.34 39.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.659 -175.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.733 ' HB3' HH22 ' A' ' 64' ' ' ARG . 44.7 mt-10 -127.37 163.0 24.98 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.771 175.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.99 ' HB2' ' HB2' ' A' ' 65' ' ' TRP . 93.2 m-85 -134.94 143.32 46.82 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.435 176.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -121.56 137.96 54.51 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 173.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.518 ' HB ' ' HA ' ' A' ' 63' ' ' THR . 51.0 mm -108.3 89.38 5.79 Favored Pre-proline 0 C--N 1.312 -1.057 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.463 -178.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -56.98 150.31 56.55 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.101 1.867 . . . . 0.0 110.531 175.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.551 HG23 ' HB2' ' A' ' 22' ' ' PRO . 2.1 mt -79.16 1.48 2.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.544 0.688 . . . . 0.0 109.996 -174.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.1 p -88.02 -4.94 58.74 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.737 174.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.717 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 33.5 t80 -65.39 145.51 99.06 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.528 175.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.717 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 98.1 Cg_endo -95.75 5.53 45.67 Favored 'Cis proline' 0 N--CA 1.455 -0.753 0 C-N-CA 124.453 -1.061 . . . . 0.0 113.029 0.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 10.2 m -62.13 -33.7 74.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.537 0.684 . . . . 0.0 109.653 178.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.0 m -111.59 135.47 52.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.065 171.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.56 146.16 98.99 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.051 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.534 ' HD3' ' CE1' ' A' ' 90' ' ' TYR . 57.3 Cg_endo -73.74 159.07 46.16 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.54 2.16 . . . . 0.0 111.697 178.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -104.5 129.8 52.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.187 0.518 . . . . 0.0 111.178 -175.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.499 HD12 HD13 ' A' ' 115' ' ' ILE . 54.4 mt -101.64 123.64 54.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.215 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -113.08 135.0 54.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.115 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.509 HG13 HG22 ' A' ' 82' ' ' ILE . 18.7 t -121.09 87.74 44.21 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-O 120.588 0.233 . . . . 0.0 111.407 -176.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -62.45 -20.63 71.08 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.993 2.462 . . . . 0.0 112.347 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.41 ' HG2' ' HA ' ' A' ' 80' ' ' PHE . 9.8 tp10 -71.75 -29.03 64.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.204 0.526 . . . . 0.0 110.602 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.0 mt -98.28 -31.43 12.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -50.86 109.64 0.34 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 123.724 0.64 . . . . 0.0 111.554 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 92.23 -36.75 3.57 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.747 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.407 ' HG2' HG11 ' A' ' 158' ' ' VAL . 37.2 ttpt -81.45 -26.55 35.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.081 0.467 . . . . 0.0 111.031 -175.191 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 5.8 t -113.83 161.79 17.13 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.838 0.352 . . . . 0.0 110.596 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.56 ' O ' ' HB3' ' A' ' 108' ' ' LYS . . . -111.61 -173.44 2.24 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 178.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.675 ' NZ ' ' HB3' ' A' ' 108' ' ' LYS . 3.8 ttpm? 75.31 -29.56 0.19 Allowed 'General case' 0 N--CA 1.471 0.576 0 O-C-N 123.3 0.375 . . . . 0.0 111.686 176.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 41.6 ttm -73.45 124.39 25.72 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 172.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.488 ' HE1' ' HB3' ' A' ' 116' ' ' CYS . 20.5 p90 -66.78 152.71 45.0 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 177.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.49 ' HD2' ' HA ' ' A' ' 111' ' ' ARG . 11.5 tpt180 -61.55 113.58 2.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.101 0.477 . . . . 0.0 110.628 -179.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 177.28 -35.32 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.75 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 87.94 -13.22 61.74 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.419 176.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 97' ' ' ILE . 17.1 ptpt -101.87 158.68 15.95 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.499 HD13 HD12 ' A' ' 97' ' ' ILE . 38.6 pt -72.28 147.98 9.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.958 0.409 . . . . 0.0 111.323 -176.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.488 ' HB3' ' HE1' ' A' ' 110' ' ' TYR . 2.0 p -97.97 116.98 31.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.523 178.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 96.7 mt -92.77 158.69 15.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.988 0.423 . . . . 0.0 111.28 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 15.2 t -87.62 157.39 19.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.207 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.28 -53.35 59.16 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 -172.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -71.59 -10.01 59.11 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -173.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -71.06 -33.96 70.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.928 0.394 . . . . 0.0 110.238 178.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -62.14 -55.39 41.04 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.632 -177.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -62.42 -34.84 75.27 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.584 1.523 . . . . 0.0 111.917 175.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 49.2 tp -59.35 -46.41 88.7 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.368 177.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 57.3 t-105 -59.33 -56.03 27.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.707 178.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.33 -36.51 82.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.159 -175.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -67.72 -31.89 72.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.301 -177.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -95.96 20.97 9.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.455 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 90.4 t -91.28 137.6 26.11 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 172.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.444 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 97.5 Cg_endo -93.36 -152.88 0.37 Allowed 'Cis proline' 0 N--CA 1.46 -0.493 0 C-N-CA 124.265 -1.139 . . . . 0.0 113.58 2.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.599 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 9.6 mtmp? 77.21 -5.96 2.08 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.955 0.902 . . . . 0.0 111.614 -176.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -80.74 152.22 28.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.291 174.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.417 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -156.72 179.17 32.74 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.797 -0.716 . . . . 0.0 111.977 -174.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' A' ' 138' ' ' MET . 53.9 tp -64.73 -40.76 95.87 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 122.57 0.348 . . . . 0.0 111.197 -174.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.42 -35.91 76.92 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.499 0.666 . . . . 0.0 110.751 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . 0.417 ' HE1' ' HA ' ' A' ' 15' ' ' VAL . 47.7 m80 -71.23 -33.02 69.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.166 178.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 62.0 tp -66.49 -33.81 76.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.321 176.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 134' ' ' LEU . 23.7 mmt -56.87 -55.65 31.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.098 0.475 . . . . 0.0 110.173 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.17 -40.77 82.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.674 -0.693 . . . . 0.0 112.657 -177.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.1 mt -86.36 -28.97 23.31 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -171.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -115.61 -57.13 0.34 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.285 -0.959 . . . . 0.0 113.165 -175.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.496 HD12 HD13 ' A' ' 97' ' ' ILE . 10.2 tt -62.48 -49.51 75.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.64 0.257 . . . . 0.0 111.208 -174.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.25 -61.45 7.38 Favored Glycine 0 CA--C 1.524 0.65 0 CA-C-N 116.178 -0.465 . . . . 0.0 113.49 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.83 -35.77 89.39 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.891 2.394 . . . . 0.0 113.059 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -65.22 -40.93 94.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.613 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 80.1 mt -59.95 -33.58 72.11 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.805 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.73 -13.87 62.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.663 -177.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 44.8 t -103.17 -35.85 3.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.091 0.472 . . . . 0.0 110.641 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -85.71 -51.89 6.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.027 -174.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.561 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 40.8 mm -60.67 -52.11 74.9 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -170.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.561 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 56.2 Cg_exo -53.74 -34.71 75.74 Favored 'Trans proline' 0 C--N 1.355 0.871 0 C-N-CA 122.18 1.92 . . . . 0.0 112.707 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -67.14 -41.03 86.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.595 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 57.8 tp -68.81 -35.72 77.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.082 0.468 . . . . 0.0 110.371 176.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.516 HG12 HD12 ' A' ' 159' ' ' ILE . 77.2 mt -62.4 -48.3 88.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.363 177.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -66.01 -26.06 67.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.842 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . 0.565 ' HE3' HG21 ' A' ' 158' ' ' VAL . 34.8 ttpt -74.0 -16.03 61.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.987 0.422 . . . . 0.0 110.268 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 83.62 18.32 64.16 Favored Glycine 0 C--O 1.229 -0.164 0 C-N-CA 121.078 -0.582 . . . . 0.0 113.607 172.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . 0.565 HG21 ' HE3' ' A' ' 156' ' ' LYS . 41.1 t -88.4 -18.59 8.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.526 0.679 . . . . 0.0 110.751 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.516 HD12 HG12 ' A' ' 154' ' ' ILE . 66.0 mt -93.19 129.28 43.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -57.29 119.88 7.18 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 177.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -70.05 108.32 4.02 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -176.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.525 ' HE3' ' HA ' ' A' ' 162' ' ' LYS . 0.8 OUTLIER -63.19 134.78 56.52 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.251 -177.205 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.18 121.2 17.92 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.265 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.664 ' HA ' HD12 ' A' ' 75' ' ' LEU . 3.7 ttmp? -89.98 -26.14 20.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.039 -174.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . 0.632 ' HA ' HD12 ' A' ' 168' ' ' LEU . 84.1 m -83.35 4.29 27.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.033 0.444 . . . . 0.0 111.184 -177.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -103.87 126.03 50.71 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 66.46 28.03 9.65 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.787 0.803 . . . . 0.0 109.596 -177.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.632 HD12 ' HA ' ' A' ' 165' ' ' CYS . 1.2 tt -77.12 110.86 12.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.428 -178.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -55.04 -36.6 65.69 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.542 -0.753 . . . . 0.0 111.85 -174.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . 0.505 ' HB2' HD22 ' A' ' 168' ' ' LEU . 26.8 m-70 -64.0 -22.09 66.78 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -112.27 -20.29 11.91 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.072 178.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -64.13 -41.4 97.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.456 174.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -109.12 121.99 46.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.719 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -72.35 119.48 16.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.411 -178.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 . . . . . 0 C--O 1.245 0.844 0 CA-C-O 118.495 -0.764 . . . . 0.0 109.542 178.575 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.904 0 CA-C-O 120.85 0.357 . . . . 0.0 110.204 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -114.61 14.17 17.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.231 0.539 . . . . 0.0 110.403 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -120.92 127.32 51.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.643 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.46 ' CD ' ' H ' ' A' ' 4' ' ' GLU . 0.1 OUTLIER -78.34 -35.15 47.92 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.092 -177.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.47 ' HA ' ' NE ' ' A' ' 8' ' ' ARG . . . -62.98 -46.37 88.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.907 0.384 . . . . 0.0 110.745 -178.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.452 ' O ' HG23 ' A' ' 10' ' ' VAL . 24.8 m -56.62 -49.53 74.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.186 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.6 ptt180 -67.79 -38.24 83.07 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -173.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.47 ' NE ' ' HA ' ' A' ' 5' ' ' ALA . 17.3 ptt180 -71.17 -32.23 68.65 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.535 -177.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 5' ' ' ALA . 79.1 t -68.64 -45.59 81.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 6' ' ' THR . 57.4 t -67.89 -26.5 34.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.891 0.377 . . . . 0.0 110.899 178.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.3 t -70.03 -50.79 37.83 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.741 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.424 ' O ' ' HD2' ' A' ' 41' ' ' ARG . 50.2 mt-10 -83.94 -8.96 59.04 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -176.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.416 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 54.0 mt -104.74 88.2 2.16 Favored Pre-proline 0 C--N 1.321 -0.642 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 170.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.6 Cg_endo -49.42 146.09 14.83 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.919 3.079 . . . . 0.0 113.657 -170.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.0 m -77.55 160.8 4.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.255 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.505 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 6.1 mp -110.05 148.99 30.65 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.161 -176.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.3 ptpp? -110.24 -20.96 12.47 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 -174.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 32.7 m -88.44 115.86 26.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.771 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -112.49 104.34 12.45 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -151.07 157.94 43.44 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.266 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.17 -177.05 29.04 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.152 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.95 5.68 5.15 Favored 'Trans proline' 0 CA--C 1.531 0.348 0 C-N-CA 122.913 2.409 . . . . 0.0 113.103 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.811 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 0.4 OUTLIER -92.52 -46.61 7.55 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 177.598 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -80.16 75.9 6.93 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 174.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.591 ' HA ' ' HB3' ' A' ' 28' ' ' TRP . 93.8 mtt180 -71.22 -25.06 62.34 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -168.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.602 ' HG3' HD22 ' A' ' 27' ' ' LEU . 7.5 pt-20 -63.53 -35.78 81.61 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.371 171.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.602 HD22 ' HG3' ' A' ' 26' ' ' GLU . 3.8 mm? -81.29 -29.52 34.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.046 0.451 . . . . 0.0 109.954 174.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.591 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 64.5 t-105 -61.16 -39.18 89.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.445 177.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 25' ' ' ARG . 87.2 t -59.55 -40.96 83.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-O 121.107 0.479 . . . . 0.0 110.414 175.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -66.86 -41.76 86.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.226 0.536 . . . . 0.0 109.678 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.551 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 11.8 tpt180 -62.23 -36.54 82.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.805 176.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 61.9 mt -57.8 -54.9 41.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.215 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.47 ' HB2' ' HE3' ' A' ' 33' ' ' LYS . 19.1 ptmt -61.23 -37.02 81.57 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.572 -176.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -59.31 -50.87 72.32 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.133 0.492 . . . . 0.0 110.68 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.452 ' HA ' HD21 ' A' ' 16' ' ' LEU . 8.5 tp10 -65.44 -42.05 92.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.138 -178.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.474 ' O ' HG13 ' A' ' 40' ' ' ILE . 23.5 m-85 -60.53 -45.36 94.11 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.165 178.284 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -60.66 -40.63 92.77 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.655 0.264 . . . . 0.0 110.848 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.405 ' HA ' ' HG2' ' A' ' 14' ' ' PRO . 8.3 t -64.73 -46.89 80.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.97 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.497 ' O ' HG23 ' A' ' 43' ' ' VAL . 64.0 mt -56.07 -53.92 51.26 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.293 177.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.523 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 82.5 mt -55.98 -40.67 64.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.883 -175.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.483 ' O ' ' HD3' ' A' ' 41' ' ' ARG . 0.0 OUTLIER -61.33 -44.34 97.35 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.704 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -65.91 -36.99 84.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.11 178.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 39' ' ' LEU . 94.9 t -64.89 -42.46 94.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.62 177.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 42.1 mt-10 -53.51 -56.21 18.9 Favored 'General case' 0 CA--C 1.519 -0.213 0 O-C-N 123.315 0.384 . . . . 0.0 111.289 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -52.22 -41.85 63.08 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.146 0.498 . . . . 0.0 111.075 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.599 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 83.3 m-20 -72.47 -51.07 21.73 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.602 -176.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 31.9 mmmt -59.08 -38.93 80.61 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.557 0.218 . . . . 0.0 111.14 176.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -63.57 -41.46 98.38 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.499 178.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.18 3.69 22.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.865 0.364 . . . . 0.0 110.495 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.1 t70 67.9 9.38 7.1 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.681 0.792 . . . . 0.0 111.23 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.599 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 5.9 t30 -98.78 77.3 2.24 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.77 102.5 0.59 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.386 0.613 . . . . 0.0 109.848 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.574 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -67.04 -57.16 7.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.66 -1.155 . . . . 0.0 112.437 -168.808 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.574 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 37.1 p90 -156.72 161.44 39.82 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.27 0.557 . . . . 0.0 111.152 -171.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.499 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 18.4 tpp85 -121.46 123.42 42.02 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 171.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 19.4 tp -124.03 122.68 38.54 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.031 0.443 . . . . 0.0 110.401 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -105.59 156.06 18.61 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.442 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.8 p -135.54 159.72 40.73 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.767 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.406 ' ND2' ' HB3' ' A' ' 64' ' ' ARG . 97.8 m-20 -73.1 176.32 5.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.104 173.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -57.56 -43.08 84.21 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.915 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -81.22 -20.47 40.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.718 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.82 25.97 65.93 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.646 -0.787 . . . . 0.0 111.314 -173.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.7 p -85.71 -4.89 59.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.972 0.415 . . . . 0.0 112.014 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.406 ' HB3' ' ND2' ' A' ' 59' ' ' ASN . 56.0 ttt180 -155.95 129.86 8.58 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 -179.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -121.22 142.09 50.24 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 -177.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -155.0 160.99 41.48 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.288 -0.264 . . . . 0.0 110.288 -177.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.499 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 163.68 -160.09 32.83 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.537 177.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -115.21 147.07 40.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.811 0.339 . . . . 0.0 110.91 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.588 ' SG ' ' HB2' ' A' ' 80' ' ' PHE . 5.3 p -117.49 134.26 55.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.134 172.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.457 ' CD1' ' HG2' ' A' ' 79' ' ' GLU . 13.6 m-90 -114.24 128.65 56.46 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.221 0.534 . . . . 0.0 111.559 -175.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -136.21 120.6 18.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.088 175.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.415 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.7 mp -105.61 123.73 60.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 120.981 0.419 . . . . 0.0 110.486 -176.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.1 t60 -128.46 108.31 10.44 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.717 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.27 57.69 4.33 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 123.674 0.609 . . . . 0.0 111.31 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.587 ' HB3' ' HB3' ' A' ' 164' ' ' LYS . 88.8 mt 70.11 -0.6 2.72 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.355 -0.839 . . . . 0.0 113.141 175.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 66.5 mt -91.91 113.69 26.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.999 0.428 . . . . 0.0 110.571 177.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.3 tttt -99.95 96.3 7.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.181 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -104.54 125.96 51.18 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.053 0.454 . . . . 0.0 110.182 176.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.457 ' HG2' ' CD1' ' A' ' 70' ' ' TRP . 28.4 mt-10 -106.88 135.41 48.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.186 -174.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.588 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . 84.7 m-85 -120.9 129.97 53.71 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.679 0.276 . . . . 0.0 110.871 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -88.09 121.09 30.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.859 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.403 HG22 HG22 ' A' ' 99' ' ' VAL . 40.1 pt -125.34 157.19 34.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.541 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -158.57 158.99 35.0 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.723 174.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.42 ' CE1' HD21 ' A' ' 134' ' ' LEU . 30.5 p90 -159.14 153.79 24.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.349 177.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.433 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 8.7 p-10 -99.41 166.6 11.1 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.89 -177.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.3 mm -111.95 89.68 12.0 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.201 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.433 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 11.0 Cg_exo -66.02 164.66 26.62 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.551 2.167 . . . . 0.0 112.12 -177.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 58.0 mt -66.49 -22.14 29.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.36 0.6 . . . . 0.0 110.052 177.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -82.23 3.38 27.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.041 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -77.94 142.72 65.17 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -96.23 10.51 41.76 Favored 'Cis proline' 0 N--CA 1.457 -0.645 0 C-N-CA 124.178 -1.176 . . . . 0.0 113.126 -1.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.523 ' HA ' HG11 ' A' ' 129' ' ' VAL . 15.9 m -56.51 -35.3 67.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.32 0.581 . . . . 0.0 110.99 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.4 m -130.66 127.62 39.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.886 175.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.4 ' HB2' ' CE2' ' A' ' 125' ' ' TRP . . . -73.38 143.44 82.81 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.824 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -83.63 134.0 6.31 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.69 2.26 . . . . 0.0 112.226 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.625 ' HB2' ' HD2' ' A' ' 114' ' ' LYS . 2.9 mp0 -62.24 132.64 53.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.149 176.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.501 ' O ' HG12 ' A' ' 115' ' ' ILE . 57.7 mt -75.64 143.47 13.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.391 -178.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.517 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -107.45 124.1 49.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.792 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.403 HG22 HG22 ' A' ' 82' ' ' ILE . 25.6 t -119.98 87.22 38.25 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.016 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -70.73 6.2 1.74 Allowed 'Trans proline' 0 N--CA 1.474 0.379 0 C-N-CA 123.5 2.8 . . . . 0.0 114.046 -173.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -103.95 -44.03 5.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.836 0.351 . . . . 0.0 110.84 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.826 ' HA ' ' HD3' ' A' ' 105' ' ' LYS . 91.4 mt -83.47 0.33 46.78 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -172.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.497 ' HA ' ' SD ' ' A' ' 109' ' ' MET . 8.1 p-10 -64.6 -15.1 60.6 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -171.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -114.8 2.71 23.03 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.56 -0.828 . . . . 0.0 113.633 -177.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.826 ' HD3' ' HA ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -127.96 -20.34 3.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.688 0.744 . . . . 0.0 112.37 -178.466 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.578 HG22 ' O ' ' A' ' 102' ' ' LEU . 7.7 t -110.85 -32.88 6.69 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.382 173.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 59.58 25.92 14.86 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.87 177.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 4.9 tppt? -83.11 7.05 17.09 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.266 0.555 . . . . 0.0 110.368 -178.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.497 ' SD ' ' HA ' ' A' ' 103' ' ' ASP . 1.9 mpt? -91.45 134.74 34.37 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.152 -178.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 11.9 p90 -114.92 6.3 15.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.174 0.511 . . . . 0.0 110.735 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.664 ' HB3' ' HB2' ' A' ' 114' ' ' LYS . 24.0 ttm180 -156.49 82.18 0.97 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.531 175.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 63.45 -103.47 0.68 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.196 -177.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . 0.517 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . -100.42 -5.54 54.13 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.292 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.664 ' HB2' ' HB3' ' A' ' 111' ' ' ARG . 64.1 mmtt -70.03 111.77 5.94 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 122.422 0.289 . . . . 0.0 110.978 -179.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 97' ' ' ILE . 34.9 pt -81.65 164.17 3.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.312 -178.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 53.0 t -99.85 119.89 38.9 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.058 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 96.1 mt -79.17 177.07 9.1 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.859 175.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.65 140.18 58.84 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.561 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.09 -46.56 61.83 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -171.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.6 m170 -92.91 -5.93 49.73 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.414 -174.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -71.38 -41.18 69.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.357 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.566 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 79.2 tttt -65.79 -49.89 57.11 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.68 -177.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.566 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 34.6 Cg_exo -60.99 -32.15 92.08 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.839 1.693 . . . . 0.0 111.83 175.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 52.3 tp -60.82 -46.98 88.43 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.984 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.492 ' O ' HG23 ' A' ' 129' ' ' VAL . 17.7 t-105 -54.23 -56.66 16.18 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.565 177.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -58.23 -35.21 71.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.648 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 127' ' ' ARG . 6.1 ttp180 -68.31 -36.31 79.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.066 0.46 . . . . 0.0 110.801 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -79.76 -31.4 40.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.513 -173.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.523 HG11 ' HA ' ' A' ' 92' ' ' THR . 94.8 t -53.5 137.24 51.75 Favored Pre-proline 0 N--CA 1.468 0.433 0 O-C-N 123.394 0.434 . . . . 0.0 110.545 176.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.493 ' HA ' HG13 ' A' ' 129' ' ' VAL . 86.5 Cg_endo -90.43 -147.55 0.28 Allowed 'Cis proline' 0 C--N 1.349 0.572 0 C-N-CA 124.28 -1.133 . . . . 0.0 113.204 5.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 33.1 ttpt 67.5 4.69 3.93 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.409 0.684 . . . . 0.0 111.439 -179.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -101.56 159.96 14.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.789 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.551 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -136.78 158.25 24.07 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.947 -174.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.42 HD21 ' CE1' ' A' ' 84' ' ' PHE . 53.6 tp -63.84 -38.76 92.29 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.23 0.612 . . . . 0.0 111.198 -177.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.59 -31.03 56.24 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.407 0.622 . . . . 0.0 111.165 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -71.2 -31.46 67.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.514 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 63.1 tp -61.73 -48.34 81.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.943 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 5.4 mpp? -66.25 -41.03 90.52 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.738 0.304 . . . . 0.0 111.206 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.18 -49.99 44.83 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -177.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 87.8 mt -88.86 -21.71 23.54 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -172.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -106.77 -62.58 0.59 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.634 -0.793 . . . . 0.0 113.01 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.501 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 53.9 tp -64.75 -42.15 95.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 -175.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.03 -61.87 6.49 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 121.248 -0.501 . . . . 0.0 112.991 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . 0.478 ' O ' HG23 ' A' ' 148' ' ' VAL . 48.9 Cg_exo -58.66 -33.84 98.52 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.635 2.223 . . . . 0.0 112.699 176.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 39.9 t90 -59.72 -44.31 93.78 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.994 0.426 . . . . 0.0 110.258 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 76.8 mt -62.75 -37.75 87.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.719 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.9 -11.84 61.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.907 -176.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 144' ' ' PRO . 59.5 t -89.13 -46.66 15.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.787 0.327 . . . . 0.0 110.828 178.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.444 ' O ' HD23 ' A' ' 153' ' ' LEU . 59.2 mm-40 -83.8 -43.14 15.72 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -173.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.504 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 1.6 mp -54.21 -50.97 81.63 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 -170.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.504 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 11.6 Cg_endo -54.91 -34.0 84.31 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 122.108 1.872 . . . . 0.0 113.055 -178.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -87.5 -43.2 12.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.98 0.419 . . . . 0.0 110.75 -177.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 149' ' ' GLU . 4.2 mm? -60.44 -35.58 76.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.639 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.534 ' HA ' ' HB ' ' A' ' 159' ' ' ILE . 67.9 mt -65.25 -40.32 88.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.066 0.46 . . . . 0.0 110.187 175.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -66.14 -34.75 78.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.564 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . 0.413 ' HD3' HD13 ' A' ' 153' ' ' LEU . 58.8 mtpt -65.29 -17.93 64.9 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.28 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 81.19 22.03 61.61 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.7 178.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 28.5 m -103.2 -21.16 5.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.855 0.359 . . . . 0.0 110.797 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.534 ' HB ' ' HA ' ' A' ' 154' ' ' ILE . 45.0 mm -84.25 138.62 18.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . 0.448 ' NE2' ' HD3' ' A' ' 162' ' ' LYS . 25.1 tp60 -65.32 102.82 0.71 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.188 0.518 . . . . 0.0 111.754 -176.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -102.86 110.46 22.39 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 172.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.457 ' HG3' ' H ' ' A' ' 163' ' ' GLU . 9.4 tptm -135.96 -158.05 0.84 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.523 -172.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.457 ' H ' ' HG3' ' A' ' 162' ' ' LYS . 34.4 mt-10 -60.32 131.65 51.44 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.059 -178.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.587 ' HB3' ' HB3' ' A' ' 75' ' ' LEU . 54.1 mttp -77.39 -18.12 57.57 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.194 -173.061 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 51.3 t -103.57 118.02 35.76 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.0 0.429 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -81.05 82.63 6.95 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -81.14 -2.61 49.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.94 -178.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -77.79 106.21 9.47 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.75 -179.5 3.96 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.199 177.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -117.59 126.71 53.03 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.954 -172.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -95.85 98.99 10.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.165 175.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 23.2 p80 -142.25 142.48 32.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.588 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 7.0 p80 -141.44 128.71 21.06 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.984 178.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -74.13 -31.69 62.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 177.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 78.9 t60 . . . . . 0 C--O 1.248 1.025 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.415 175.782 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.11 -21.15 29.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.868 0.366 . . . . 0.0 111.32 -177.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -89.78 20.57 4.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.101 0.477 . . . . 0.0 110.245 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.49 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 2.7 tm-20 -58.3 -54.64 44.75 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.097 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.465 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -59.58 -42.14 91.83 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.856 177.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.1 m -58.88 -51.14 71.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.609 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 4' ' ' GLU . 14.3 ptm180 -65.26 -38.07 89.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.702 -174.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.1 ppt_? -75.16 -23.5 57.78 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.247 -177.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 5' ' ' ALA . 76.1 t -75.56 -50.68 22.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.826 0.346 . . . . 0.0 110.217 175.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.8 t -62.29 -30.4 48.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.876 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.8 t -64.31 -21.89 66.76 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.386 -178.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -95.98 2.37 53.41 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.975 0.416 . . . . 0.0 110.812 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.462 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 32.1 mt -118.93 88.0 35.1 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.462 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 6.4 Cg_endo -46.76 148.64 3.63 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 124.398 3.399 . . . . 0.0 114.382 -170.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.4 m -83.36 152.88 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.237 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.761 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 6.1 mp -103.21 136.15 43.53 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.382 -175.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.47 ' HD2' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -94.76 -45.62 7.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.188 0.518 . . . . 0.0 110.779 -173.434 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.44 HG21 ' HB3' ' A' ' 30' ' ' GLN . 0.6 OUTLIER -88.86 83.35 6.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.224 -174.681 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.455 ' OD1' ' HD2' ' A' ' 31' ' ' ARG . 84.9 m-20 -124.62 127.37 47.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.413 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.457 ' HB3' ' HB3' ' A' ' 27' ' ' LEU . . . -140.45 -65.5 0.45 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.866 178.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 158.85 166.71 18.43 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.873 -0.679 . . . . 0.0 111.694 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.9 -10.87 29.47 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.061 2.508 . . . . 0.0 111.89 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.507 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 4.8 mmp_? -63.63 -44.47 93.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.417 176.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.539 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 10.3 t0 -91.74 111.28 22.73 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 -178.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.459 ' O ' HG23 ' A' ' 29' ' ' VAL . 18.1 mtp180 -55.14 -51.28 66.95 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.026 -178.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.77 -44.02 94.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.901 0.381 . . . . 0.0 111.345 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.539 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 4.4 mm? -70.55 -29.39 65.84 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.204 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.546 ' CH2' HG21 ' A' ' 86' ' ' ILE . 75.6 t-105 -73.99 -42.0 61.07 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 177.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 25' ' ' ARG . 72.1 t -60.97 -42.51 93.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.982 0.42 . . . . 0.0 110.082 176.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.454 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 2.4 mm100 -62.15 -52.43 63.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.604 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.534 HH12 HD22 ' A' ' 16' ' ' LEU . 1.8 ttt85 -56.62 -39.37 73.49 Favored 'General case' 0 N--CA 1.462 0.167 0 O-C-N 123.144 0.278 . . . . 0.0 111.338 178.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.523 ' HG ' ' CE2' ' A' ' 36' ' ' TYR . 18.1 tp -57.34 -47.57 81.26 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.773 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -67.5 -38.97 85.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.863 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 6.7 mm-40 -55.76 -50.67 69.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.232 0.539 . . . . 0.0 110.312 175.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.539 ' HA ' HD21 ' A' ' 16' ' ' LEU . 12.6 tp10 -65.53 -37.85 87.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.424 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.523 ' CE2' ' HG ' ' A' ' 32' ' ' LEU . 10.7 m-85 -59.78 -38.28 81.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.145 177.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -60.59 -45.12 95.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.993 0.425 . . . . 0.0 110.252 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.7 t -63.77 -47.04 82.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.552 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.436 ' O ' HG23 ' A' ' 43' ' ' VAL . 94.7 mt -58.78 -48.08 82.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.093 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 36' ' ' TYR . 80.0 mt -57.86 -47.14 86.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.778 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -63.43 -40.25 96.67 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.704 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -59.76 -48.87 79.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.524 HG12 ' HE2' ' A' ' 47' ' ' LYS . 94.3 t -59.19 -38.41 74.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.781 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.63 -50.31 74.31 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 173.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -58.2 -40.47 81.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.918 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.431 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 16.2 m120 -55.72 -55.28 34.14 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.916 176.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.524 ' HE2' HG12 ' A' ' 43' ' ' VAL . 53.8 mttm -66.21 -34.81 78.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.973 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -68.41 -28.32 66.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.704 0.287 . . . . 0.0 111.384 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -93.81 2.16 56.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.754 0.312 . . . . 0.0 110.788 177.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.1 t0 64.24 20.14 12.06 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.827 0.822 . . . . 0.0 110.677 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -118.39 72.96 0.89 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.627 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.431 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 14.8 t70 -91.85 88.81 6.78 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.172 -179.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.444 ' HB2' ' O ' ' A' ' 70' ' ' TRP . 24.1 p-90 -117.28 2.95 12.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.986 -173.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -119.23 129.88 55.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.498 0.666 . . . . 0.0 112.195 -167.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -140.45 124.23 17.24 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.906 -1.043 . . . . 0.0 108.376 174.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.7 tp -134.49 127.99 32.52 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.764 0.316 . . . . 0.0 110.259 -178.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -128.39 160.42 32.28 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.5 p -142.23 172.72 12.31 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.997 0.427 . . . . 0.0 111.019 -176.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 33.1 p30 -89.66 163.55 15.09 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 168.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.472 ' HE2' ' HB2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -66.27 -21.39 66.28 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -172.825 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -74.38 -25.94 59.8 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.572 175.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.03 22.36 78.0 Favored Glycine 0 N--CA 1.452 -0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.162 -177.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 26.8 p -89.97 -26.94 20.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.864 0.364 . . . . 0.0 111.336 -177.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.3 mtt180 -127.58 132.99 49.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.034 0.445 . . . . 0.0 110.553 175.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -115.82 128.21 55.65 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.244 175.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.7 p90 -130.4 129.32 42.91 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -131.24 166.84 22.67 Favored Glycine 0 N--CA 1.435 -1.401 0 C-N-CA 119.838 -1.173 . . . . 0.0 113.28 -172.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -124.24 131.23 53.51 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.0 p -128.64 131.6 48.07 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.418 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.444 ' O ' ' HB2' ' A' ' 53' ' ' TRP . 6.7 p90 -133.26 121.47 22.5 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.261 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.435 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 14.5 t80 -117.82 129.44 55.66 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.896 -172.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.449 ' N ' HD12 ' A' ' 72' ' ' ILE . 4.0 mp -93.83 113.79 29.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -138.21 118.68 13.83 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.653 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 56.79 45.21 22.09 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.58 0.55 . . . . 0.0 110.84 -176.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.605 ' HB2' ' HB2' ' A' ' 166' ' ' ASN . 4.4 mm? 67.26 4.74 3.83 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.479 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 99.2 mt -96.96 113.14 24.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.106 0.479 . . . . 0.0 110.126 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 51.9 tttp -96.44 93.47 6.84 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.32 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.435 ' CE1' ' HB3' ' A' ' 71' ' ' TYR . 14.2 p90 -99.66 150.13 22.59 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.597 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -124.37 136.27 53.95 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.499 -174.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.412 ' HD1' ' HG2' ' A' ' 101' ' ' GLU . 96.4 m-85 -133.5 137.96 45.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.948 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -102.75 137.1 41.41 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.011 0.434 . . . . 0.0 110.051 176.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 99' ' ' VAL . 40.8 pt -136.41 158.16 37.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.396 -176.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -155.79 156.4 34.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.245 0.545 . . . . 0.0 110.829 175.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.589 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 42.4 p90 -155.46 149.81 25.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.23 177.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -102.36 163.52 12.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.503 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.546 HG21 ' CH2' ' A' ' 28' ' ' TRP . 50.8 mm -105.66 91.49 5.12 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.189 -178.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.04 164.01 10.86 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.677 2.251 . . . . 0.0 112.798 -179.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 73.4 mt -66.33 -33.39 63.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.196 -177.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.9 p -85.19 17.57 2.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.25 0.548 . . . . 0.0 111.64 -176.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.502 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 69.0 t80 -79.15 143.4 60.86 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 176.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.502 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.4 Cg_endo -96.7 14.74 36.42 Favored 'Cis proline' 0 N--CA 1.459 -0.509 0 C-N-CA 124.497 -1.043 . . . . 0.0 113.689 2.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.5 m -65.57 -26.93 68.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.543 0.687 . . . . 0.0 109.972 178.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.3 m -114.01 131.57 56.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.543 172.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -70.73 144.92 91.6 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.804 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 5.7 Cg_exo -72.8 143.41 37.14 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.8 2.334 . . . . 0.0 112.307 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.499 ' HB3' ' HD3' ' A' ' 114' ' ' LYS . 48.0 mt-10 -86.63 101.17 13.0 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.993 0.425 . . . . 0.0 110.046 179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.589 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 61.6 mt -74.35 125.42 33.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.781 -178.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -105.58 134.14 49.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.54 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.525 HG22 HG22 ' A' ' 82' ' ' ILE . 42.5 t -127.78 86.84 57.33 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.54 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.04 -24.53 73.93 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.861 2.374 . . . . 0.0 112.664 -175.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.412 ' HG2' ' HD1' ' A' ' 80' ' ' PHE . 10.4 tp10 -63.58 -38.9 92.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.574 176.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 98.7 mt -108.99 34.16 3.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.312 -177.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -63.01 -16.98 61.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.03 -175.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -171.74 30.17 0.12 Allowed Glycine 0 C--N 1.314 -0.65 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.145 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -100.08 8.2 44.11 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -175.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.572 HG23 ' HB2' ' A' ' 109' ' ' MET . 4.2 t -121.07 154.96 35.42 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 174.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -76.09 -27.95 57.36 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.7 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 21.9 pttm -115.49 101.03 8.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.391 0.615 . . . . 0.0 110.111 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.572 ' HB2' HG23 ' A' ' 106' ' ' THR . 12.6 tpt -139.26 156.62 46.94 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.711 -173.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -75.98 162.79 27.78 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -66.6 84.14 0.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.935 0.397 . . . . 0.0 111.053 176.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 135.71 -163.46 24.98 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 121.097 -0.573 . . . . 0.0 111.752 178.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -97.66 29.34 11.18 Favored Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.302 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.499 ' HD3' ' HB3' ' A' ' 96' ' ' GLU . 59.4 mttp -109.36 139.18 44.64 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 35.4 pt -68.02 146.69 12.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.149 0.499 . . . . 0.0 112.314 -173.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.2 t -104.53 100.07 9.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.885 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 97.3 mt -88.16 171.84 9.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.334 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 10.2 t -64.83 142.07 58.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.795 0.331 . . . . 0.0 110.161 178.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -65.42 -25.09 67.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.521 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -79.93 -6.67 57.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.734 0.302 . . . . 0.0 111.61 -177.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -71.71 -36.44 70.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.707 0.289 . . . . 0.0 110.529 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.453 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 99.8 mttt -68.21 -50.51 29.46 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.987 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 10.3 Cg_endo -55.29 -37.81 94.2 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 121.932 1.755 . . . . 0.0 111.88 172.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.77 -46.05 87.01 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.721 0.296 . . . . 0.0 110.27 176.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.58 ' O ' HG23 ' A' ' 129' ' ' VAL . 17.9 t-105 -53.16 -57.6 9.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.624 176.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.43 -27.35 68.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.647 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 -74.44 -25.29 59.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.958 0.409 . . . . 0.0 110.945 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -104.01 15.12 29.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.858 -175.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 125' ' ' TRP . 95.9 t -98.57 137.26 20.63 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.434 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 82.0 Cg_endo -89.98 -158.25 1.02 Allowed 'Cis proline' 0 N--CA 1.46 -0.473 0 C-N-CA 123.871 -1.304 . . . . 0.0 113.243 -0.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.761 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 57.8 mttp 75.51 0.79 3.5 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.898 0.879 . . . . 0.0 111.73 -174.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -79.08 169.77 17.68 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -149.32 160.48 28.45 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.652 -176.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' A' ' 137' ' ' LEU . 49.3 tp -69.85 -38.45 76.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 122.678 0.391 . . . . 0.0 110.368 -177.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.9 -30.82 64.28 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.246 0.546 . . . . 0.0 110.809 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -70.38 -31.9 69.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.45 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.424 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 49.5 tp -60.52 -51.96 67.22 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.137 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 5.4 mpp? -67.19 -33.61 75.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.732 0.301 . . . . 0.0 111.141 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.7 -48.39 47.68 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.976 -178.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 84.5 mt -97.97 -2.94 39.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -173.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -119.13 -64.82 0.29 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.316 -0.945 . . . . 0.0 112.586 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.473 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 52.6 tp -62.3 -51.86 66.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.47 0.176 . . . . 0.0 111.37 -176.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -50.7 -61.07 6.32 Favored Glycine 0 CA--C 1.523 0.581 0 CA-C-N 116.181 -0.463 . . . . 0.0 113.298 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . 0.569 ' O ' HG23 ' A' ' 148' ' ' VAL . 72.6 Cg_exo -53.49 -40.42 78.79 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.724 2.283 . . . . 0.0 112.73 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -63.47 -41.82 98.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.709 0.29 . . . . 0.0 110.616 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.494 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 89.7 mt -59.99 -39.28 85.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.091 0.472 . . . . 0.0 110.092 176.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.63 -18.66 64.34 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.736 -179.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 144' ' ' PRO . 86.4 t -71.61 -56.68 9.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -175.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -134.5 0.53 3.04 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -172.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.582 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 33.4 mm -68.2 -52.18 23.22 Favored Pre-proline 0 C--N 1.324 -0.502 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.157 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.582 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 38.2 Cg_exo -61.42 -29.36 85.24 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.734 1.623 . . . . 0.0 111.516 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -69.84 -40.98 75.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.008 178.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.537 HD23 HD11 ' A' ' 159' ' ' ILE . 24.7 tp -68.11 -30.93 70.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.499 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 150' ' ' ILE . 74.3 mt -62.14 -44.86 99.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.073 0.463 . . . . 0.0 110.077 175.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 54.3 tp60 -69.16 -14.66 63.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.081 -178.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . 0.559 ' HE2' ' HA ' ' A' ' 156' ' ' LYS . 11.2 mmpt? -68.3 -20.94 64.79 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.95 0.405 . . . . 0.0 110.228 174.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 88.96 13.15 62.75 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.722 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 27.5 m -100.11 -16.31 7.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.844 0.354 . . . . 0.0 111.645 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.537 HD11 HD23 ' A' ' 153' ' ' LEU . 55.6 mt -104.86 107.45 22.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.12 0.486 . . . . 0.0 110.391 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -146.15 93.21 2.29 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.594 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -95.08 -15.55 23.33 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.409 -174.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.541 ' HG3' ' OE1' ' A' ' 163' ' ' GLU . 14.8 tptp -142.45 162.26 35.93 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.219 -175.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.541 ' OE1' ' HG3' ' A' ' 162' ' ' LYS . 0.1 OUTLIER -94.92 8.61 42.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.523 -177.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -56.32 -63.63 1.13 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.035 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 41.2 m 55.13 87.03 0.05 Allowed 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.715 0.635 . . . . 0.0 111.606 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . 0.605 ' HB2' ' HB2' ' A' ' 75' ' ' LEU . 8.5 t30 -85.93 -37.89 18.58 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.164 0.507 . . . . 0.0 109.759 179.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -71.28 132.31 44.73 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.929 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 88.6 mt -74.33 103.6 4.78 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 176.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -54.91 121.34 8.45 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.014 -175.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -82.69 142.48 31.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.514 177.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 -56.07 115.8 2.64 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.068 0.461 . . . . 0.0 110.449 -175.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -130.76 146.94 52.35 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.081 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 1.2 p80 -123.39 139.65 53.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.195 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -147.38 140.06 24.83 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -177.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.494 -0.765 . . . . 0.0 108.977 177.807 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 121.021 0.438 . . . . 0.0 110.592 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.56 4.85 52.78 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.611 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.563 ' HB3' ' HB ' ' A' ' 6' ' ' THR . 55.1 m-20 64.38 47.24 3.13 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.945 177.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -56.91 -54.81 42.37 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.723 -178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.485 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -57.9 -43.91 86.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.625 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.563 ' HB ' ' HB3' ' A' ' 3' ' ' ASP . 17.4 m -57.43 -48.63 78.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.59 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 24.0 mmt180 -64.11 -38.98 93.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.79 0.328 . . . . 0.0 110.658 -178.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 8' ' ' ARG . 44.5 ttp180 -65.2 -40.02 93.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.286 177.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 5' ' ' ALA . 52.3 t -63.96 -44.14 97.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.04 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 6' ' ' THR . 46.7 t -68.38 -20.15 25.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 121.103 0.478 . . . . 0.0 110.613 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.1 m -81.54 -47.61 12.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.786 176.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -69.85 -27.88 65.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.896 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.608 HG23 ' HB2' ' A' ' 38' ' ' SER . 39.6 mt -106.56 88.67 3.54 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.827 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -65.69 179.32 1.77 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.981 2.454 . . . . 0.0 113.109 -174.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.592 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.8 m -88.85 162.98 2.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.102 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.812 HD21 ' HB3' ' A' ' 35' ' ' GLU . 9.1 mp -92.07 156.09 17.63 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.448 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -71.45 -33.06 69.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.151 0.5 . . . . 0.0 110.267 178.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.567 HG23 ' HB3' ' A' ' 31' ' ' ARG . 3.0 t -146.74 152.36 38.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.629 -176.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -132.1 36.32 3.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.084 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.63 149.48 48.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.439 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.38 176.78 54.58 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.327 -179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.8 -3.44 6.88 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.364 2.709 . . . . 0.0 112.587 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.546 ' HD2' HG22 ' A' ' 88' ' ' ILE . 0.3 OUTLIER -64.11 -29.5 70.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.7 176.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -109.33 110.55 21.74 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 57.9 mtp85 -56.61 -51.59 68.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.647 -174.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -65.6 -52.82 49.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.68 0.276 . . . . 0.0 111.197 -174.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.502 HD12 HG21 ' A' ' 18' ' ' THR . 4.4 mm? -63.67 -33.42 75.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.002 -177.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.467 ' CZ2' HG21 ' A' ' 86' ' ' ILE . 63.7 t-105 -63.19 -52.05 63.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.633 176.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.6 t -64.7 -34.34 69.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.975 0.417 . . . . 0.0 110.662 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -71.58 -44.48 64.42 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.053 -178.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.567 ' HB3' HG23 ' A' ' 18' ' ' THR . 6.8 ptm180 -68.37 -28.54 67.2 Favored 'General case' 0 CA--C 1.523 -0.095 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -43.72 76.08 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.046 174.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -67.51 -40.48 85.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.536 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -61.12 -45.05 96.26 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.233 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.812 ' HB3' HD21 ' A' ' 16' ' ' LEU . 22.0 pt-20 -77.41 -29.29 52.99 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.953 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.491 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.0 OUTLIER -57.35 -47.1 82.47 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.92 0.39 . . . . 0.0 110.404 171.747 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 65.0 mm-40 -63.98 -37.92 89.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.732 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.608 ' HB2' HG23 ' A' ' 13' ' ' ILE . 0.6 OUTLIER -72.18 -31.38 65.86 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.732 177.068 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 56.9 mt -62.28 -49.28 76.3 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 170.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.3 mt -58.32 -40.66 78.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.837 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.432 ' NE ' ' HA ' ' A' ' 41' ' ' ARG . 4.5 mmp_? -53.42 -52.54 59.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.75 0.31 . . . . 0.0 111.192 176.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -63.16 -47.2 83.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.697 -177.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.8 t -62.67 -41.38 92.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.909 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.546 ' OE2' ' HD3' ' A' ' 47' ' ' LYS . 6.7 tp10 -61.72 -51.34 68.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.354 0.597 . . . . 0.0 110.318 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -59.31 -39.45 83.1 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.89 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -66.9 -47.42 71.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.573 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.546 ' HD3' ' OE2' ' A' ' 44' ' ' GLU . 22.8 ptmt -66.59 -28.75 68.75 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.207 -0.197 . . . . 0.0 110.887 -178.053 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.464 HD22 ' HG3' ' A' ' 47' ' ' LYS . 1.0 OUTLIER -71.98 -24.72 61.63 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.245 0.545 . . . . 0.0 110.302 176.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -88.17 7.06 33.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.266 176.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.7 t70 72.81 3.87 4.81 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.469 176.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.517 ' C ' HD22 ' A' ' 51' ' ' ASN . 0.2 OUTLIER -117.81 86.11 2.46 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.129 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.27 136.07 51.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.088 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -88.79 -78.78 0.33 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.906 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -150.95 171.25 17.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.124 0.488 . . . . 0.0 111.453 -170.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.8 tpt180 -132.48 124.05 27.81 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.043 172.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.0 mt -126.69 127.12 44.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.94 0.4 . . . . 0.0 111.378 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -133.22 163.32 29.55 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.354 173.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -129.54 166.72 19.11 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.737 0.303 . . . . 0.0 110.738 -173.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.494 ' HB3' ' OE1' ' A' ' 61' ' ' GLU . 4.3 m-20 -58.71 159.71 6.42 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 167.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -67.19 -17.94 65.04 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.824 0.345 . . . . 0.0 110.891 -177.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.494 ' OE1' ' HB3' ' A' ' 59' ' ' ASN . 1.4 mp0 -85.78 -17.66 35.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.021 0.438 . . . . 0.0 110.519 174.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.03 11.55 83.89 Favored Glycine 0 C--O 1.227 -0.311 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.542 -177.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.4 p -77.37 -36.7 53.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.884 0.373 . . . . 0.0 111.808 -177.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.7 mtt180 -123.07 144.22 49.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.095 0.474 . . . . 0.0 110.857 175.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.97 ' HB2' ' HB2' ' A' ' 84' ' ' PHE . 22.8 m95 -118.89 150.33 40.05 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.196 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -154.12 150.61 28.34 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 174.27 -165.1 36.5 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.297 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -138.29 142.3 39.8 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.461 ' SG ' HD13 ' A' ' 82' ' ' ILE . 78.1 m -115.9 129.63 56.49 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.065 177.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.64 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 28.9 m-90 -100.5 125.85 46.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.949 0.404 . . . . 0.0 109.963 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 38.5 t80 -117.37 120.32 37.81 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.131 0.491 . . . . 0.0 110.367 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 50.8 mm -94.9 118.44 41.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.7 178.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 10.2 t60 -141.56 121.43 13.57 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.69 41.49 15.01 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.465 0.65 . . . . 0.0 110.156 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 98.8 mt 71.92 -4.89 1.83 Allowed 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.214 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.551 HD22 ' HE1' ' A' ' 161' ' ' HIS . 63.7 mt -91.95 144.6 25.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.666 0.27 . . . . 0.0 110.762 -177.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.406 ' HZ2' ' HB2' ' A' ' 77' ' ' LYS . 3.8 ttmp? -109.34 117.42 34.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.508 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -130.28 128.68 42.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.782 0.325 . . . . 0.0 110.14 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.64 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 9.6 pt-20 -102.29 145.24 29.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.158 -177.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -123.48 135.78 54.24 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.874 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -92.14 129.82 38.0 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.803 -178.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.523 HG22 HG22 ' A' ' 99' ' ' VAL . 42.5 pt -126.78 149.58 31.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.734 -174.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -131.15 163.44 27.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.981 174.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.97 ' HB2' ' HB2' ' A' ' 65' ' ' TRP . 44.9 m-85 -150.11 148.66 29.25 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.854 -179.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -129.85 148.13 51.69 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 169.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.467 HG21 ' CZ2' ' A' ' 28' ' ' TRP . 47.9 mm -109.68 91.7 10.94 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -172.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 15.0 Cg_endo -56.19 159.02 13.48 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.533 2.155 . . . . 0.0 111.715 174.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.546 HG22 ' HD2' ' A' ' 23' ' ' ARG . 23.3 mm -71.99 -14.58 17.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.373 0.606 . . . . 0.0 110.702 -175.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.2 p -89.69 1.98 55.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.634 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.6 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 65.6 t80 -80.62 146.87 61.73 Favored Pre-proline 0 C--N 1.328 -0.336 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 176.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.6 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 85.1 Cg_endo -95.18 16.41 39.24 Favored 'Cis proline' 0 C--N 1.351 0.671 0 C-N-CA 124.519 -1.034 . . . . 0.0 113.608 1.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -64.04 -37.06 86.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.591 0.71 . . . . 0.0 109.586 176.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.4 m -111.16 124.73 52.78 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.799 176.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -71.58 144.43 88.73 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.811 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -89.48 -164.44 0.16 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.907 2.405 . . . . 0.0 112.04 177.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -123.89 127.15 47.59 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.6 HG12 ' CZ ' ' A' ' 84' ' ' PHE . 47.6 mt -66.05 115.76 4.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -89.54 112.38 23.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.026 -176.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.523 HG22 HG22 ' A' ' 82' ' ' ILE . 34.0 t -125.28 85.34 58.45 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.804 176.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -73.58 -9.62 22.91 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.795 2.33 . . . . 0.0 112.59 -175.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -73.68 -43.13 60.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.398 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.409 ' O ' HG22 ' A' ' 106' ' ' THR . 90.3 mt -82.36 -30.19 30.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.836 -178.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.502 ' HB2' ' HA2' ' A' ' 113' ' ' GLY . 16.6 t70 -53.66 124.91 16.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.949 178.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 106.37 -27.25 17.55 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.214 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.796 ' HG2' HG11 ' A' ' 158' ' ' VAL . 10.5 mptt -101.25 -42.4 6.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.016 0.436 . . . . 0.0 110.424 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.572 ' HB ' HD21 ' A' ' 153' ' ' LEU . 5.7 t -93.6 155.59 17.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.386 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -126.65 11.95 7.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.073 -179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -86.66 -8.31 57.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.827 0.346 . . . . 0.0 110.638 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.498 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 2.5 ppp? -121.27 -171.86 2.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.265 -176.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -86.37 120.65 27.95 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.006 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -59.87 111.86 1.63 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.83 176.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 148.31 -13.31 1.24 Allowed Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.567 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . 0.502 ' HA2' ' HB2' ' A' ' 103' ' ' ASP . . . 109.61 2.9 30.74 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.856 -0.688 . . . . 0.0 113.014 176.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.16 136.91 43.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.901 0.381 . . . . 0.0 111.056 -178.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 43.4 pt -69.19 162.18 3.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.878 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.498 ' HB2' ' HA ' ' A' ' 109' ' ' MET . 53.1 t -113.63 105.32 13.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.847 0.356 . . . . 0.0 110.345 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.1 mt -93.74 -178.33 4.65 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.842 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.8 t -85.14 158.81 20.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.002 -176.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -75.32 -12.88 60.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.069 0.462 . . . . 0.0 110.741 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 61.1 m-70 -80.79 -12.26 59.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.264 0.554 . . . . 0.0 110.201 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -70.75 -45.18 65.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.346 -172.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.45 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 14.7 mmmm -60.53 -52.23 74.26 Favored Pre-proline 0 C--O 1.236 0.392 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -175.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 26.5 Cg_endo -63.85 -31.87 67.31 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 121.769 1.646 . . . . 0.0 112.205 176.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 47.4 tp -66.1 -45.09 82.42 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.9 0.381 . . . . 0.0 110.171 177.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 41.8 t-105 -56.88 -49.3 75.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.482 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.14 -21.85 65.81 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.727 -176.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -84.64 -35.16 22.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.125 0.488 . . . . 0.0 110.3 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -73.85 -42.43 60.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.076 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.571 HG13 ' HA ' ' A' ' 130' ' ' PRO . 98.7 t -60.28 141.07 91.25 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.571 ' HA ' HG13 ' A' ' 129' ' ' VAL . 65.6 Cg_endo -84.29 -159.47 1.82 Allowed 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 124.909 -0.871 . . . . 0.0 114.061 6.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.592 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 73.7 mmtt 71.36 11.25 6.7 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.631 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -94.65 163.27 13.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.208 0.528 . . . . 0.0 111.742 -171.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -159.43 162.63 32.98 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.064 -0.814 . . . . 0.0 111.064 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.7 tp -60.39 -29.14 68.75 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -173.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.13 -39.12 66.19 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.187 0.518 . . . . 0.0 111.781 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.0 m80 -71.47 -32.48 68.34 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.95 -178.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 49.3 tp -63.28 -44.05 96.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 110.746 -179.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 14.4 mmt -64.11 -52.69 57.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.512 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.08 -34.16 77.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.548 -175.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.1 mt -98.39 -17.9 18.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -174.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -111.72 -64.04 0.49 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.981 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 38.5 tp -63.16 -41.31 99.23 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.625 0.231 . . . . 0.0 111.625 -171.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.95 -61.79 6.98 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.084 -179.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -58.74 -28.69 87.46 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.766 2.311 . . . . 0.0 112.908 177.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 64.7 t90 -72.05 -45.64 60.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.052 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 96.7 mt -60.16 -34.99 74.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.079 0.466 . . . . 0.0 111.16 -178.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.23 -2.81 20.29 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.989 -176.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 60.5 t -92.82 -55.28 6.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -109.82 -12.49 14.59 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.269 0.84 . . . . 0.0 113.269 -170.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.586 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 1.4 mp -55.58 -45.52 99.86 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.689 178.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 11.0 Cg_endo -55.77 -32.36 84.07 Favored 'Trans proline' 0 C--N 1.357 1.02 0 C-N-CA 122.026 1.817 . . . . 0.0 112.73 174.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.604 ' HA ' ' HG2' ' A' ' 155' ' ' GLN . 31.6 t70 -71.29 -36.48 71.68 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 120.589 0.233 . . . . 0.0 110.645 -179.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.572 HD21 ' HB ' ' A' ' 106' ' ' THR . 4.3 mm? -65.7 -31.63 72.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.9 0.381 . . . . 0.0 110.362 176.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 66.0 mt -72.51 -47.11 53.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.616 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.604 ' HG2' ' HA ' ' A' ' 152' ' ' ASP . 13.3 pt20 -71.16 -20.84 62.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.805 0.336 . . . . 0.0 110.723 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -72.68 -32.39 65.77 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.105 0.479 . . . . 0.0 109.762 175.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 99.58 10.08 48.29 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.775 -0.726 . . . . 0.0 113.176 177.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . 0.796 HG11 ' HG2' ' A' ' 105' ' ' LYS . 42.1 t -91.62 -14.06 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.356 0.598 . . . . 0.0 110.485 -178.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.401 HG12 ' HB3' ' A' ' 153' ' ' LEU . 37.4 mm -84.07 111.89 20.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.139 176.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -84.98 118.13 24.37 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.257 -178.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . 0.551 ' HE1' HD22 ' A' ' 76' ' ' LEU . 82.2 t60 -75.52 120.38 20.86 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.93 0.395 . . . . 0.0 111.315 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -102.25 -71.56 0.71 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.562 176.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -155.95 162.49 40.36 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.582 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.97 -79.01 0.5 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.977 0.418 . . . . 0.0 111.064 -178.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 64.5 m -100.79 139.67 36.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.696 -176.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -100.73 6.57 43.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.092 0.472 . . . . 0.0 109.963 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 12.7 tp60 -143.53 170.41 15.88 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -177.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.471 ' H ' HD12 ' A' ' 168' ' ' LEU . 5.4 mp -70.94 152.64 43.42 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 178.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . 0.437 ' CD ' ' H ' ' A' ' 169' ' ' GLU . 0.7 OUTLIER -70.41 146.8 50.13 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.903 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -158.13 -178.39 7.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.713 0.292 . . . . 0.0 110.99 -173.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -74.03 142.75 45.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.408 -177.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 16.0 m170 -95.42 141.29 29.14 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -177.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -109.6 85.42 2.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.943 0.401 . . . . 0.0 110.901 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -175.62 165.29 3.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.165 177.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 18.1 p80 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.147 -0.93 . . . . 0.0 109.975 -179.789 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.481 1.104 0 CA-C-O 120.806 0.336 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.3 -156.0 0.62 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.135 -179.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -76.12 159.02 31.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.865 0.364 . . . . 0.0 110.094 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -66.82 -37.98 85.56 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.478 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -59.14 -34.29 71.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.339 176.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.426 ' O ' HG23 ' A' ' 10' ' ' VAL . 7.4 m -58.53 -50.38 73.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.979 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -72.92 -25.28 60.99 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.042 -0.263 . . . . 0.0 111.136 -177.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -69.98 -43.74 70.83 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 5' ' ' ALA . 73.8 t -58.37 -44.99 89.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.613 177.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 6' ' ' THR . 50.5 t -67.04 -24.21 31.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.183 0.516 . . . . 0.0 110.815 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t -80.01 -43.1 22.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.657 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.595 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 42.5 mt-10 -75.45 -27.27 58.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.844 0.354 . . . . 0.0 110.94 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 47.9 mt -104.92 89.19 2.73 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.235 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.595 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 33.1 Cg_exo -59.23 165.06 9.55 Favored 'Trans proline' 0 N--CA 1.475 0.385 0 C-N-CA 123.538 2.826 . . . . 0.0 113.811 -173.102 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.474 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 30.3 m -83.59 162.42 3.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.166 178.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.569 HD21 ' HB2' ' A' ' 35' ' ' GLU . 7.0 mp -93.44 134.55 35.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.407 177.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -36.61 74.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.702 0.287 . . . . 0.0 111.293 -176.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.46 ' O ' ' HG3' ' A' ' 31' ' ' ARG . 6.2 p -107.61 139.67 41.8 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.725 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -132.56 77.11 1.73 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.409 0.623 . . . . 0.0 109.547 176.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -115.86 174.68 5.9 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.276 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.29 -179.69 23.15 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.331 -174.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -69.29 2.39 3.31 Favored 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 123.015 2.477 . . . . 0.0 112.847 -178.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.403 ' HD2' HG23 ' A' ' 88' ' ' ILE . 26.3 mtp-105 -74.76 -44.68 48.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.617 0.722 . . . . 0.0 109.775 176.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.54 ' HB3' HD23 ' A' ' 27' ' ' LEU . 11.8 m-20 -94.62 101.54 13.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.653 -1.158 . . . . 0.0 109.925 -174.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.565 ' O ' HG23 ' A' ' 29' ' ' VAL . 60.2 mtm180 -57.63 -52.84 63.76 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -170.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.6 -41.6 92.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.049 0.452 . . . . 0.0 110.902 -175.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.54 HD23 ' HB3' ' A' ' 24' ' ' ASP . 3.3 mm? -67.63 -34.46 77.02 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.976 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.588 ' CH2' HG21 ' A' ' 86' ' ' ILE . 76.4 t-105 -67.66 -43.35 80.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.406 177.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 25' ' ' ARG . 84.1 t -61.09 -47.21 94.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 O-C-N 123.186 0.304 . . . . 0.0 111.501 -178.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.491 ' HA ' ' HG2' ' A' ' 33' ' ' LYS . 3.8 pt20 -72.03 -32.49 67.17 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.72 -178.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 18' ' ' THR . 18.8 ttp85 -66.22 -39.8 89.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.55 0.691 . . . . 0.0 109.301 174.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -63.69 -47.69 80.16 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.192 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.491 ' HG2' ' HA ' ' A' ' 30' ' ' GLN . 19.4 ptpt -64.38 -38.42 90.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.672 0.272 . . . . 0.0 111.204 -178.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 12.7 mm-40 -69.54 -32.52 71.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.018 0.437 . . . . 0.0 110.366 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.569 ' HB2' HD21 ' A' ' 16' ' ' LEU . 37.6 tt0 -70.59 -35.98 73.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.435 176.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.42 ' O ' HG13 ' A' ' 40' ' ' ILE . 4.5 m-30 -59.71 -49.14 78.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.74 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -59.4 -41.46 89.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.943 0.401 . . . . 0.0 110.602 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.5 t -58.33 -44.8 88.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.346 177.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.453 ' O ' HG23 ' A' ' 43' ' ' VAL . 88.1 mt -64.16 -52.64 58.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.274 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 36' ' ' TYR . 86.3 mt -54.58 -41.45 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.473 -176.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -56.8 -45.98 81.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.938 0.399 . . . . 0.0 110.85 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -73.56 -35.71 65.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.672 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 39' ' ' LEU . 80.9 t -62.68 -45.95 97.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.993 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -34.27 75.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.193 -179.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -60.88 -44.43 97.09 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 174.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.527 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 62.0 m-20 -63.55 -36.97 85.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.837 177.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -60.97 -49.68 76.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.727 0.299 . . . . 0.0 110.712 177.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.97 -41.06 95.64 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.264 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -86.09 5.9 31.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.757 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 56.03 33.2 21.38 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 122.127 0.965 . . . . 0.0 109.816 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -117.66 24.85 10.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.068 -175.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.527 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 29.9 t70 -67.5 100.14 0.83 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.973 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 58.5 p-90 -114.33 2.93 14.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.282 -173.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -162.29 169.6 20.37 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.554 -178.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -160.99 124.33 3.32 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.3 168.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.536 HD13 ' HA3' ' A' ' 67' ' ' GLY . 3.4 mm? -90.24 123.99 34.5 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.304 -178.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -110.22 147.17 34.3 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 176.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.7 p -128.94 157.1 42.58 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-O 120.981 0.419 . . . . 0.0 111.31 -171.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -79.31 168.56 19.36 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 172.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -57.1 -49.33 76.23 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -174.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -68.76 -19.54 64.33 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.849 0.357 . . . . 0.0 111.551 178.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.43 16.49 80.32 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.774 -174.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.5 p -88.46 -39.55 14.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.171 0.51 . . . . 0.0 111.078 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -101.57 128.46 47.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.075 174.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 54.9 m95 -116.04 145.15 43.23 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.011 176.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -152.36 86.06 1.28 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.688 0.756 . . . . 0.0 109.674 -177.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.536 ' HA3' HD13 ' A' ' 56' ' ' LEU . . . -104.8 146.55 16.14 Favored Glycine 0 N--CA 1.439 -1.104 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.074 -176.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 81' ' ' ASP . 1.5 ptpp? -100.18 130.93 46.37 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 54.8 m -131.48 127.99 38.47 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.089 -177.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.726 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 8.2 p90 -119.32 138.51 52.99 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.07 0.462 . . . . 0.0 110.948 -177.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -117.54 120.45 38.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.786 -178.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.446 ' N ' HD12 ' A' ' 72' ' ' ILE . 4.1 mp -91.39 121.03 41.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.996 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 61.1 t60 -147.97 124.6 11.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.011 175.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.1 t70 59.95 50.13 7.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.034 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.4 mt 74.46 -33.43 0.25 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 114.767 -1.106 . . . . 0.0 112.642 178.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 51.1 mt -76.0 139.61 41.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.038 0.447 . . . . 0.0 111.548 -178.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -121.38 106.86 11.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.966 177.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.419 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 79.9 m-85 -96.26 121.53 38.15 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.255 178.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.726 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 0.0 OUTLIER -108.38 135.83 49.03 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.418 0.628 . . . . 0.0 111.208 -179.903 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -128.41 120.25 26.55 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.158 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.42 ' HA ' ' HA ' ' A' ' 68' ' ' LYS . 2.4 m-20 -78.24 119.12 21.17 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 171.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.4 pt -114.46 130.31 69.01 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.337 0.589 . . . . 0.0 110.416 -179.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -120.06 149.4 42.24 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.538 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.608 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 45.7 p90 -158.14 162.8 37.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.338 0.589 . . . . 0.0 110.934 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -106.64 154.78 20.43 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.176 -177.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.588 HG21 ' CH2' ' A' ' 28' ' ' TRP . 43.7 mm -104.19 90.46 3.13 Favored Pre-proline 0 C--N 1.324 -0.517 0 C-N-CA 122.734 0.413 . . . . 0.0 110.676 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -70.99 175.9 8.46 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.797 2.332 . . . . 0.0 112.182 -177.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.403 HG23 ' HD2' ' A' ' 23' ' ' ARG . 51.6 mm -68.47 -22.66 27.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.147 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.63 -13.74 61.05 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.219 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.497 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 63.5 t80 -87.47 143.75 34.61 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.497 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 23.0 Cg_endo -96.34 26.17 20.36 Favored 'Cis proline' 0 N--CA 1.457 -0.664 0 C-N-CA 124.825 -0.906 . . . . 0.0 112.883 0.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.1 m -69.57 -34.99 74.95 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.528 0.68 . . . . 0.0 110.129 178.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -131.32 145.64 51.95 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.16 175.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.12 144.3 99.02 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.437 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -80.61 161.08 22.03 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.79 2.327 . . . . 0.0 112.342 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -93.17 101.56 13.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.24 0.543 . . . . 0.0 110.537 -177.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.608 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 63.2 mt -72.38 136.72 25.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.783 -177.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -102.28 116.66 33.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.788 0.328 . . . . 0.0 110.864 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.442 ' HA ' ' HD2' ' A' ' 100' ' ' PRO . 5.8 p -124.04 87.74 53.05 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-O 121.889 0.852 . . . . 0.0 110.659 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 99' ' ' VAL . 18.8 Cg_endo -59.97 -36.35 90.3 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 123.287 2.658 . . . . 0.0 114.056 -172.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -82.65 17.87 1.7 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -171.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.464 ' O ' HG22 ' A' ' 106' ' ' THR . 42.3 mt -106.09 -15.69 14.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.274 0.559 . . . . 0.0 109.751 169.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.68 144.01 54.57 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.101 -176.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 77.74 -8.64 34.5 Favored Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.601 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 27.9 mtmm -117.22 -48.92 2.61 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.71 -0.288 . . . . 0.0 111.473 -176.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 102' ' ' LEU . 14.1 t -94.98 166.05 12.14 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -148.0 168.8 21.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.827 -177.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 108' ' ' LYS . 39.3 tttm 65.71 8.9 5.54 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.788 0.68 . . . . 0.0 110.89 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.495 ' SD ' ' HA ' ' A' ' 115' ' ' ILE . 9.2 tmm? -113.77 3.55 15.58 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.865 -174.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 66.2 t80 64.17 95.55 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.557 0.694 . . . . 0.0 110.109 -174.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.1 24.26 1.36 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.873 -172.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -83.89 41.51 2.97 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.901 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 68.77 26.87 74.28 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 121.174 -0.536 . . . . 0.0 112.767 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -141.44 -171.9 3.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.495 ' HA ' ' SD ' ' A' ' 109' ' ' MET . 46.3 pt -123.7 152.36 28.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.891 0.377 . . . . 0.0 111.115 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.8 t -112.09 111.06 21.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.473 173.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.35 165.32 20.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.604 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.402 ' HB ' ' CB ' ' A' ' 121' ' ' PHE . 2.7 m -55.1 133.67 48.96 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.856 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -56.91 -49.42 75.62 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -172.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -79.03 -15.43 58.25 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.991 -0.284 . . . . 0.0 111.703 -177.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.402 ' CB ' ' HB ' ' A' ' 118' ' ' THR . 85.9 t80 -71.37 -33.69 69.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.134 0.493 . . . . 0.0 110.145 179.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.614 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 54.0 mtpt -59.88 -51.22 82.28 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.427 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.614 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 25.9 Cg_exo -64.63 -35.62 46.33 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.761 1.641 . . . . 0.0 111.862 171.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.5 tp -59.6 -37.34 78.3 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.881 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.508 ' O ' HG23 ' A' ' 129' ' ' VAL . 48.0 t-105 -54.83 -50.44 68.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.417 176.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -65.21 -18.31 65.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.708 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -83.78 -20.4 33.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.005 0.431 . . . . 0.0 110.894 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -104.07 10.1 36.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.797 -178.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 125' ' ' TRP . 94.9 t -93.79 139.69 22.79 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 174.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.414 ' HA ' HG13 ' A' ' 129' ' ' VAL . 69.5 Cg_endo -95.98 -154.7 0.35 Allowed 'Cis proline' 0 N--CA 1.456 -0.677 0 C-N-CA 124.165 -1.181 . . . . 0.0 113.49 1.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.474 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 54.8 mtmt 71.99 12.06 6.07 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.834 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -90.51 177.44 6.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.073 176.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -169.35 172.56 43.52 Favored Glycine 0 C--O 1.236 0.236 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.243 -176.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 45.1 tp -60.41 -36.15 77.46 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.815 0.446 . . . . 0.0 111.66 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.52 -41.78 73.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.29 0.567 . . . . 0.0 111.124 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -71.84 -34.86 69.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.536 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 69.3 tp -67.3 -41.14 85.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.19 -178.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 24.7 mmt -69.05 -40.68 78.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.82 0.343 . . . . 0.0 111.017 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.07 -47.37 62.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.766 -177.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 86.9 mt -84.34 -29.1 26.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.005 0.431 . . . . 0.0 111.419 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.432 ' O ' ' HB2' ' A' ' 145' ' ' TRP . . . -96.41 -77.93 1.38 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.852 -0.689 . . . . 0.0 113.092 -176.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.8 tp -55.07 -47.92 74.22 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -170.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.6 -63.15 5.48 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.995 -0.621 . . . . 0.0 113.522 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.6 -27.31 53.4 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.42 2.08 . . . . 0.0 112.085 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . 0.466 ' HZ2' ' SD ' ' A' ' 109' ' ' MET . 56.6 t90 -62.2 -45.05 95.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.74 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 96.4 mt -67.37 -34.18 76.75 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.132 0.492 . . . . 0.0 110.549 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.97 -5.05 36.08 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.954 -176.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 84.7 t -70.26 -55.13 15.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.489 ' O ' HD23 ' A' ' 153' ' ' LEU . 0.0 OUTLIER -135.08 -12.82 2.16 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -174.709 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.552 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 32.1 mm -55.76 -50.66 85.83 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-N 118.059 0.39 . . . . 0.0 111.836 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.3 Cg_endo -53.58 -34.75 74.36 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 122.203 1.935 . . . . 0.0 112.533 177.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -78.22 -39.31 40.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.771 -177.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.489 HD23 ' O ' ' A' ' 149' ' ' GLU . 4.0 mm? -58.35 -37.78 75.87 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.705 177.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 71.7 mt -63.02 -47.19 93.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.685 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.45 ' HG3' ' O ' ' A' ' 151' ' ' PRO . 22.3 mt-30 -68.46 -27.92 66.58 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.774 -178.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -63.85 -27.43 69.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.432 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 87.13 6.24 79.06 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.846 176.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.9 p -78.45 -26.61 14.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.294 0.569 . . . . 0.0 110.386 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 54.7 mt -83.49 138.52 19.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.0 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -59.72 113.31 2.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.173 0.511 . . . . 0.0 110.34 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -125.0 131.03 53.48 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.028 -172.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -165.72 171.52 12.85 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.694 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 65.18 41.96 4.25 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.851 0.719 . . . . 0.0 112.913 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 36.9 mtmt -96.53 -53.45 3.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.513 0.673 . . . . 0.0 109.473 172.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 62.2 m -95.39 50.74 1.26 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.385 -173.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -72.28 -51.04 22.67 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 173.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -178.9 135.91 0.14 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.057 -1.429 . . . . 0.0 108.018 178.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.87 91.84 3.58 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.623 0.725 . . . . 0.0 110.234 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.47 160.02 29.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.966 -175.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -139.45 122.84 17.15 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.904 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -82.05 130.35 35.06 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.239 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 69.6 t60 -64.75 125.01 23.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.504 -175.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 43.0 t-80 -84.26 116.86 23.19 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.954 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 33.6 p80 -83.21 165.32 19.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.071 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 24.5 p80 . . . . . 0 C--O 1.247 0.927 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.006 177.388 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tmt? . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 120.669 0.271 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.09 -29.38 61.82 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -173.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.454 ' O ' ' HG3' ' A' ' 7' ' ' ARG . 33.6 t70 -88.84 7.46 34.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.005 0.431 . . . . 0.0 110.775 -174.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.455 ' OE2' ' HD2' ' A' ' 8' ' ' ARG . 7.4 tm-20 -53.9 -48.7 69.87 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.816 -178.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.446 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -59.55 -45.93 90.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.768 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.2 m -59.78 -55.44 34.21 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.095 0.474 . . . . 0.0 111.297 -175.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -68.99 -22.04 64.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.292 -177.354 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.455 ' HD2' ' OE2' ' A' ' 4' ' ' GLU . 21.6 ttt180 -71.16 -39.23 72.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.377 178.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 5' ' ' ALA . 99.4 t -63.73 -43.37 97.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.196 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.9 t -60.32 -39.13 79.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.398 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.3 m -61.86 -37.78 85.78 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -177.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -88.11 8.58 26.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.836 0.351 . . . . 0.0 111.475 -177.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 54.1 mt -121.87 86.93 46.35 Favored Pre-proline 0 C--O 1.237 0.404 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 172.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -48.85 146.29 11.88 Favored 'Trans proline' 0 C--O 1.238 0.484 0 C-N-CA 123.674 2.916 . . . . 0.0 114.047 -173.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.431 ' HB ' ' O ' ' A' ' 131' ' ' LYS . 33.0 m -81.04 162.79 3.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.611 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' A' ' 35' ' ' GLU . 10.0 mp -96.19 146.15 24.93 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.814 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -75.03 -39.54 60.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.41 -176.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.606 HG21 HD12 ' A' ' 27' ' ' LEU . 62.8 m -124.02 128.48 49.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.735 -173.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -91.71 118.36 30.59 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 173.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -161.2 156.75 24.67 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.578 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -113.29 -164.55 15.85 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.65 177.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.91 5.69 2.86 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.78 2.32 . . . . 0.0 113.232 -176.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 51.6 mtm180 -70.74 -62.67 1.3 Allowed 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -84.33 97.87 9.7 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.666 HH22 ' HG2' ' A' ' 61' ' ' GLU . 15.1 mtp180 -63.26 -33.2 74.99 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.213 -173.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -70.93 -50.73 31.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.558 0.218 . . . . 0.0 111.034 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.606 HD12 HG21 ' A' ' 18' ' ' THR . 4.3 mm? -66.91 -28.74 68.55 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.218 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.575 ' CH2' HG21 ' A' ' 86' ' ' ILE . 72.0 t-105 -60.53 -45.48 93.7 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.889 172.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 25' ' ' ARG . 70.2 t -61.07 -42.9 94.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.231 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.423 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 12.1 mt-30 -58.19 -53.92 52.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.388 179.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 28' ' ' TRP . 0.0 OUTLIER -67.34 -28.75 68.23 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.737 -179.841 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.4 tp -62.59 -46.56 87.76 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 8.4 mtpm? -56.46 -58.81 6.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.056 176.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 18.3 mm-40 -62.13 -39.31 92.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.523 -174.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.775 ' HB2' HD21 ' A' ' 16' ' ' LEU . 39.6 tt0 -67.36 -38.29 84.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.389 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.548 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.1 m-85 -64.17 -30.45 71.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.527 176.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 90.2 mm-40 -68.3 -42.59 79.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.141 176.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.3 m -61.23 -39.72 91.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.984 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.511 HD12 ' HA ' ' A' ' 36' ' ' TYR . 76.6 mt -60.66 -49.35 77.85 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.884 177.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 36' ' ' TYR . 84.3 mt -51.98 -44.7 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 120.79 0.329 . . . . 0.0 110.603 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.516 ' O ' ' HB2' ' A' ' 45' ' ' ASN . 18.6 tpt180 -58.71 -51.18 71.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.222 177.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -66.62 -42.93 86.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.648 0.261 . . . . 0.0 111.066 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 39' ' ' LEU . 94.8 t -61.83 -47.85 91.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.548 179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -63.57 -42.86 98.29 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.528 0.68 . . . . 0.0 109.705 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' A' ' 41' ' ' ARG . 1.0 OUTLIER -53.77 -49.29 68.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.398 178.202 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -69.7 -43.25 72.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.439 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -66.49 -43.84 84.28 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -177.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.401 ' ND2' ' HA ' ' A' ' 45' ' ' ASN . 2.9 p30 -70.98 -23.85 62.29 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.987 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.52 8.41 7.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.732 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.533 ' HB3' ' CD2' ' A' ' 172' ' ' HIS . 27.4 t0 62.77 41.39 9.03 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.597 0.713 . . . . 0.0 110.515 177.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -141.52 87.44 2.07 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.508 174.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -101.46 101.81 12.48 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.55 ' HA ' ' CD1' ' A' ' 70' ' ' TRP . 52.6 p-90 -123.72 -1.37 8.46 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -173.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -154.21 158.16 39.88 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.96 -172.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.89 130.34 2.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.977 168.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.3 tp -124.53 131.47 53.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.427 -173.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -126.26 175.95 7.44 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.949 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.0 m -154.46 166.96 31.62 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.729 0.299 . . . . 0.0 110.826 -178.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.431 HD21 ' HB2' ' A' ' 64' ' ' ARG . 6.9 p30 -79.54 172.37 13.88 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 169.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -64.31 -26.04 68.31 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -174.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.666 ' HG2' HH22 ' A' ' 25' ' ' ARG . 37.4 mt-10 -80.25 -23.53 40.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.87 0.367 . . . . 0.0 110.834 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.69 17.91 73.48 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.962 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -86.11 -6.54 58.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.227 0.536 . . . . 0.0 110.969 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.431 ' HB2' HD21 ' A' ' 59' ' ' ASN . 50.5 mtm180 -142.0 120.77 12.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.469 176.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 24.9 m95 -106.11 130.06 54.08 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -146.45 137.76 24.45 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.274 0.559 . . . . 0.0 110.527 -175.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.93 -152.63 6.77 Favored Glycine 0 N--CA 1.442 -0.933 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.158 -178.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.691 ' HD3' ' CZ3' ' A' ' 70' ' ' TRP . 34.9 tttp -143.02 143.16 31.78 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -177.206 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.6 p -144.84 148.42 33.96 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.691 ' CZ3' ' HD3' ' A' ' 68' ' ' LYS . 0.7 OUTLIER -138.29 151.38 47.54 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.939 0.4 . . . . 0.0 110.902 179.119 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -117.71 138.09 52.25 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.383 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.2 mm -107.22 123.99 62.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.186 -176.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -159.5 123.17 3.73 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.393 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 57.26 55.55 5.79 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.809 0.693 . . . . 0.0 112.057 177.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.643 HD13 ' HA ' ' A' ' 168' ' ' LEU . 3.7 mm? 69.46 1.64 3.4 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.789 175.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 76.8 mt -107.18 138.14 43.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.085 0.469 . . . . 0.0 111.509 -174.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.1 ttmm -119.57 109.0 15.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.246 175.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -107.04 116.0 31.16 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.608 ' HB2' ' HE3' ' A' ' 68' ' ' LYS . 0.1 OUTLIER -105.29 144.97 31.33 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.253 0.549 . . . . 0.0 111.519 -177.215 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -135.04 151.09 50.46 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.335 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.71 118.66 37.12 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 30.0 pt -113.31 147.04 17.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.63 0 CA-C-O 121.109 0.481 . . . . 0.0 111.187 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -150.69 153.06 34.9 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.242 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.601 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 39.1 p90 -158.27 155.46 28.92 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.406 176.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.474 ' O ' ' HB3' ' A' ' 95' ' ' PRO . 7.8 p-10 -95.06 156.86 16.14 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.015 -176.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.575 HG21 ' CH2' ' A' ' 28' ' ' TRP . 46.8 mm -109.76 90.43 9.07 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.988 175.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 11.7 Cg_endo -53.62 155.31 13.8 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.932 2.421 . . . . 0.0 112.751 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 39.6 mm -67.75 -21.12 26.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.515 0.674 . . . . 0.0 110.031 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.1 p -85.71 10.55 13.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.89 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.533 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 51.6 t80 -72.64 145.54 87.37 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.533 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 95.3 Cg_endo -94.75 11.99 46.46 Favored 'Cis proline' 0 C--N 1.35 0.608 0 C-N-CA 124.318 -1.117 . . . . 0.0 113.328 -0.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 23.7 m -62.75 -31.22 72.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.488 0.661 . . . . 0.0 110.304 178.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 32.0 m -114.01 134.18 55.02 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.016 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.407 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -75.49 145.05 78.65 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.454 -178.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.474 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 19.3 Cg_exo -66.7 151.79 81.92 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.156 2.57 . . . . 0.0 112.395 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -93.34 100.48 12.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.353 -178.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.601 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.4 mt -71.97 121.67 22.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.815 -178.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -118.71 125.47 49.74 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.106 0.479 . . . . 0.0 111.114 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 24.3 t -118.32 87.2 29.44 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.428 175.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.74 -25.21 74.9 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 123.288 2.659 . . . . 0.0 113.761 -172.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.03 -17.86 60.92 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.88 -43.59 95.61 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 38.6 t70 55.06 26.35 8.04 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.825 0.703 . . . . 0.0 112.127 170.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 68.56 16.1 69.28 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.961 -0.637 . . . . 0.0 113.045 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.503 ' HB2' ' NZ ' ' A' ' 105' ' ' LYS . 4.6 ttmp? -76.16 -18.03 59.29 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.001 0.429 . . . . 0.0 110.783 -178.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.426 ' OG1' HD11 ' A' ' 153' ' ' LEU . 2.9 t -86.21 -165.22 1.19 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.982 -177.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -66.99 -154.8 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.74 0.305 . . . . 0.0 111.738 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -54.99 112.16 0.99 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 121.582 0.706 . . . . 0.0 111.562 -177.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 24.9 ttt -126.13 170.02 12.22 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.376 -173.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -96.1 -170.86 2.19 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? -60.13 135.93 57.87 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.042 0.448 . . . . 0.0 111.638 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 62.43 -126.6 38.16 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.493 -0.776 . . . . 0.0 113.122 175.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -112.33 16.74 24.42 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.215 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.1 mtpp -76.73 120.81 22.42 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 47.6 pt -75.64 155.15 6.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.959 0.409 . . . . 0.0 110.811 -178.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 7.9 p -97.54 114.85 26.83 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.009 -178.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.8 mt -100.12 142.56 31.43 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 174.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.5 t -71.1 156.31 39.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.075 0.464 . . . . 0.0 111.261 -176.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -66.48 -42.93 86.76 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -172.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.445 ' C ' ' HD2' ' A' ' 123' ' ' PRO . 12.6 m-70 -62.25 -14.68 40.92 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -178.224 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -66.87 -33.92 76.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.952 0.406 . . . . 0.0 110.141 176.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.641 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 37.9 mtpt -62.7 -52.39 65.04 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.073 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.641 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 31.2 Cg_exo -59.74 -35.56 94.17 Favored 'Trans proline' 0 C--N 1.359 1.096 0 C-N-CA 121.697 1.598 . . . . 0.0 112.028 173.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 59.1 tp -63.55 -44.54 93.89 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.551 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.406 ' O ' HG23 ' A' ' 129' ' ' VAL . 47.3 t-105 -57.94 -57.46 12.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.894 178.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.72 -29.96 71.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.719 -176.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 13.3 ttm180 -64.53 -30.94 71.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.221 -178.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -102.14 16.48 25.98 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.336 -174.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 125' ' ' TRP . 93.9 t -106.49 134.46 19.79 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 172.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -83.27 -162.77 2.93 Favored 'Cis proline' 0 C--N 1.347 0.45 0 C-N-CA 124.208 -1.164 . . . . 0.0 114.001 3.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.431 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 68.1 mttm 74.67 7.73 4.39 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.441 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -89.99 175.47 7.17 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 177.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -164.9 155.37 26.73 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.107 -177.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.42 HD21 ' CE2' ' A' ' 84' ' ' PHE . 43.3 tp -65.4 -30.98 71.85 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 122.78 0.432 . . . . 0.0 111.068 -175.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.45 ' O ' ' HG2' ' A' ' 138' ' ' MET . . . -56.81 -33.02 66.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.411 0.624 . . . . 0.0 110.936 176.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -71.46 -32.25 68.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.367 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.6 tp -67.44 -40.13 85.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.258 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' A' ' 135' ' ' ALA . 23.5 ptp -72.09 -36.54 69.52 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.866 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -75.07 -45.69 39.71 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 88.6 mt -93.97 -23.72 17.94 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -174.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -101.17 -65.83 0.79 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.851 -177.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 50.6 tp -59.26 -57.14 14.33 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -173.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.82 -61.98 6.32 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-N 116.156 -0.475 . . . . 0.0 113.819 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . 0.43 ' O ' HG23 ' A' ' 148' ' ' VAL . 53.2 Cg_exo -57.29 -35.07 98.85 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.717 2.278 . . . . 0.0 113.137 -179.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 45.9 t90 -64.31 -49.58 71.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.058 0.456 . . . . 0.0 109.917 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 94.6 mt -64.39 -32.31 73.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.8 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.22 -12.57 60.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.993 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 144' ' ' PRO . 67.2 t -88.57 -56.14 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.672 0.272 . . . . 0.0 110.916 178.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . 0.529 ' O ' ' HG ' ' A' ' 153' ' ' LEU . 7.7 mm-40 -80.49 -52.79 7.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -173.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.614 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 48.9 mm -55.21 -54.46 50.34 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -170.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.614 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 31.6 Cg_exo -60.4 -33.76 93.89 Favored 'Trans proline' 0 C--N 1.354 0.84 0 C-N-CA 121.99 1.793 . . . . 0.0 112.314 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -75.03 -43.49 53.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.331 -177.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 149' ' ' GLU . 23.3 mt -56.98 -34.58 68.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.247 178.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 150' ' ' ILE . 73.0 mt -62.59 -49.59 83.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.552 177.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -68.96 -34.43 75.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.489 -177.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -73.83 -16.95 61.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.879 0.371 . . . . 0.0 111.054 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.14 24.62 47.45 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.215 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 51.4 t -83.17 -33.29 10.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.557 0.694 . . . . 0.0 109.294 178.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 72.8 mt -93.21 122.59 44.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.241 174.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -59.88 105.1 0.35 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 123.57 0.544 . . . . 0.0 111.085 -176.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -108.28 84.05 1.88 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.316 0.579 . . . . 0.0 111.024 -179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm -86.22 18.45 3.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.62 -178.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 61.88 60.95 1.47 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.527 176.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -75.91 -34.21 59.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.825 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 61.1 m 59.61 102.14 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.348 0.594 . . . . 0.0 112.304 175.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -102.62 -62.93 1.21 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.826 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.425 HE21 ' HB3' ' A' ' 167' ' ' GLN . 3.0 pt20 -140.5 157.87 44.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.559 -178.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.643 ' HA ' HD13 ' A' ' 75' ' ' LEU . 7.1 mp -90.71 166.25 13.24 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.189 -174.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -72.63 121.18 19.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.558 178.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 20.1 p-80 -125.96 119.38 27.59 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.131 0.491 . . . . 0.0 110.584 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -89.35 144.12 26.31 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.79 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . 0.533 ' CD2' ' HB3' ' A' ' 50' ' ' ASP . 25.1 m80 -87.32 153.64 21.31 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.531 -176.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 10.3 p-80 -56.57 136.23 54.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.071 0.463 . . . . 0.0 110.618 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -102.15 164.9 11.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.948 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 . . . . . 0 C--O 1.245 0.839 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.189 177.619 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptp . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.435 0.159 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.27 158.95 26.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.64 0.257 . . . . 0.0 110.691 178.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -86.02 -16.38 38.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.301 0.572 . . . . 0.0 110.786 -176.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.443 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 45.0 mt-10 -69.88 -44.86 68.91 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.84 -177.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -65.01 -41.31 95.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.059 0.457 . . . . 0.0 110.179 175.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.438 ' O ' HG23 ' A' ' 10' ' ' VAL . 22.6 m -62.76 -46.25 88.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.182 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 4' ' ' GLU . 11.6 ptp180 -66.77 -29.68 69.69 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.117 -176.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.5 ttm180 -62.6 -47.98 81.41 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.42 ' O ' HG13 ' A' ' 13' ' ' ILE . 58.5 t -57.34 -46.36 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.721 178.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 6' ' ' THR . 67.5 t -60.16 -36.9 70.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.183 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.4 m -76.08 -37.99 57.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.73 -176.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -82.37 8.58 11.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.201 0.524 . . . . 0.0 110.593 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.457 HG12 ' HB2' ' A' ' 42' ' ' TYR . 71.1 mt -114.2 89.56 17.66 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.387 171.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -40.04 143.04 0.49 Allowed 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.268 3.312 . . . . 0.0 114.202 -175.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.8 m -83.23 162.85 3.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.732 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.827 HD21 ' HB3' ' A' ' 35' ' ' GLU . 6.8 mp -95.96 134.77 38.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.68 -177.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -86.32 -30.84 21.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.275 0.559 . . . . 0.0 109.868 174.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 27.5 m -96.83 125.89 41.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.29 -176.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -132.04 104.2 6.69 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.129 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -149.76 173.65 13.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.019 -178.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.94 166.16 17.75 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.112 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -66.86 -1.87 6.77 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 123.322 2.682 . . . . 0.0 113.327 -177.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -72.48 -18.23 61.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.583 0.23 . . . . 0.0 111.471 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -116.6 112.19 20.94 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 175.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 29' ' ' VAL . 48.8 mtt180 -58.57 -51.48 69.71 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -173.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -72.62 -35.89 67.94 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.379 -0.528 . . . . 0.0 111.667 -173.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.05 -34.32 75.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.991 0.424 . . . . 0.0 110.207 174.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.415 ' O ' HD23 ' A' ' 32' ' ' LEU . 44.9 t-105 -66.01 -48.08 72.34 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.878 176.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 25' ' ' ARG . 80.0 t -63.2 -35.95 74.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 178.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.528 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 5.9 tt0 -66.94 -39.05 87.21 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.925 178.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.508 HH12 ' HG3' ' A' ' 91' ' ' PRO . 25.2 ttt85 -68.61 -38.28 80.45 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.17 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.585 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 1.7 mm? -52.68 -51.97 57.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.476 176.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 18.7 ptpt -67.52 -25.53 65.88 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.621 0.248 . . . . 0.0 111.132 -179.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.528 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 28.3 mm-40 -64.47 -62.53 1.54 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.766 175.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.827 ' HB3' HD21 ' A' ' 16' ' ' LEU . 12.1 pt-20 -73.1 -26.02 61.09 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.332 -177.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.585 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -52.42 -45.81 66.1 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 169.092 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.3 mm-40 -61.01 -42.4 98.37 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.524 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.8 m -59.03 -45.04 91.72 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.445 176.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.428 ' O ' HG23 ' A' ' 43' ' ' VAL . 77.7 mt -60.47 -55.45 33.36 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.798 178.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 79.9 mt -60.26 -39.24 80.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.049 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' A' ' 41' ' ' ARG . 6.9 tpp85 -66.69 -41.22 88.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.647 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.457 ' HB2' HG12 ' A' ' 13' ' ' ILE . 86.5 t80 -66.27 -44.77 82.66 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.091 177.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 39' ' ' LEU . 92.3 t -59.76 -38.62 76.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.329 176.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -57.13 -59.87 4.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.263 0.554 . . . . 0.0 110.061 176.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -58.8 -35.49 72.93 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.356 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -68.45 -46.1 70.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.461 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -67.29 -28.52 68.08 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.148 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -67.64 -14.28 62.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.89 0.376 . . . . 0.0 110.89 177.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -101.34 14.88 30.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.216 174.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.6 t70 70.54 5.83 5.55 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.504 0.721 . . . . 0.0 111.487 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.507 ' OD1' ' HD1' ' A' ' 53' ' ' TRP . 23.7 t-20 -102.28 142.37 33.62 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.862 -0.524 . . . . 0.0 110.984 -176.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -158.09 111.43 2.44 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.507 ' HD1' ' OD1' ' A' ' 51' ' ' ASN . 56.1 p-90 -130.04 -3.03 4.55 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -172.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.4 ' HZ ' ' HD2' ' A' ' 42' ' ' TYR . 10.8 p90 -152.42 156.52 39.67 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.072 -0.651 . . . . 0.0 111.67 -174.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -161.92 126.79 3.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.565 171.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.543 HD13 ' HA3' ' A' ' 67' ' ' GLY . 3.8 mm? -100.54 130.38 46.6 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.242 -174.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -120.83 160.41 23.47 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 172.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.8 p -154.34 174.9 14.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 120.964 0.411 . . . . 0.0 111.163 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -83.04 170.73 14.54 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 172.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -65.65 -24.89 67.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.681 0.276 . . . . 0.0 111.544 -176.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -71.4 -24.72 62.11 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.805 0.336 . . . . 0.0 110.686 176.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.67 23.53 77.91 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.539 -0.625 . . . . 0.0 111.539 -176.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.2 p -95.2 -39.23 10.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.139 0.495 . . . . 0.0 111.397 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.1 mmt-85 -110.12 116.82 32.23 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.25 177.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 39.1 m95 -110.34 133.93 52.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.346 178.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -129.84 128.56 42.53 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.072 176.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.543 ' HA3' HD13 ' A' ' 56' ' ' LEU . . . -126.62 138.4 10.62 Favored Glycine 0 N--CA 1.441 -0.978 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.255 -175.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -101.25 131.98 47.0 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 177.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 38.0 m -120.14 136.45 54.61 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.733 -176.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 24.8 m-90 -126.35 122.74 36.27 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.331 177.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.432 ' HD2' ' HH ' ' A' ' 78' ' ' TYR . 3.8 t80 -128.24 119.11 24.52 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.24 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.498 HD13 ' HA ' ' A' ' 77' ' ' LYS . 31.7 mm -101.76 113.92 39.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.96 175.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 23.4 t60 -154.18 140.58 18.71 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -176.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.3 t70 62.73 27.26 16.03 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.34 0.591 . . . . 0.0 109.898 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 66.42 12.4 8.64 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.837 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.8 mt -105.93 135.73 46.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.122 0.487 . . . . 0.0 110.956 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.498 ' HA ' HD13 ' A' ' 72' ' ' ILE . 63.4 tttp -97.98 119.25 36.28 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.742 177.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.432 ' HH ' ' HD2' ' A' ' 71' ' ' TYR . 15.0 p90 -141.1 143.45 34.33 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.098 0.475 . . . . 0.0 110.53 174.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -135.69 148.7 49.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.994 -177.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -138.63 144.16 39.6 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -108.57 128.38 54.77 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 121.106 0.479 . . . . 0.0 109.73 174.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 29.2 pt -117.7 151.04 19.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.583 -175.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -139.21 153.82 47.94 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 174.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.585 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 31.2 p90 -156.38 151.35 26.22 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.481 177.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.562 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 29.5 t70 -98.73 145.29 27.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.998 -177.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.0 mm -107.7 89.97 5.74 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.627 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.562 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 22.4 Cg_exo -64.49 164.04 24.89 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.554 2.169 . . . . 0.0 111.982 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 57.2 mt -69.2 -18.5 22.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.38 0.61 . . . . 0.0 110.322 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -79.95 9.02 5.85 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.392 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.558 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 78.2 t80 -77.94 139.46 61.65 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.558 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 44.2 Cg_endo -95.82 13.09 41.28 Favored 'Cis proline' 0 C--N 1.349 0.573 0 C-N-CA 124.314 -1.119 . . . . 0.0 113.856 1.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 38.1 m -58.5 -31.91 68.31 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.356 0.598 . . . . 0.0 110.496 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 35.6 m -123.63 124.4 42.7 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.785 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.498 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -69.0 143.93 95.04 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.518 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 17.2 Cg_exo -68.22 155.53 69.05 Favored 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 123.31 2.673 . . . . 0.0 112.687 179.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -102.3 116.87 33.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.926 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.585 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 4.2 mp -88.46 117.95 33.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.467 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -90.24 -44.0 10.02 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.816 -175.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.421 ' CG1' ' HG ' ' A' ' 102' ' ' LEU . 17.9 t 63.52 86.58 0.14 Allowed Pre-proline 0 CA--C 1.535 0.399 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.889 -176.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -61.15 -28.14 85.02 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.957 2.438 . . . . 0.0 112.969 -175.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.92 -37.08 83.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.855 0.36 . . . . 0.0 110.876 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.472 ' HA ' ' HB3' ' A' ' 105' ' ' LYS . 60.8 mt -82.33 -10.78 58.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.741 -173.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -61.84 112.45 2.3 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 81.02 -12.29 37.71 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.34 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.472 ' HB3' ' HA ' ' A' ' 102' ' ' LEU . 3.6 tppp? -86.33 -60.7 1.93 Allowed 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.638 HG23 HD11 ' A' ' 153' ' ' LEU . 66.4 m -75.1 119.94 19.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.707 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -77.7 72.28 4.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.465 0.65 . . . . 0.0 110.285 176.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.595 ' HG2' ' H ' ' A' ' 109' ' ' MET . 31.1 ttmt -166.15 -168.49 1.25 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.595 ' H ' ' HG2' ' A' ' 108' ' ' LYS . 65.6 mtt 69.51 100.1 0.06 Allowed 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.419 0.45 . . . . 0.0 110.322 -178.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -57.62 -47.99 80.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.632 -176.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' A' ' 111' ' ' ARG . 44.1 mtm105 -152.57 176.34 11.81 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 82.61 -54.58 4.93 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.391 175.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 83.34 70.47 1.35 Allowed Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 98' ' ' ALA . 16.5 ptpt -164.61 164.47 21.54 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -175.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 45.5 pt -73.46 135.24 28.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 120.966 0.412 . . . . 0.0 110.419 178.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 42.6 t -96.83 117.92 32.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.34 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.7 mt -98.21 164.19 12.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.337 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 3.5 t -72.14 152.09 42.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.078 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -68.41 -26.93 65.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.101 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -70.43 -18.51 63.01 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.64 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -67.12 -33.62 75.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.054 0.454 . . . . 0.0 110.035 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.411 ' HB2' ' CD ' ' A' ' 123' ' ' PRO . 41.8 mtpt -58.6 -58.94 15.47 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.842 -178.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.411 ' CD ' ' HB2' ' A' ' 122' ' ' LYS . 27.9 Cg_endo -63.94 -26.76 66.6 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 121.874 1.716 . . . . 0.0 112.451 178.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 64.5 tp -66.31 -47.24 74.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.968 0.414 . . . . 0.0 110.24 175.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -67.19 -51.42 53.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.624 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.05 -15.37 59.35 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.19 -176.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -78.55 -40.91 33.59 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.95 0.405 . . . . 0.0 110.786 177.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -105.16 70.53 0.9 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.105 0.479 . . . . 0.0 110.949 -173.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 68.2 t -130.9 128.69 22.43 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.267 176.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.454 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 78.0 Cg_endo -87.92 -139.83 0.15 OUTLIER 'Cis proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.728 -1.363 . . . . 0.0 112.91 1.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 50.6 mtmt 75.54 -7.62 1.75 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.496 0.718 . . . . 0.0 111.533 -178.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.7 m-30 -95.65 141.17 29.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.29 171.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -145.98 -174.06 17.79 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 42.7 tp -57.14 -38.31 73.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.78 0.29 . . . . 0.0 111.415 -176.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.56 -43.63 89.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.005 0.431 . . . . 0.0 111.173 178.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 20.2 m80 -70.99 -36.66 72.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.313 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 55.8 tp -60.31 -47.89 84.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.249 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . 0.429 ' HA ' ' CE ' ' A' ' 138' ' ' MET . 18.2 mmt -63.96 -43.17 96.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.034 -178.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -69.9 -37.14 75.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.951 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.8 mt -86.86 -33.31 19.84 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -176.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -98.6 -64.89 0.86 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.4 -0.905 . . . . 0.0 113.109 -176.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 48.7 tp -66.21 -44.26 84.34 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -173.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -51.8 -61.59 6.32 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.371 -0.442 . . . . 0.0 113.566 -178.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -62.42 -31.46 80.98 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.571 2.18 . . . . 0.0 112.37 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 52.3 t90 -62.66 -46.17 89.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.022 0.439 . . . . 0.0 110.097 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 86.8 mt -63.94 -33.11 74.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.784 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.6 -18.1 64.86 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.476 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 64.7 t -104.36 -54.5 6.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.493 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -77.21 -35.18 55.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -171.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.572 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 31.9 mm -59.62 -51.84 78.25 Favored Pre-proline 0 CA--C 1.535 0.4 0 N-CA-C 111.79 0.292 . . . . 0.0 111.79 -178.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.572 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 50.6 Cg_exo -55.12 -34.53 87.87 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.974 1.783 . . . . 0.0 112.129 175.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.87 -45.04 87.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.725 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.638 HD11 HG23 ' A' ' 106' ' ' THR . 4.2 mm? -67.94 -30.25 69.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.231 178.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 150' ' ' ILE . 65.5 mt -70.93 -42.1 77.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.139 0.495 . . . . 0.0 110.172 175.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -63.42 -42.61 98.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.904 176.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 43.0 tttp -67.98 -31.83 71.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.125 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 79.99 33.67 32.5 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.904 174.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.2 t -97.37 -14.76 7.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.021 0.439 . . . . 0.0 110.934 -177.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.7 mt -75.16 87.56 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.389 0.614 . . . . 0.0 109.658 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -86.09 119.31 26.25 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.96 -174.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 33.4 p80 -153.35 153.93 33.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.802 -1.09 . . . . 0.0 108.259 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -66.52 151.48 47.18 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 178.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 67.62 89.67 0.1 Allowed 'General case' 0 C--N 1.33 -0.247 0 O-C-N 123.91 0.756 . . . . 0.0 110.648 -175.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -126.96 -35.47 2.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.93 176.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 8.9 p -137.15 133.54 35.37 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.85 -178.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -91.84 172.62 8.34 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 173.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.4 100.54 0.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 173.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 86.3 mt -70.51 137.91 50.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.338 0.59 . . . . 0.0 111.978 -170.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -109.18 147.62 32.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.401 175.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -74.33 100.76 3.85 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 165.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -35.98 108.83 0.08 Allowed 'General case' 0 N--CA 1.47 0.56 0 O-C-N 124.469 1.106 . . . . 0.0 113.801 -160.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 20.7 p80 -136.69 -37.27 0.68 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.585 -1.189 . . . . 0.0 109.404 176.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -87.33 -40.11 14.75 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -98.75 165.83 11.6 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.528 -1.214 . . . . 0.0 108.297 170.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 26.3 p80 . . . . . 0 C--O 1.246 0.904 0 CA-C-O 118.169 -0.92 . . . . 0.0 109.476 177.634 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.43 ' O ' ' HB2' ' A' ' 2' ' ' ALA . 18.4 mmt . . . . . 0 N--CA 1.482 1.146 0 CA-C-O 120.825 0.345 . . . . 0.0 111.103 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.43 ' HB2' ' O ' ' A' ' 1' ' ' MET . . . 147.03 -20.2 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.499 1.52 . . . . 0.0 107.71 -169.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -107.99 -2.45 19.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 114.34 -1.3 . . . . 0.0 111.148 -174.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.512 ' CD ' ' H ' ' A' ' 4' ' ' GLU . 0.8 OUTLIER -63.49 -35.18 79.59 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.507 -174.1 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.417 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -67.46 -44.25 79.08 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.279 0.562 . . . . 0.0 109.965 175.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.2 m -64.68 -45.7 85.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.488 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 4' ' ' GLU . 0.3 OUTLIER -65.52 -30.0 70.71 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.282 -178.741 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -66.64 -41.65 87.93 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 177.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 5' ' ' ALA . 71.9 t -58.74 -46.1 90.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.319 177.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.1 t -66.42 -28.85 44.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.752 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.8 t -76.87 -36.27 56.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.946 -178.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -86.13 -4.31 59.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.429 . . . . 0.0 110.879 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 61.6 mt -119.06 86.36 31.69 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 173.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.15 149.51 27.67 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.665 2.91 . . . . 0.0 113.768 -172.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.8 m -76.23 175.1 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.037 178.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.422 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 6.3 mp -100.27 163.59 12.33 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.485 -179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.63 -39.7 5.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 172.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.624 ' HB ' ' HG3' ' A' ' 34' ' ' GLU . 23.0 m -88.92 135.86 33.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.148 179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -150.02 121.44 7.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.51 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.669 ' H ' ' HD2' ' A' ' 31' ' ' ARG . . . -156.28 -178.99 7.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.277 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -101.5 168.56 19.76 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.058 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.74 -7.48 18.37 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 123.2 2.6 . . . . 0.0 113.2 -177.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.407 ' HB2' ' HE ' ' A' ' 23' ' ' ARG . 11.0 mtm180 -70.28 -51.26 31.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.638 0.732 . . . . 0.0 109.723 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -76.6 93.77 3.65 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.133 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.415 ' O ' HG23 ' A' ' 29' ' ' VAL . 97.9 mtt180 -55.75 -52.17 64.85 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -168.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.553 ' HG3' HD22 ' A' ' 27' ' ' LEU . 10.0 pt-20 -71.37 -33.93 69.99 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -174.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.553 HD22 ' HG3' ' A' ' 26' ' ' GLU . 4.2 mm? -75.48 -33.31 60.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.967 0.413 . . . . 0.0 110.341 178.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.51 ' CH2' HG21 ' A' ' 86' ' ' ILE . 64.1 t-105 -65.32 -50.67 64.76 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.126 177.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 25' ' ' ARG . 84.3 t -60.17 -32.68 51.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-O 121.123 0.487 . . . . 0.0 110.49 177.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.517 ' HB3' HG21 ' A' ' 18' ' ' THR . 16.2 tt0 -67.32 -49.21 65.06 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.249 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.669 ' HD2' ' H ' ' A' ' 20' ' ' ALA . 2.9 ptm180 -70.31 -27.58 64.5 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.374 -0.53 . . . . 0.0 110.066 178.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.437 ' HA ' HD22 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -62.84 -44.77 95.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.231 -0.441 . . . . 0.0 109.866 179.116 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.499 ' O ' ' HG2' ' A' ' 37' ' ' GLN . 18.5 ptpt -73.38 -31.09 63.71 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.349 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.624 ' HG3' ' HB ' ' A' ' 18' ' ' THR . 6.1 mm-40 -57.35 -51.51 69.11 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.381 0.61 . . . . 0.0 109.69 172.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.552 ' OE1' ' HA3' ' A' ' 133' ' ' GLY . 5.3 tp10 -64.66 -39.64 94.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.075 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.426 ' O ' HG13 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -61.85 -42.18 98.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.798 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 15.4 mm100 -64.43 -39.2 93.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.899 0.38 . . . . 0.0 110.314 177.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.7 t -61.74 -43.14 99.43 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.884 175.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.418 ' O ' HG23 ' A' ' 43' ' ' VAL . 61.9 mt -59.86 -52.29 66.09 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.84 175.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 36' ' ' TYR . 77.7 mt -59.06 -33.28 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.87 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 41' ' ' ARG . 6.8 tpp180 -61.1 -44.6 97.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.275 177.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -68.6 -43.17 77.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.422 177.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.497 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 86.6 t -59.42 -42.02 86.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.655 178.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.44 -47.26 86.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.756 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -54.57 -41.51 69.94 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.371 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.479 ' HB3' ' HA ' ' A' ' 52' ' ' ASP . 89.3 m-20 -67.5 -41.28 84.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.141 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 74.0 mmtt -68.09 -27.57 66.59 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.244 -0.182 . . . . 0.0 110.808 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.18 -41.65 79.7 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.946 178.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -107.83 3.88 24.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.81 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.6 t70 59.14 31.46 21.29 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.5 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -97.17 16.04 20.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.469 -177.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.479 ' HA ' ' HB3' ' A' ' 46' ' ' ASN . 20.7 t0 -57.75 138.93 55.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.202 -178.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 59.7 p-90 -143.33 -0.25 1.11 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.167 -0.47 . . . . 0.0 112.104 -172.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -140.44 135.26 31.84 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 119.893 -0.723 . . . . 0.0 112.019 -170.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -130.33 125.04 33.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.056 174.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -122.1 126.91 49.43 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.873 0.368 . . . . 0.0 110.274 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -118.08 160.35 21.67 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.633 177.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.4 p -158.67 168.74 26.07 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.766 0.317 . . . . 0.0 110.834 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -75.72 172.88 11.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.025 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -71.93 -14.85 62.04 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -175.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.25 -18.22 29.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.853 0.358 . . . . 0.0 110.239 176.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.22 23.94 70.2 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 116.042 -0.527 . . . . 0.0 112.244 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.8 p -90.97 -4.35 56.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.025 0.441 . . . . 0.0 111.436 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -152.47 128.42 10.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 45.7 m95 -120.59 136.97 54.65 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.865 0.364 . . . . 0.0 110.69 -176.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.4 p90 -141.01 139.25 34.14 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.326 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -165.1 -177.73 37.81 Favored Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 119.427 -1.368 . . . . 0.0 113.128 -177.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.51 ' HD2' ' CZ2' ' A' ' 70' ' ' TRP . 22.7 ttmm -130.65 133.05 45.8 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 -177.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.426 ' O ' ' HA ' ' A' ' 79' ' ' GLU . 6.9 p -112.6 130.13 56.13 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.321 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.683 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 16.6 m-90 -103.64 131.11 51.09 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.57 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -118.22 119.51 34.89 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 175.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 15.7 mm -101.89 119.78 50.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.221 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -140.36 107.32 5.42 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.254 177.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.5 t70 55.07 64.75 1.69 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.548 173.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.679 HD12 ' HB3' ' A' ' 165' ' ' CYS . 3.6 mm? 67.12 2.08 2.62 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.658 175.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -107.4 137.45 45.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.762 0.315 . . . . 0.0 110.401 177.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.402 ' H ' ' HG3' ' A' ' 164' ' ' LYS . 21.4 ttpt -118.0 113.87 22.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.263 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -112.4 122.19 47.0 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.683 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 8.2 pt-20 -115.26 140.13 49.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.988 0.423 . . . . 0.0 110.904 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -127.8 126.18 41.22 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.153 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -87.23 126.06 34.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.862 177.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.475 HG22 HG22 ' A' ' 99' ' ' VAL . 41.1 pt -125.25 153.42 32.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.92 -175.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -147.82 155.12 41.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.798 0.333 . . . . 0.0 110.502 176.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.434 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 44.2 p90 -165.21 159.28 17.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.288 177.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -104.28 170.15 8.07 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.259 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.51 HG21 ' CH2' ' A' ' 28' ' ' TRP . 47.7 mm -114.91 90.89 24.27 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.936 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 11.0 Cg_endo -53.52 159.74 6.02 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.249 2.633 . . . . 0.0 112.89 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.1 mm -71.66 -18.5 19.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.509 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 m -88.52 9.31 24.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.05 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.473 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 47.7 t80 -81.37 146.05 56.9 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.31 -0.404 . . . . 0.0 109.914 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.473 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 10.9 Cg_endo -92.99 12.81 51.03 Favored 'Cis proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.48 -1.05 . . . . 0.0 112.696 -2.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.4 m -59.38 -28.83 67.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.389 0.614 . . . . 0.0 110.61 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 74.0 m -128.51 132.52 48.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.557 173.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.62 144.67 69.87 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.214 -178.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -85.82 173.98 6.81 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 122.826 2.351 . . . . 0.0 112.332 178.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.646 ' HB3' ' HA ' ' A' ' 114' ' ' LYS . 45.1 mt-10 -109.09 116.99 33.01 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.296 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.434 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.8 mt -76.24 132.43 33.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.457 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.739 ' HA ' ' HA3' ' A' ' 113' ' ' GLY . . . -107.15 128.88 54.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.926 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.475 HG22 HG22 ' A' ' 82' ' ' ILE . 10.6 t -122.83 86.06 50.12 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -63.13 -17.94 62.61 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.855 2.37 . . . . 0.0 112.829 -175.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -81.09 -27.54 35.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.96 0.41 . . . . 0.0 111.006 -178.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 72.9 mt -88.42 -17.82 29.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.978 0.418 . . . . 0.0 110.13 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -57.54 112.59 1.48 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.031 178.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 82.93 -11.84 52.05 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.092 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.416 ' HB2' ' NZ ' ' A' ' 105' ' ' LYS . 4.9 ttmp? -93.47 -44.51 8.21 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 120.802 0.334 . . . . 0.0 110.789 -177.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.737 ' HB ' ' HB2' ' A' ' 109' ' ' MET . 20.0 m -71.19 145.27 49.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.194 178.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -47.03 -50.89 18.6 Favored 'General case' 0 N--CA 1.463 0.18 0 O-C-N 123.559 0.537 . . . . 0.0 111.086 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -128.53 112.96 14.88 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.737 ' HB2' ' HB ' ' A' ' 106' ' ' THR . 15.1 tpt -143.29 141.97 31.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.231 -175.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -73.15 157.67 36.76 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -73.71 119.1 17.46 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.423 -172.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 82.1 -60.11 4.83 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.802 -178.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . 0.739 ' HA3' ' HA ' ' A' ' 98' ' ' ALA . . . -178.23 -107.53 0.22 Allowed Glycine 0 N--CA 1.437 -1.257 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 176.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.646 ' HA ' ' HB3' ' A' ' 96' ' ' GLU . 7.4 mtpm? 49.03 39.55 15.1 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 122.782 0.433 . . . . 0.0 111.389 178.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 31.6 pt -72.15 135.51 27.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.295 0.569 . . . . 0.0 110.957 -177.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 2.8 p -108.58 153.2 23.71 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.004 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.428 ' HB2' ' CD1' ' A' ' 121' ' ' PHE . 64.7 mt -91.37 -171.39 2.93 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.008 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 13.7 t -61.1 145.68 50.07 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -58.41 -30.69 67.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.492 -173.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -54.77 -30.98 58.1 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.169 178.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.428 ' CD1' ' HB2' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -69.19 -33.04 72.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.469 -175.561 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.464 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 10.0 tmtt? -58.77 -57.08 29.49 Favored Pre-proline 0 CA--C 1.541 0.618 0 CA-C-O 119.714 -0.184 . . . . 0.0 111.393 -173.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.464 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 35.6 Cg_endo -66.95 -34.95 27.91 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 121.672 1.581 . . . . 0.0 111.982 175.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 43.9 tp -60.98 -37.91 84.11 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.927 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.482 ' CZ3' HD13 ' A' ' 137' ' ' LEU . 63.7 t-105 -61.21 -54.71 40.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.484 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.48 -33.27 74.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.303 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 31.6 mtt180 -63.7 -37.12 86.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.465 177.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -83.47 -61.24 1.89 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -175.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.47 HG13 ' HA ' ' A' ' 130' ' ' PRO . 94.6 t -47.49 132.93 10.35 Favored Pre-proline 0 N--CA 1.471 0.602 0 O-C-N 123.627 0.579 . . . . 0.0 111.407 -175.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.481 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 91.7 Cg_endo -77.61 -164.65 4.04 Favored 'Cis proline' 0 C--N 1.35 0.643 0 C-N-CA 124.259 -1.142 . . . . 0.0 114.298 7.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 30.8 mttm 73.66 -9.87 1.15 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.867 -178.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . 0.506 ' HZ ' HD12 ' A' ' 140' ' ' LEU . 6.0 t80 -106.68 151.36 25.21 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.552 ' HA3' ' OE1' ' A' ' 35' ' ' GLU . . . -166.96 -158.18 11.13 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 119.629 -1.272 . . . . 0.0 113.759 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 48.6 tp -63.22 -44.93 93.89 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.746 0.646 . . . . 0.0 112.746 -169.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.04 87.51 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.944 0.878 . . . . 0.0 110.002 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -72.7 -32.48 65.79 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.533 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.482 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 65.8 tp -66.66 -48.74 68.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.308 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 20.3 ptm -65.34 -34.83 79.24 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 121.071 -0.252 . . . . 0.0 111.073 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.18 -45.66 72.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.708 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.506 HD12 ' HZ ' ' A' ' 132' ' ' PHE . 76.2 mt -91.0 -16.06 28.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.825 -174.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -110.43 -67.34 0.56 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.259 -176.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 54.5 tp -60.97 -46.11 92.03 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 -174.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.5 -62.18 6.47 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.061 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.61 -33.84 96.71 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.705 2.27 . . . . 0.0 112.962 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 18.7 t90 -57.66 -52.67 64.48 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.241 0.543 . . . . 0.0 109.772 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.405 ' HA ' HG12 ' A' ' 150' ' ' ILE . 88.9 mt -67.47 -36.13 80.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.892 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.21 -24.15 67.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.362 -174.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 57.7 t -104.23 -54.72 6.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.78 -0.368 . . . . 0.0 111.905 -177.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -73.99 -34.08 64.07 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -170.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.493 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.0 mm -66.52 -49.77 50.21 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -176.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.493 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 79.1 Cg_exo -50.21 -39.52 52.09 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 122.225 1.95 . . . . 0.0 112.95 177.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -70.6 -42.27 71.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.71 0.291 . . . . 0.0 110.491 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 23.2 tp -59.51 -35.71 74.67 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.071 0.462 . . . . 0.0 110.438 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 150' ' ' ILE . 69.2 mt -70.34 -53.69 21.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.692 177.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -64.47 -26.65 68.53 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.854 -175.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -70.77 -14.32 62.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.721 -178.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 90.92 16.66 54.01 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.764 176.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 59.9 t -80.95 -62.74 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.944 0.402 . . . . 0.0 110.284 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 13.2 pt -100.66 100.25 10.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.356 0.598 . . . . 0.0 111.261 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -128.97 106.86 9.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.64 177.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 37.6 m170 -98.03 176.01 5.91 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.17 175.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -89.61 177.23 6.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.918 0.39 . . . . 0.0 111.503 -176.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -50.5 109.08 0.27 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.198 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.875 ' HE2' ' HA ' ' A' ' 164' ' ' LYS . 10.2 mmpt? -88.2 -28.48 21.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.046 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . 0.679 ' HB3' HD12 ' A' ' 75' ' ' LEU . 38.6 t -136.22 151.06 49.3 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.223 -178.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -72.91 159.26 33.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.643 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -80.56 49.44 1.17 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.531 0.681 . . . . 0.0 110.104 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 96.0 mt -132.24 162.29 31.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.792 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.81 172.43 13.02 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 121.168 -0.213 . . . . 0.0 110.684 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -155.02 97.24 1.92 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.948 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 38.7 t60 -80.75 105.1 11.72 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.833 0.349 . . . . 0.0 110.357 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 7.3 p80 -93.38 126.7 38.65 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 175.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -65.95 120.79 13.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.335 -175.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 61.9 t-80 -104.96 128.89 53.42 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 174.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 56.9 p-80 . . . . . 0 C--O 1.245 0.827 0 CA-C-O 118.09 -0.957 . . . . 0.0 110.343 178.451 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.099 0 CA-C-O 121.053 0.454 . . . . 0.0 110.661 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.98 118.46 31.86 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.516 174.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.497 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 5.5 m-20 -65.01 141.43 58.77 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.544 -177.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -61.25 -29.53 69.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.066 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -58.64 -51.21 70.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.818 174.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.5 m -57.98 -44.17 86.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.424 177.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 51.3 mmm-85 -59.4 -48.17 82.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.952 -178.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.3 -46.16 77.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.065 -177.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 5' ' ' ALA . 79.5 t -59.45 -48.07 88.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.304 -178.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 92.5 t -66.74 -26.99 38.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.966 0.412 . . . . 0.0 110.803 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -77.26 -54.22 6.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.424 -177.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -80.56 0.49 33.68 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.976 0.417 . . . . 0.0 111.708 -173.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.642 HG12 ' HB2' ' A' ' 42' ' ' TYR . 60.9 mt -108.97 87.96 5.1 Favored Pre-proline 0 C--N 1.324 -0.543 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 169.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.533 ' HG2' ' HG3' ' A' ' 41' ' ' ARG . 80.7 Cg_exo -48.48 140.46 21.31 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 123.978 3.119 . . . . 0.0 114.006 -170.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.513 ' HB ' ' HG2' ' A' ' 131' ' ' LYS . 35.6 m -73.43 163.4 4.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.942 177.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.5 mp -106.94 154.8 20.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.092 -175.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.412 ' HB2' ' NZ ' ' A' ' 17' ' ' LYS . 9.0 mtmp? -99.91 -47.27 5.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.905 177.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.561 HG23 HD12 ' A' ' 27' ' ' LEU . 72.7 m -82.97 116.59 22.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.424 -177.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.479 ' OD1' ' HG3' ' A' ' 91' ' ' PRO . 38.4 t-20 -148.16 99.06 3.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -136.08 -58.08 0.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.508 -174.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 151.68 170.16 18.11 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.961 176.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.73 -13.36 17.96 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 123.042 2.494 . . . . 0.0 112.294 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.44 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 1.7 mmp_? -65.76 -33.85 76.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.758 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -93.43 107.34 19.2 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 mmp_? -58.22 -43.41 87.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.876 -176.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.43 -45.2 66.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.846 0.355 . . . . 0.0 110.681 -174.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.561 HD12 HG23 ' A' ' 18' ' ' THR . 4.5 mm? -73.18 -23.56 60.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.774 178.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 51.7 t-105 -70.66 -45.66 64.7 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 175.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 25' ' ' ARG . 99.5 t -60.78 -38.66 79.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.094 0.473 . . . . 0.0 110.029 175.244 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.583 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 0.7 OUTLIER -61.33 -37.27 82.67 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.459 174.813 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.573 HH22 ' HA2' ' A' ' 133' ' ' GLY . 2.4 mtp180 -64.5 -37.4 87.41 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.119 177.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 32' ' ' LEU . 4.1 mm? -56.7 -42.69 79.57 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 175.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -60.12 -47.84 84.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.468 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 11.0 mm-40 -59.57 -49.77 76.46 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.836 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -62.07 -44.73 96.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.802 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.42 ' O ' HG13 ' A' ' 40' ' ' ILE . 8.4 m-30 -57.67 -46.66 83.97 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.452 0.168 . . . . 0.0 111.308 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -58.56 -46.78 86.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 0.0 110.684 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.8 t -66.84 -44.42 81.08 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.468 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.427 ' O ' HG23 ' A' ' 43' ' ' VAL . 58.5 mt -60.52 -53.88 52.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.216 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 36' ' ' TYR . 79.9 mt -57.71 -39.8 72.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.48 0.181 . . . . 0.0 110.702 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.533 ' HG3' ' HG2' ' A' ' 14' ' ' PRO . 5.9 mmp_? -59.63 -56.88 16.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.911 176.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.642 ' HB2' HG12 ' A' ' 13' ' ' ILE . 36.4 t80 -57.44 -50.07 74.2 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.355 -179.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.513 HG12 ' HE2' ' A' ' 47' ' ' LYS . 91.1 t -63.56 -37.52 79.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.162 -176.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 40' ' ' ILE . 2.7 tp10 -63.22 -49.82 72.66 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.342 0.591 . . . . 0.0 109.99 179.193 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.414 ' HA ' HD21 ' A' ' 48' ' ' ASN . 89.3 m-20 -59.29 -36.59 75.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.568 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.449 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 65.6 t30 -73.2 -40.06 65.05 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.411 -177.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.513 ' HE2' HG12 ' A' ' 43' ' ' VAL . 66.5 mttm -63.04 -46.38 87.83 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.802 -178.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.414 HD21 ' HA ' ' A' ' 45' ' ' ASN . 10.4 p30 -71.8 -14.71 62.06 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.853 -175.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -89.81 -2.82 58.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.825 0.345 . . . . 0.0 110.452 175.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 33.2 t0 60.78 40.25 16.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.277 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -122.99 17.83 10.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.923 0.868 . . . . 0.0 109.505 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.449 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 22.4 t70 -62.3 101.47 0.23 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.827 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.442 ' HB2' ' O ' ' A' ' 70' ' ' TRP . 15.9 p-90 -111.13 -40.98 4.3 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -167.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.586 ' H ' ' HD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -124.1 162.34 23.75 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 121.776 -0.577 . . . . 0.0 111.762 -174.235 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -156.28 129.03 7.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.848 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -112.61 144.14 42.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.252 0.549 . . . . 0.0 111.759 -173.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -109.25 162.99 13.77 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 173.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.1 m -153.19 155.4 36.59 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.808 0.337 . . . . 0.0 110.904 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -81.49 168.73 17.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 169.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -73.87 -6.5 47.56 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.805 -174.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -84.8 -25.58 28.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.98 0.419 . . . . 0.0 110.258 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.04 18.23 74.43 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.2 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.0 p -90.38 -4.35 57.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -176.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 64' ' ' ARG . 12.8 ttp180 -151.99 128.37 10.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.788 0.328 . . . . 0.0 110.17 172.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -111.54 126.56 55.11 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.36 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -137.25 138.04 39.68 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.212 -175.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -172.66 -155.94 12.0 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.676 -0.774 . . . . 0.0 112.051 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -138.66 153.61 48.58 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.771 0.319 . . . . 0.0 110.406 -178.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.8 p -128.19 123.97 35.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.841 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.6 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 17.0 m-90 -102.11 121.56 42.43 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 175.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.427 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 11.1 t80 -118.99 124.5 47.14 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.175 -178.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 41.6 mm -97.9 114.8 36.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -177.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -146.57 118.42 8.15 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.403 177.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.6 t0 62.1 41.95 10.32 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.333 0.587 . . . . 0.0 110.828 175.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mm? 70.44 5.04 5.19 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.693 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.635 HD21 ' HB2' ' A' ' 164' ' ' LYS . 83.2 mt -88.48 106.12 18.06 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.998 0.427 . . . . 0.0 110.199 176.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -94.28 93.61 7.84 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.427 ' CE1' ' HB3' ' A' ' 71' ' ' TYR . 30.1 p90 -118.22 138.85 52.05 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.067 0.46 . . . . 0.0 111.087 -177.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.6 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 0.7 OUTLIER -115.21 141.87 47.43 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.74 179.734 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -123.85 136.95 54.69 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.174 174.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -85.48 110.91 19.52 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 177.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.403 ' HA ' HG22 ' A' ' 99' ' ' VAL . 32.0 pt -115.16 155.62 16.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.016 -172.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -166.08 159.64 15.61 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.631 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 52.3 p90 -159.39 147.73 17.71 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.55 178.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -98.98 159.45 14.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.307 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.7 mm -106.6 90.32 4.91 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.328 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.18 148.5 18.09 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 123.102 2.535 . . . . 0.0 112.591 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 38.8 mm -71.66 -14.31 17.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.559 0.695 . . . . 0.0 110.091 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 2.9 p -84.21 7.65 18.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.423 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.698 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 63.5 t80 -69.63 144.65 94.2 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.698 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 37.8 Cg_endo -92.7 3.01 60.17 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 124.186 -1.173 . . . . 0.0 114.133 1.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.9 m -58.02 -41.71 83.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.459 0.647 . . . . 0.0 110.09 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 37.5 m -103.93 120.92 42.04 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.206 172.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.61 145.07 95.61 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.479 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.441 ' HD2' HD22 ' A' ' 137' ' ' LEU . 25.7 Cg_exo -62.63 115.38 2.87 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.64 2.227 . . . . 0.0 111.221 175.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.575 ' CB ' ' HD2' ' A' ' 114' ' ' LYS . 30.6 mt-10 -74.44 117.33 16.13 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.83 -175.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.631 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 60.5 mt -66.6 127.76 28.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 175.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.98 -78.0 0.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.142 -170.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.403 HG22 ' HA ' ' A' ' 82' ' ' ILE . 8.1 t 51.69 75.79 0.61 Allowed Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.598 -175.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.88 -21.16 56.14 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 123.096 2.531 . . . . 0.0 112.798 -175.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 10.6 tp10 -63.61 -28.49 69.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.368 -178.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 97.8 mt -77.62 -22.53 50.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.288 -177.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -68.67 -16.38 63.81 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.557 0.694 . . . . 0.0 110.726 -178.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -108.5 10.37 35.74 Favored Glycine 0 C--N 1.316 -0.535 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.891 176.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 48.5 mmtm -115.49 -68.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.679 0.276 . . . . 0.0 111.497 -177.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.9 t -77.72 -27.61 50.65 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.486 -173.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 71.7 -35.23 0.32 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.52 0.728 . . . . 0.0 111.751 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -81.67 83.29 7.13 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 172.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 9.3 tpt -149.38 157.1 43.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.528 -1.215 . . . . 0.0 109.338 -167.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.549 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 41.7 m-85 -70.04 122.41 19.32 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 172.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 59.6 mtt180 -74.9 6.4 4.1 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.369 -167.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -103.43 7.96 51.6 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 172.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 89.54 51.31 2.93 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.117 -0.563 . . . . 0.0 112.018 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.575 ' HD2' ' CB ' ' A' ' 96' ' ' GLU . 38.6 mmtt -138.89 143.49 38.75 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -178.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.407 ' CD1' ' HB ' ' A' ' 97' ' ' ILE . 39.4 pt -76.34 152.9 5.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.825 179.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.401 ' HA ' ' HE2' ' A' ' 110' ' ' TYR . 39.0 t -88.71 106.54 18.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.461 -179.188 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 95.9 mt -92.68 -175.49 3.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.7 t -84.36 155.52 22.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.716 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -73.53 -24.58 60.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.701 -178.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -82.64 -2.73 54.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.088 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -69.83 -40.94 75.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.023 -178.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.432 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 31.6 mmtp -63.77 -53.7 48.0 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.792 -177.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.432 ' HD2' ' N ' ' A' ' 122' ' ' LYS . 16.1 Cg_endo -59.46 -32.08 95.79 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 121.738 1.626 . . . . 0.0 112.419 176.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 58.6 tp -69.43 -47.97 62.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.993 0.425 . . . . 0.0 110.312 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -61.12 -51.88 67.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.878 -177.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.24 -28.97 70.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.459 -177.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -68.88 -38.73 79.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.089 0.471 . . . . 0.0 110.241 179.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -66.78 -54.97 17.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.71 -176.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 59.3 t -42.22 125.29 2.76 Favored Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 124.188 0.93 . . . . 0.0 111.983 -173.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.453 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 85.4 Cg_endo -81.92 -132.45 0.09 OUTLIER 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.079 -1.217 . . . . 0.0 113.027 4.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.513 ' HG2' ' HB ' ' A' ' 15' ' ' VAL . 7.1 ttmm 70.34 -45.0 0.58 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 176.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -74.12 155.82 38.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.949 0.405 . . . . 0.0 110.837 -177.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.573 ' HA2' HH22 ' A' ' 31' ' ' ARG . . . -144.97 174.17 25.15 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.435 -175.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.445 HD11 ' CE2' ' A' ' 84' ' ' PHE . 47.8 tp -69.59 -37.17 76.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.781 0.324 . . . . 0.0 110.913 -175.47 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.09 -37.88 64.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.429 0.633 . . . . 0.0 110.695 174.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -71.23 -32.73 69.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.419 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.441 HD22 ' HD2' ' A' ' 95' ' ' PRO . 61.7 tp -65.6 -48.91 70.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.197 -178.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 22.9 ptp -67.25 -34.78 78.17 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.992 -177.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -75.47 -53.47 8.61 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 -178.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.91 -17.31 44.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.821 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -95.49 -71.59 1.11 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.434 -0.889 . . . . 0.0 112.897 -177.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.488 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 44.5 tp -67.6 -36.51 81.0 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -172.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.88 -62.22 6.31 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.093 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -65.53 -26.63 54.38 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.601 2.201 . . . . 0.0 112.6 177.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -65.47 -39.37 91.89 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.921 0.391 . . . . 0.0 110.651 -178.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 96.3 mt -59.03 -32.88 70.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.828 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.78 1.68 14.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.785 -177.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 61.4 t -101.18 -55.86 5.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.854 0.359 . . . . 0.0 111.187 179.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -84.57 -46.63 11.37 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -174.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.478 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 48.0 mm -58.69 -54.46 56.01 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -169.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.478 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 12.2 Cg_endo -54.93 -38.98 92.66 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 122.299 1.999 . . . . 0.0 113.202 -175.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.5 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 38.6 t70 -81.68 -34.29 30.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.725 0.298 . . . . 0.0 110.275 -178.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.429 ' HG ' ' HB ' ' A' ' 158' ' ' VAL . 20.2 tp -59.95 -39.15 84.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.032 0.444 . . . . 0.0 110.481 178.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 150' ' ' ILE . 60.5 mt -64.37 -44.02 97.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.223 0.535 . . . . 0.0 110.06 176.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -68.32 -28.82 67.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.127 -177.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 30.7 mtpp -71.86 -9.51 58.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.729 0.299 . . . . 0.0 110.959 176.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 84.45 26.2 40.28 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.93 -0.652 . . . . 0.0 112.379 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . 0.429 ' HB ' ' HG ' ' A' ' 153' ' ' LEU . 40.8 t -94.69 -28.91 4.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.217 0.532 . . . . 0.0 110.23 179.016 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.42 HD11 HD23 ' A' ' 153' ' ' LEU . 58.8 mt -107.48 141.93 21.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.707 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -64.77 161.58 17.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.015 -177.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 40.7 m80 -83.87 -14.38 51.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.652 -174.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.506 ' HB2' HD22 ' A' ' 76' ' ' LEU . 73.6 mmtt 48.46 31.49 2.85 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 171.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 59.82 54.01 4.54 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.784 0.802 . . . . 0.0 111.162 -179.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.635 ' HB2' HD21 ' A' ' 76' ' ' LEU . 28.2 tttp -65.28 -39.11 92.15 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.42 173.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 2.2 p -68.47 152.95 44.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.344 -176.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -54.85 126.87 26.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.592 174.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -69.83 90.27 0.6 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.393 0.616 . . . . 0.0 111.67 -173.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 77.5 mt -121.72 93.14 3.91 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 170.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . 0.402 ' H ' ' CD ' ' A' ' 169' ' ' GLU . 0.0 OUTLIER -93.75 -168.27 1.85 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.968 -171.704 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -60.8 138.05 58.15 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.553 176.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 63.0 m170 -65.53 -26.29 67.83 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.682 -172.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -84.07 87.06 7.13 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -61.55 -68.2 0.34 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.495 -171.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -162.89 130.4 3.67 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.288 -177.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 22.5 t-80 . . . . . 0 C--O 1.247 0.946 0 CA-C-O 118.657 -0.687 . . . . 0.0 109.693 173.721 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.6 ttp . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 120.948 0.404 . . . . 0.0 110.296 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.17 110.04 22.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.538 176.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -104.04 126.96 51.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.242 0.544 . . . . 0.0 111.681 -175.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -68.8 -32.27 71.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.844 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -70.8 -45.87 63.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.787 0.327 . . . . 0.0 110.495 -178.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.451 ' O ' HG23 ' A' ' 10' ' ' VAL . 89.7 m -55.82 -52.94 62.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.261 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.9 ptp180 -61.74 -32.53 72.77 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.864 0.364 . . . . 0.0 110.873 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -63.89 -41.23 97.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.649 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.2 t -78.61 -42.48 25.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.128 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 6' ' ' THR . 82.5 t -59.62 -36.96 68.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.592 -178.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.1 m -64.42 -25.15 67.89 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.029 0.442 . . . . 0.0 111.022 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.564 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 37.7 mt-10 -91.99 -13.99 30.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.429 -177.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 52.4 mt -107.69 89.91 5.68 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.616 0.246 . . . . 0.0 110.752 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.564 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 38.9 Cg_exo -55.73 158.34 13.8 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.545 2.83 . . . . 0.0 113.373 -174.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.555 ' HB ' ' O ' ' A' ' 131' ' ' LYS . 28.4 m -100.24 170.98 1.42 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.181 -178.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.562 ' HG ' ' HB3' ' A' ' 34' ' ' GLU . 9.4 mp -91.58 -177.71 4.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.538 -178.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -137.04 6.75 2.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.705 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.566 HG21 HD12 ' A' ' 27' ' ' LEU . 27.0 m -154.21 96.33 1.93 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.869 0.366 . . . . 0.0 110.834 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -111.24 110.08 20.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.942 0.401 . . . . 0.0 110.901 -177.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.467 ' O ' ' HD3' ' A' ' 91' ' ' PRO . . . -143.91 -178.37 5.89 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.345 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.15 165.5 54.05 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.988 -175.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 88' ' ' ILE . 16.2 Cg_exo -69.3 -15.94 39.14 Favored 'Trans proline' 0 CA--C 1.529 0.259 0 C-N-CA 123.368 2.712 . . . . 0.0 112.526 178.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 23' ' ' ARG . 36.0 mtp-105 -83.32 -14.01 53.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.185 0.517 . . . . 0.0 110.072 178.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -80.48 64.35 5.25 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 170.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.402 ' O ' HG23 ' A' ' 29' ' ' VAL . 12.4 mtm-85 -54.23 -43.35 70.79 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.876 -167.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.413 ' HG3' HD22 ' A' ' 27' ' ' LEU . 7.4 pt-20 -60.13 -45.27 93.59 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.651 0.263 . . . . 0.0 111.614 -178.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.566 HD12 HG21 ' A' ' 18' ' ' THR . 4.1 mm? -81.94 -19.92 39.73 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.949 0.404 . . . . 0.0 110.978 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.449 ' HE3' HH21 ' A' ' 31' ' ' ARG . 62.3 t-105 -65.76 -39.81 91.43 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.772 177.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 25' ' ' ARG . 88.0 t -61.3 -42.37 93.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.091 176.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.515 ' O ' ' HG2' ' A' ' 34' ' ' GLU . 26.6 tt0 -67.09 -42.56 84.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.367 0.603 . . . . 0.0 110.187 176.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.456 ' HD3' ' O ' ' A' ' 18' ' ' THR . 15.9 ttp-105 -63.56 -32.69 74.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.07 -179.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -59.7 -47.33 86.07 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.344 178.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 10.3 ptmm? -65.52 -33.63 76.37 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.462 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.562 ' HB3' ' HG ' ' A' ' 16' ' ' LEU . 29.8 mm-40 -64.56 -48.98 73.0 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.837 0.351 . . . . 0.0 110.23 177.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -59.88 -44.47 94.18 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.641 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.458 ' O ' HG13 ' A' ' 40' ' ' ILE . 11.0 m-85 -59.38 -46.54 88.37 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.213 178.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -65.25 -37.79 88.32 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.468 0.173 . . . . 0.0 111.468 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.7 t -61.58 -43.39 98.95 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.746 -0.465 . . . . 0.0 109.746 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.488 ' O ' HG23 ' A' ' 43' ' ' VAL . 92.4 mt -64.84 -52.53 56.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.998 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.5 mt -55.84 -37.63 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.177 -177.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -57.27 -47.71 80.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.857 0.361 . . . . 0.0 110.96 177.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -68.62 -38.57 80.66 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.5 t -60.31 -43.27 93.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.865 178.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -57.42 -53.41 58.43 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 120.737 0.303 . . . . 0.0 110.437 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -54.22 -45.7 72.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.34 0.59 . . . . 0.0 111.07 176.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.558 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 26.3 t30 -71.62 -45.95 60.56 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.012 -0.994 . . . . 0.0 112.045 -170.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -72.9 -31.19 64.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.481 0.182 . . . . 0.0 111.297 -175.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -71.67 -26.99 62.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.904 0.383 . . . . 0.0 110.497 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -89.18 -5.23 57.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.882 0.372 . . . . 0.0 110.494 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 t70 67.44 16.26 9.97 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.438 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -91.96 8.79 35.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.718 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.558 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 24.5 t70 -51.44 110.87 0.5 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.006 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 67.7 p-90 -123.97 8.22 8.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.22 -170.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -158.02 143.55 16.94 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.063 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.43 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -125.44 124.37 41.28 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 173.889 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.493 HD23 ' HA3' ' A' ' 67' ' ' GLY . 65.5 mt -135.69 133.65 38.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.0 111.621 -176.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -138.31 157.18 46.75 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 171.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.536 ' HB3' ' CE2' ' A' ' 65' ' ' TRP . 30.9 p -103.67 164.78 11.45 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 120.661 0.267 . . . . 0.0 110.41 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -79.88 -179.14 6.8 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 171.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -68.83 -21.05 64.32 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.818 -171.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -88.25 -21.81 24.29 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.795 0.331 . . . . 0.0 110.818 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.63 2.09 84.5 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.127 -0.558 . . . . 0.0 112.407 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.49 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . 20.8 p -90.45 -7.25 53.57 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.756 0.312 . . . . 0.0 111.493 -177.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -136.41 129.63 31.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.039 0.447 . . . . 0.0 110.891 173.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.536 ' CE2' ' HB3' ' A' ' 58' ' ' SER . 38.3 m95 -112.87 138.03 50.33 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.747 176.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -137.87 145.06 41.74 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.01 -178.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.493 ' HA3' HD23 ' A' ' 56' ' ' LEU . . . -177.8 -150.69 8.72 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.183 -1.008 . . . . 0.0 112.651 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -147.1 139.21 24.5 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -174.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 23.2 p -125.84 138.31 53.81 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 175.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 13.9 p90 -157.4 135.74 11.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.812 0.339 . . . . 0.0 110.378 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -145.76 151.42 37.94 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 38.1 mm -88.24 121.4 38.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.019 0.438 . . . . 0.0 110.759 -175.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -129.69 112.52 13.74 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.031 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 0.8 OUTLIER 59.11 38.36 23.84 Favored 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.546 0.528 . . . . 0.0 111.229 179.508 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.4 mm? 75.4 -6.95 1.87 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.238 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.8 mt -79.98 107.49 12.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.914 0.388 . . . . 0.0 110.018 177.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -89.73 108.34 19.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.823 176.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -130.99 151.22 51.64 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.686 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -134.58 150.61 50.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.335 -178.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -131.99 119.84 21.62 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.032 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -72.16 119.06 15.81 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 172.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.488 HG22 HG22 ' A' ' 99' ' ' VAL . 30.7 pt -118.06 143.52 28.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 121.12 0.486 . . . . 0.0 111.819 -172.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -135.14 166.39 23.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.442 172.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.574 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 49.1 p90 -166.18 145.24 5.88 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.023 173.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -103.18 152.66 21.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.159 0.504 . . . . 0.0 110.664 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.49 ' HB ' ' HA ' ' A' ' 63' ' ' THR . 49.1 mm -104.37 90.82 3.47 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.855 -177.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -62.54 166.63 13.0 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.671 2.247 . . . . 0.0 112.319 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.417 ' HA ' ' HD2' ' A' ' 22' ' ' PRO . 34.1 mt -70.1 -9.94 13.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.66 0.743 . . . . 0.0 110.582 -178.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.8 p -86.43 -13.62 45.68 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.332 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.533 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 72.2 t80 -73.51 143.5 82.48 Favored Pre-proline 0 C--N 1.326 -0.42 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.533 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 10.9 Cg_endo -94.1 14.96 44.12 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 124.703 -0.957 . . . . 0.0 113.172 0.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.5 m -65.81 -30.34 70.95 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.583 0.706 . . . . 0.0 109.738 177.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 25.3 m -122.06 150.64 41.84 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.521 175.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.24 144.68 92.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.427 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -77.61 156.23 31.82 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.66 2.24 . . . . 0.0 111.872 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -93.06 109.82 21.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.097 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.574 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 52.9 mt -76.01 128.82 37.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 177.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.38 -62.72 1.25 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.991 -173.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.488 HG22 HG22 ' A' ' 82' ' ' ILE . 21.2 t 60.39 83.15 0.21 Allowed Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.151 -173.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.17 -20.93 71.56 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.015 2.477 . . . . 0.0 113.462 -173.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -71.79 -25.32 61.96 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.858 0.361 . . . . 0.0 111.19 -178.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 86.8 mt -97.3 16.41 20.07 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.246 -0.284 . . . . 0.0 110.895 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -59.89 92.62 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.476 -177.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 68.44 21.86 74.57 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.939 -0.573 . . . . 0.0 113.346 174.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -98.56 -45.69 6.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.94 0.37 . . . . 0.0 110.821 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.438 HG23 HD11 ' A' ' 153' ' ' LEU . 33.6 m -66.94 -51.35 56.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.502 0.668 . . . . 0.0 110.524 178.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -160.47 -164.08 1.19 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.822 -178.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -71.46 106.17 3.85 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 176.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 6.1 tpt -66.32 132.88 49.36 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.499 -174.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -90.2 145.49 24.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.091 -173.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.21 32.34 17.28 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.018 174.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 90.39 -55.11 3.53 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.868 -178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -170.03 52.94 0.2 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.363 -179.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -124.24 142.49 51.2 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 46.2 pt -80.48 159.15 4.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.917 0.389 . . . . 0.0 111.221 -177.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 20.8 p -99.94 118.81 37.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.501 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.4 mt -86.74 176.35 7.78 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.552 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.448 HG23 ' HB2' ' A' ' 121' ' ' PHE . 8.7 t -71.59 149.67 45.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.398 179.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -64.5 -38.33 90.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.362 -175.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -71.75 -9.35 58.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.457 -177.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.448 ' HB2' HG23 ' A' ' 118' ' ' THR . 70.6 t80 -69.72 -34.69 74.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.736 0.303 . . . . 0.0 111.036 -178.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.41 ' N ' ' HD2' ' A' ' 123' ' ' PRO . 14.5 mmmm -61.94 -53.58 58.59 Favored Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -177.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.53 ' O ' ' HG3' ' A' ' 127' ' ' ARG . 19.7 Cg_endo -61.61 -37.09 71.95 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 121.701 1.601 . . . . 0.0 111.8 174.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 63.9 tp -57.2 -47.03 82.32 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.921 0.391 . . . . 0.0 110.589 178.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.549 ' O ' HG23 ' A' ' 129' ' ' VAL . 29.5 t-105 -60.29 -53.06 62.17 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.001 177.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -58.06 -38.87 77.12 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.319 -175.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.53 ' HG3' ' O ' ' A' ' 123' ' ' PRO . 98.1 mtt180 -63.24 -26.69 68.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.685 0.278 . . . . 0.0 111.581 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -108.85 21.71 16.87 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.121 0.486 . . . . 0.0 111.053 -174.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.549 HG23 ' O ' ' A' ' 125' ' ' TRP . 68.8 t -107.77 136.43 19.69 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.959 175.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.432 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 1.4 Cg_endo -86.35 -158.3 1.36 Allowed 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 124.193 -1.169 . . . . 0.0 112.948 0.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.555 ' O ' ' HB ' ' A' ' 15' ' ' VAL . 55.5 mttp 75.77 -0.55 3.17 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.168 0.987 . . . . 0.0 111.956 -177.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . 0.441 ' HZ ' HD12 ' A' ' 140' ' ' LEU . 4.3 t80 -72.53 163.95 27.2 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -151.67 165.38 30.54 Favored Glycine 0 C--O 1.236 0.265 0 C-N-CA 120.209 -0.996 . . . . 0.0 112.801 -174.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.44 HD23 HD11 ' A' ' 39' ' ' LEU . 48.2 tp -58.01 -46.74 84.76 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 123.52 0.728 . . . . 0.0 112.595 -172.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.46 -30.02 51.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.323 0.583 . . . . 0.0 111.8 -177.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -71.13 -31.23 67.47 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.566 -178.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 35.7 tp -58.79 -47.48 84.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.026 0.441 . . . . 0.0 110.815 178.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . 0.471 ' HA ' ' HB3' ' A' ' 142' ' ' LEU . 1.3 mpt? -67.01 -39.35 87.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.903 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -69.86 -42.08 73.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.176 -177.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.441 HD12 ' HZ ' ' A' ' 132' ' ' PHE . 84.0 mt -95.01 -24.29 16.99 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -173.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -119.66 -63.69 0.27 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.098 -1.048 . . . . 0.0 113.755 -174.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.471 ' HB3' ' HA ' ' A' ' 138' ' ' MET . 1.4 tm? -57.99 -51.94 67.57 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -172.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.84 -61.17 7.75 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 121.312 -0.471 . . . . 0.0 113.134 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . 0.501 ' O ' HG23 ' A' ' 148' ' ' VAL . 77.3 Cg_exo -52.36 -36.58 69.31 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.884 2.389 . . . . 0.0 113.14 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -62.99 -49.0 76.42 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.788 0.328 . . . . 0.0 110.344 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 91.6 mt -60.1 -41.79 93.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.537 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.04 -8.61 46.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.316 -176.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 144' ' ' PRO . 94.7 t -106.44 -55.59 5.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.651 0.263 . . . . 0.0 111.362 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -79.84 -42.83 23.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.907 -170.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.564 ' O ' HG13 ' A' ' 154' ' ' ILE . 49.0 mm -59.66 -52.67 72.34 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -172.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.535 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 70.3 Cg_exo -53.45 -34.56 72.23 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.349 2.033 . . . . 0.0 113.488 -178.068 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.6 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 9.2 m-20 -86.26 -27.07 24.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.947 0.403 . . . . 0.0 110.875 178.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.652 ' HG ' ' HB ' ' A' ' 158' ' ' VAL . 15.7 tp -70.5 -26.79 63.76 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.146 0.498 . . . . 0.0 110.193 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 150' ' ' ILE . 69.1 mt -66.05 -49.56 75.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.736 175.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.6 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 1.4 pp0? -69.92 -20.17 63.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.188 -176.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' A' ' 152' ' ' ASP . 67.6 mttm -77.11 -16.64 59.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.077 0.465 . . . . 0.0 110.269 174.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 90.45 17.15 53.72 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.851 177.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . 0.652 ' HB ' ' HG ' ' A' ' 153' ' ' LEU . 58.7 t -88.71 -40.46 13.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.797 0.332 . . . . 0.0 110.705 -178.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.549 HD11 HD23 ' A' ' 153' ' ' LEU . 48.1 mm -67.09 127.32 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.325 178.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -83.36 117.55 23.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.197 0.522 . . . . 0.0 111.956 -176.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -171.8 127.51 0.61 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 172.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.504 ' HB3' ' OE2' ' A' ' 163' ' ' GLU . 6.8 ttpm? -58.05 -46.16 85.83 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 123.296 0.373 . . . . 0.0 111.378 -173.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.504 ' OE2' ' HB3' ' A' ' 162' ' ' LYS . 2.7 mp0 -78.25 101.12 6.97 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.25 177.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -104.06 -13.93 16.1 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.203 0.525 . . . . 0.0 109.674 174.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 79.5 m -124.15 159.0 31.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.236 173.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -68.58 149.77 48.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.827 0.346 . . . . 0.0 111.505 -175.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.454 ' HA ' ' OE1' ' A' ' 167' ' ' GLN . 5.5 tp60 -88.06 118.69 27.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.728 -178.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 45.9 tp -80.62 144.76 32.1 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.961 -177.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -79.88 120.46 24.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.108 0.48 . . . . 0.0 109.943 173.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -94.81 126.58 40.22 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.467 -173.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 75.5 t60 55.37 53.39 9.96 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 123.86 0.725 . . . . 0.0 111.093 173.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 22.3 t-160 -85.51 113.23 21.61 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.145 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -61.28 123.56 18.08 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.4 0.619 . . . . 0.0 110.741 -176.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -94.94 147.48 23.34 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.386 -174.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 33.4 p-80 . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.301 177.498 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.479 0.975 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -122.6 89.29 3.08 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.778 -178.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 52.09 79.46 0.11 Allowed 'General case' 0 C--O 1.234 0.275 0 O-C-N 123.93 0.768 . . . . 0.0 112.531 176.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.9 mp0 -61.19 -35.37 76.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.656 177.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -64.91 -43.51 92.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.782 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.437 ' O ' HG23 ' A' ' 10' ' ' VAL . 25.7 m -64.13 -35.63 81.41 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.576 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -62.42 -39.88 94.74 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 120.855 0.359 . . . . 0.0 110.285 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.427 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 44.0 ttt85 -65.7 -38.17 88.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.686 178.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 5' ' ' ALA . 97.5 t -60.48 -41.03 86.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.937 0.399 . . . . 0.0 110.546 177.138 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 6' ' ' THR . 59.7 t -69.16 -27.17 33.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 121.099 0.476 . . . . 0.0 110.354 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.3 t -73.55 -32.47 64.21 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.231 177.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 8' ' ' ARG . 44.3 mt-10 -81.49 -28.26 34.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.877 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.401 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 51.0 mt -104.73 87.56 1.86 Allowed Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 174.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.8 Cg_endo -50.18 141.71 30.22 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.884 3.056 . . . . 0.0 113.636 -169.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.4 m -69.33 149.53 10.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.369 177.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.556 HD21 ' HA ' ' A' ' 35' ' ' GLU . 6.4 mp -99.98 153.95 18.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.196 0.522 . . . . 0.0 111.571 -175.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.2 mttt -98.22 -49.67 4.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.619 -175.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.4 m -75.17 108.05 7.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.606 -170.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -105.7 90.41 3.39 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 169.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.404 ' O ' ' HD3' ' A' ' 91' ' ' PRO . . . -145.04 145.63 31.55 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.492 -177.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.1 167.49 41.75 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.149 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.28 -13.47 38.33 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 123.217 2.611 . . . . 0.0 113.088 -176.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -74.14 -24.6 59.44 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.801 0.334 . . . . 0.0 110.869 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -89.4 94.27 9.83 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 25' ' ' ARG . 43.3 mtm105 -60.11 -51.58 69.02 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -164.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -73.75 -29.94 62.51 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.496 -175.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -76.6 -26.52 55.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.904 0.383 . . . . 0.0 110.199 175.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.531 ' CH2' HG21 ' A' ' 86' ' ' ILE . 55.3 t-105 -64.2 -44.73 91.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.982 175.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.52 -41.35 81.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.353 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.698 ' HG3' ' HE3' ' A' ' 33' ' ' LYS . 53.5 tt0 -64.63 -44.0 91.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.308 177.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.537 HH22 HD22 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -54.52 -45.08 73.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.721 177.16 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.6 mp -62.88 -46.24 88.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.592 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.698 ' HE3' ' HG3' ' A' ' 30' ' ' GLN . 20.7 pttp -68.26 -38.88 82.23 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.904 -176.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 6.6 mm-40 -68.26 -45.13 74.0 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.712 0.292 . . . . 0.0 110.634 -179.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.556 ' HA ' HD21 ' A' ' 16' ' ' LEU . 10.0 tp10 -61.91 -42.51 99.17 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.084 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -63.84 -30.55 71.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.49 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.684 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 81.8 mm-40 -62.32 -49.51 75.33 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 m -63.72 -38.15 90.04 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.897 178.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.462 ' O ' HG23 ' A' ' 43' ' ' VAL . 92.8 mt -61.22 -55.92 26.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 177.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 87.2 mt -62.27 -36.22 73.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.78 -178.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -55.24 -47.17 75.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.991 175.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -72.45 -41.03 66.56 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.354 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.6 t -59.54 -39.05 78.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 120.736 0.303 . . . . 0.0 110.804 178.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -55.14 -54.83 38.31 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -57.4 -46.6 83.28 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.31 178.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -56.07 -51.41 67.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.623 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -63.16 -32.57 73.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.627 -179.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -65.34 -36.73 84.9 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.006 0.431 . . . . 0.0 110.59 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -85.68 2.42 45.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.802 178.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 36.1 t70 64.51 23.02 12.83 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.844 0.831 . . . . 0.0 110.866 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -114.08 76.62 1.0 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.502 177.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -72.91 104.7 4.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.277 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.494 ' HB3' ' HD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -75.53 -61.22 1.99 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.458 -168.645 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.494 ' HD1' ' HB3' ' A' ' 53' ' ' TRP . 3.3 p90 -162.48 172.34 15.65 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.794 -173.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.506 ' NH2' ' HH2' ' A' ' 70' ' ' TRP . 4.5 ptp180 -141.79 133.32 26.82 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.5 tp -121.23 123.48 42.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.164 0.507 . . . . 0.0 110.545 -173.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -109.23 164.42 12.47 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.658 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.9 m -141.93 156.2 45.49 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 179.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -74.57 162.93 28.3 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 168.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -70.63 -4.8 25.16 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -171.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -98.57 -16.13 19.24 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.142 0.496 . . . . 0.0 110.471 173.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.69 15.61 75.75 Favored Glycine 0 CA--C 1.52 0.392 0 CA-C-N 115.952 -0.567 . . . . 0.0 113.597 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.3 p -86.33 -3.37 58.97 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -158.76 120.31 3.44 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -105.22 145.59 30.43 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -178.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 83' ' ' GLU . 45.8 p90 -153.34 158.92 42.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.457 -176.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 166.83 -150.53 17.61 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.564 -0.826 . . . . 0.0 112.078 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.579 ' HD3' ' HB2' ' A' ' 79' ' ' GLU . 38.9 ttmt -133.21 140.95 47.82 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 -178.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.5 t -134.56 138.12 44.34 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.782 ' HB3' ' HA ' ' A' ' 79' ' ' GLU . 22.5 p90 -148.12 159.4 43.97 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.225 -0.59 . . . . 0.0 111.06 178.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 64.3 t80 -124.34 129.47 50.77 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.877 -176.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 49.9 mm -100.01 118.56 46.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 179.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 82.4 t60 -146.5 119.1 8.52 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.07 -0.513 . . . . 0.0 109.646 -178.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.465 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 0.9 OUTLIER 63.84 31.93 13.72 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.418 0.449 . . . . 0.0 110.151 -175.687 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.2 mm? 71.84 -3.75 2.11 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.43 -176.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.616 HD21 ' HE2' ' A' ' 164' ' ' LYS . 93.1 mt -65.12 123.75 20.34 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.726 0.298 . . . . 0.0 110.417 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -114.01 108.38 16.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.296 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.495 ' CE1' HG21 ' A' ' 150' ' ' ILE . 0.5 OUTLIER -129.94 109.83 11.19 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.22 177.368 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.782 ' HA ' ' HB3' ' A' ' 70' ' ' TRP . 11.4 pt-20 -96.64 143.71 27.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.091 -176.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -132.96 136.68 46.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.041 177.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -82.19 127.61 33.33 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 176.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 48.0 pt -126.52 158.38 36.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-O 121.121 0.486 . . . . 0.0 111.284 -175.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 66' ' ' PHE . 7.3 pt-20 -159.26 170.16 22.48 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.793 174.535 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.553 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 39.4 p90 -167.93 146.59 4.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.118 0.485 . . . . 0.0 110.411 173.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -89.76 167.11 13.13 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.342 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.531 HG21 ' CH2' ' A' ' 28' ' ' TRP . 47.2 mm -114.36 89.46 17.87 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.572 -177.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -63.2 163.46 22.97 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.802 2.335 . . . . 0.0 111.925 175.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.402 ' N ' HD12 ' A' ' 88' ' ' ILE . 2.0 mp -62.31 -23.79 33.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-O 121.145 0.498 . . . . 0.0 110.938 -178.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.534 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 1.3 p -72.79 -12.75 61.12 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -178.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -73.02 141.0 81.02 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.404 ' HD3' ' O ' ' A' ' 20' ' ' ALA . 63.6 Cg_endo -97.55 8.63 36.05 Favored 'Cis proline' 0 N--CA 1.458 -0.564 0 C-N-CA 124.437 -1.068 . . . . 0.0 112.895 -0.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 25.2 m -60.6 -32.92 72.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.409 0.623 . . . . 0.0 110.429 -178.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.534 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 29.6 m -126.3 132.58 51.61 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 172.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.3 144.74 97.43 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.693 0.282 . . . . 0.0 111.509 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -82.51 158.35 16.81 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.693 2.262 . . . . 0.0 112.24 177.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -83.31 115.83 22.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.223 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.553 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 5.0 mp -73.9 131.38 35.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.294 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.445 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -100.72 123.0 44.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.933 0.396 . . . . 0.0 110.904 -179.022 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.0 t -129.33 87.09 54.56 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.37 178.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.75 -19.37 45.94 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 123.273 2.648 . . . . 0.0 113.917 -173.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.457 ' O ' ' HD3' ' A' ' 105' ' ' LYS . 7.8 tp10 -84.53 3.86 34.6 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.971 0.415 . . . . 0.0 110.985 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.7 mt -123.38 22.01 9.37 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 122.161 -0.337 . . . . 0.0 111.005 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -69.29 89.32 0.47 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.113 0.483 . . . . 0.0 111.146 -177.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 60.49 25.44 63.05 Favored Glycine 0 CA--C 1.52 0.358 0 CA-C-N 115.395 -0.821 . . . . 0.0 113.915 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' ' 101' ' ' GLU . 19.8 ptmt -116.08 13.41 15.82 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.178 0.489 . . . . 0.0 111.835 -177.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.2 t -123.12 -16.92 6.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.095 0.474 . . . . 0.0 110.118 172.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -170.7 -168.13 0.65 Allowed 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -177.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -65.1 -39.86 93.73 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 8.3 tpt 65.63 98.69 0.04 OUTLIER 'General case' 0 N--CA 1.461 0.12 0 O-C-N 124.079 0.862 . . . . 0.0 110.946 175.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -78.77 4.94 12.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.958 -175.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.457 ' HG3' ' SG ' ' A' ' 116' ' ' CYS . 30.5 mmt180 -120.01 -81.5 0.63 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.828 0.347 . . . . 0.0 110.186 175.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 153.63 -111.09 0.47 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.875 -0.678 . . . . 0.0 111.773 178.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -80.19 -11.95 83.77 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.902 -0.666 . . . . 0.0 111.859 178.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 98' ' ' ALA . 17.5 ptpt -105.06 140.32 38.41 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 178.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.42 HD11 ' HB ' ' A' ' 97' ' ' ILE . 2.8 pp -101.03 161.58 3.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.516 -179.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.457 ' SG ' ' HG3' ' A' ' 111' ' ' ARG . 73.3 m -138.47 161.93 35.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.019 178.331 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.4 mt -103.75 167.74 9.59 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.795 -177.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.0 t -57.81 156.52 8.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.143 -179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -50.8 -36.33 36.6 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.282 -178.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.427 ' O ' ' HD2' ' A' ' 123' ' ' PRO . 19.4 m170 -67.06 -21.58 65.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.591 -172.046 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -68.65 -36.55 78.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.217 -178.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.58 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 26.8 ttpp -60.97 -49.52 88.74 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -174.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.58 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 20.7 Cg_exo -66.82 -39.41 14.86 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 121.662 1.575 . . . . 0.0 112.19 174.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 51.4 tp -59.69 -49.28 78.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.129 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.42 ' O ' HG23 ' A' ' 129' ' ' VAL . 58.9 t-105 -57.62 -52.21 66.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.908 -176.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -69.09 -13.29 62.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.597 -176.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -91.82 -26.73 18.38 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.944 0.402 . . . . 0.0 110.376 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -85.35 -44.46 12.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.209 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.552 HG13 ' HA ' ' A' ' 130' ' ' PRO . 91.9 t -51.97 138.9 34.07 Favored Pre-proline 0 N--CA 1.471 0.577 0 O-C-N 123.704 0.627 . . . . 0.0 111.093 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.552 ' HA ' HG13 ' A' ' 129' ' ' VAL . 4.7 Cg_exo -81.48 -152.38 0.78 Allowed 'Cis proline' 0 C--N 1.353 0.814 0 C-N-CA 124.574 -1.011 . . . . 0.0 113.118 3.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm 76.02 -20.67 0.35 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.657 0.783 . . . . 0.0 111.322 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.8 -179.28 7.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.74 0.305 . . . . 0.0 110.546 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -179.86 -179.57 48.79 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.14 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.457 HD21 ' HZ ' ' A' ' 84' ' ' PHE . 55.5 tp -66.75 -37.21 84.19 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 122.625 0.37 . . . . 0.0 111.204 -176.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.31 -38.8 77.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.406 0.622 . . . . 0.0 110.404 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -71.67 -32.45 67.89 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.009 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 57.5 tp -66.55 -45.57 78.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.454 -179.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -35.94 74.77 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.119 -177.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -76.63 -50.47 13.69 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 86.9 mt -89.58 -14.06 35.89 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -173.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -108.16 -63.42 0.56 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.632 -179.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.505 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 60.9 tp -67.59 -40.83 84.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.471 0.177 . . . . 0.0 111.462 -175.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.08 -61.48 6.52 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.24 -0.505 . . . . 0.0 113.259 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . 0.439 ' O ' HG23 ' A' ' 148' ' ' VAL . 45.0 Cg_exo -59.17 -33.76 98.3 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.58 2.186 . . . . 0.0 112.568 177.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -62.7 -41.74 99.29 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.036 0.446 . . . . 0.0 110.424 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 97.9 mt -59.72 -36.14 75.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.628 177.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.79 -9.7 58.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.556 -178.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 144' ' ' PRO . 60.4 t -91.82 -56.04 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.668 0.271 . . . . 0.0 111.135 -179.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -89.63 -41.59 11.88 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -172.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.563 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.9 mm -56.2 -52.86 69.53 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -172.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.563 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 51.0 Cg_exo -55.44 -40.87 83.13 Favored 'Trans proline' 0 C--N 1.356 0.947 0 C-N-CA 122.04 1.827 . . . . 0.0 112.356 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -68.79 -39.99 79.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.234 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.561 HD12 ' HD2' ' A' ' 156' ' ' LYS . 21.7 tp -64.41 -28.93 70.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.983 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 150' ' ' ILE . 78.8 mt -63.92 -53.28 46.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.571 177.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -69.64 -14.43 62.81 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.175 0.512 . . . . 0.0 110.22 -178.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . 0.561 ' HD2' HD12 ' A' ' 153' ' ' LEU . 28.1 ttmt -69.03 -13.55 62.51 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.769 -178.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 91.6 -16.7 58.54 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.275 173.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.9 p -73.45 -31.58 33.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.701 0.286 . . . . 0.0 110.932 -178.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.556 HD11 HD23 ' A' ' 153' ' ' LEU . 57.4 mt -88.39 120.81 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.496 178.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -77.76 96.33 4.88 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 175.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -57.31 113.04 1.58 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.421 -174.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 64.0 mmtt -87.3 179.1 6.67 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.613 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 60.42 16.25 6.18 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 165.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.616 ' HE2' HD21 ' A' ' 76' ' ' LEU . 69.8 mmtt -84.69 -14.64 47.85 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.324 175.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 73.6 m 61.85 86.2 0.11 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.418 175.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -98.64 144.97 27.33 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 172.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -80.66 85.56 6.02 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.124 0.488 . . . . 0.0 111.902 -174.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 6.5 mp -109.62 92.62 4.12 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 168.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -81.3 77.06 8.22 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.833 0.825 . . . . 0.0 110.428 -174.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -85.95 94.18 9.13 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 172.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 15.5 t60 -53.16 124.92 15.78 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.653 0.595 . . . . 0.0 111.237 -172.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -75.41 90.13 2.67 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.412 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -80.91 157.21 25.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.452 -176.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -61.27 130.69 47.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.757 178.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 29.2 t-80 . . . . . 0 C--O 1.245 0.816 0 CA-C-O 118.793 -0.622 . . . . 0.0 109.733 178.434 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.03 94.18 6.13 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.962 0.41 . . . . 0.0 109.915 176.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.519 ' HB2' ' OG1' ' A' ' 6' ' ' THR . 3.1 m-20 -67.88 139.99 56.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.302 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -60.04 -36.53 77.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.737 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.434 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -65.44 -47.17 77.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.354 176.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.519 ' OG1' ' HB2' ' A' ' 3' ' ' ASP . 22.2 m -57.78 -54.74 43.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.355 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -62.53 -36.41 82.5 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.496 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.2 tpm_? -61.34 -44.5 97.08 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.794 0.331 . . . . 0.0 110.435 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.464 ' O ' HG13 ' A' ' 13' ' ' ILE . 92.0 t -67.5 -46.58 82.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.818 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 6' ' ' THR . 88.7 t -58.01 -45.28 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.885 -177.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 45.2 m -65.7 -19.37 65.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -103.59 13.22 33.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.655 0.264 . . . . 0.0 111.266 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 9' ' ' VAL . 52.1 mt -122.4 89.53 49.3 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.04 161.06 5.34 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.549 2.833 . . . . 0.0 113.723 -175.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.433 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 35.6 m -97.56 179.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.983 -179.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.999 HD21 ' HB3' ' A' ' 35' ' ' GLU . 7.1 mp -108.1 154.08 22.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.271 -176.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.555 ' HG2' ' OE1' ' A' ' 34' ' ' GLU . 36.1 mmtm -78.85 -66.47 0.86 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.536 0.684 . . . . 0.0 109.176 171.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 5.4 m -75.68 126.64 31.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.686 -176.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -120.77 81.82 1.82 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.415 0.626 . . . . 0.0 109.887 171.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -125.83 -173.38 2.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.895 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -127.27 -177.19 14.75 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.204 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.473 ' HD2' ' O ' ' A' ' 88' ' ' ILE . 39.3 Cg_exo -61.94 -5.4 6.11 Favored 'Trans proline' 0 CA--C 1.533 0.45 0 C-N-CA 123.265 2.644 . . . . 0.0 113.254 -179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 49.3 mtm105 -67.22 -41.64 85.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.305 0.574 . . . . 0.0 110.015 175.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.546 ' HB3' HD23 ' A' ' 27' ' ' LEU . 5.6 m-20 -92.44 95.11 9.46 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.102 177.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -58.69 -47.17 85.44 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -170.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -72.33 -38.69 68.57 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.085 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.546 HD23 ' HB3' ' A' ' 24' ' ' ASP . 3.6 mm? -68.58 -29.19 67.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.003 0.43 . . . . 0.0 110.252 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.49 ' O ' HD23 ' A' ' 32' ' ' LEU . 63.3 t-105 -62.24 -47.69 83.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.978 175.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 50.7 t -57.26 -35.1 47.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.644 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.401 HE21 ' HB3' ' A' ' 30' ' ' GLN . 23.8 mt-30 -70.2 -39.01 75.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.911 176.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.691 ' NH2' ' HG3' ' A' ' 91' ' ' PRO . 27.5 ttt-85 -64.26 -39.78 94.65 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.054 -0.351 . . . . 0.0 110.054 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.49 HD23 ' O ' ' A' ' 28' ' ' TRP . 4.0 mm? -52.72 -58.48 6.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.002 177.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -61.7 -35.48 78.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 121.248 -0.181 . . . . 0.0 111.105 -177.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.555 ' OE1' ' HG2' ' A' ' 17' ' ' LYS . 46.0 mm-40 -62.34 -54.63 37.68 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.484 179.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.999 ' HB3' HD21 ' A' ' 16' ' ' LEU . 15.5 pt-20 -77.57 -27.08 51.33 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.515 -177.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.551 ' O ' HG13 ' A' ' 40' ' ' ILE . 2.0 m-85 -55.06 -45.0 75.26 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 169.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -59.98 -41.58 92.31 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.86 0.362 . . . . 0.0 110.598 176.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.3 t -60.81 -43.7 97.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.938 176.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.481 ' O ' HG23 ' A' ' 43' ' ' VAL . 79.2 mt -61.35 -49.97 74.81 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.878 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 36' ' ' TYR . 81.0 mt -53.1 -43.36 48.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.58 -177.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.87 -44.26 97.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.682 0.277 . . . . 0.0 110.49 -179.297 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -66.8 -41.3 87.79 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.854 0.359 . . . . 0.0 110.204 177.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.509 HG12 ' HE2' ' A' ' 47' ' ' LYS . 80.4 t -59.92 -42.93 91.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.731 178.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 44.0 mt-10 -55.83 -54.08 48.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.506 177.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.3 m-20 -61.13 -50.26 73.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.662 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.65 ' ND2' ' HA ' ' A' ' 52' ' ' ASP . 10.5 t30 -72.39 -32.46 66.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.285 -169.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.509 ' HE2' HG12 ' A' ' 43' ' ' VAL . 42.8 mtmt -71.33 -45.53 62.78 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.845 176.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -69.61 -18.73 63.63 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.236 0.541 . . . . 0.0 110.226 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.13 -2.3 47.88 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.806 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.5 t70 59.62 37.7 22.39 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.842 0.829 . . . . 0.0 109.329 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -133.44 29.29 3.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.135 -173.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.65 ' HA ' ' ND2' ' A' ' 46' ' ' ASN . 9.6 p-10 -69.16 105.34 2.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.691 0.758 . . . . 0.0 110.012 178.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 43.5 p-90 -108.94 10.43 26.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.309 -170.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 37.2 p90 -158.05 156.93 31.94 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.651 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.426 ' O ' ' HA3' ' A' ' 67' ' ' GLY . 21.6 mmm180 -130.08 123.77 31.23 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.99 -1.004 . . . . 0.0 108.934 171.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 52.0 mt -123.56 124.62 43.22 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.149 0.5 . . . . 0.0 110.63 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -116.6 150.17 38.48 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.3 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.4 m -106.77 147.63 29.43 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.059 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -77.78 172.33 13.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 172.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -62.06 -23.45 66.5 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -175.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -91.99 -20.68 21.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.694 -177.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.66 16.9 80.01 Favored Glycine 0 C--O 1.228 -0.223 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.588 -175.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.0 p -98.79 -16.72 18.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.969 0.414 . . . . 0.0 111.367 -176.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -136.99 125.85 24.12 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.497 179.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 34.1 m95 -109.42 137.65 46.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.1 p90 -145.08 160.26 41.68 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.463 -176.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.426 ' HA3' ' O ' ' A' ' 55' ' ' ARG . . . 162.75 -159.33 31.68 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.33 -0.938 . . . . 0.0 112.51 178.079 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -121.23 146.83 46.4 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.898 0.38 . . . . 0.0 110.972 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 51.1 t -112.34 123.96 51.42 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 168.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.456 ' HD1' ' HG2' ' A' ' 79' ' ' GLU . 6.9 m0 -106.02 122.07 45.41 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.788 -177.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -118.74 118.66 32.22 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 176.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 30.8 mm -99.88 119.95 48.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -127.62 115.34 18.62 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.04 -176.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.473 ' C ' HD22 ' A' ' 75' ' ' LEU . 39.7 m-20 67.65 -85.8 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 124.027 0.829 . . . . 0.0 110.432 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.473 HD22 ' C ' ' A' ' 74' ' ' ASP . 3.0 mm? -137.04 0.63 2.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.882 0.372 . . . . 0.0 110.108 178.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.551 ' CD2' ' HA ' ' A' ' 164' ' ' LYS . 61.8 mt -108.69 149.61 28.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.335 -170.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -110.19 119.64 39.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.784 179.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -110.06 115.13 29.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.456 ' HG2' ' HD1' ' A' ' 70' ' ' TRP . 30.5 mt-10 -100.63 136.56 40.32 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.635 -175.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -128.93 116.76 19.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.814 177.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.73 131.83 36.74 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 176.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.461 HG22 HG22 ' A' ' 99' ' ' VAL . 23.3 pt -126.21 147.9 30.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.909 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -155.09 141.6 18.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.761 178.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.605 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 44.7 p90 -156.25 147.29 22.18 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.362 0.601 . . . . 0.0 111.652 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.544 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 5.2 p-10 -92.26 156.29 17.39 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.433 178.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.7 mm -104.88 90.87 3.83 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.403 179.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.544 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 71.5 Cg_exo -48.53 148.78 7.7 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.3 2.667 . . . . 0.0 113.189 -178.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.473 ' O ' ' HD2' ' A' ' 22' ' ' PRO . 50.3 mm -58.43 -27.54 33.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.1 -178.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.758 HG22 ' HB ' ' A' ' 92' ' ' THR . 4.1 m -93.52 17.58 11.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.964 0.411 . . . . 0.0 111.588 -178.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 91' ' ' PRO . 87.4 t80 -68.56 138.24 91.07 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 174.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.691 ' HG3' ' NH2' ' A' ' 31' ' ' ARG . 35.7 Cg_endo -97.83 12.35 33.59 Favored 'Cis proline' 0 C--N 1.346 0.446 0 C-N-CA 124.377 -1.093 . . . . 0.0 113.096 -1.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.758 ' HB ' HG22 ' A' ' 89' ' ' THR . 24.3 m -56.38 -35.82 68.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.401 0.619 . . . . 0.0 109.805 177.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 52.5 m -117.86 125.31 50.27 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.368 -0.833 . . . . 0.0 108.761 171.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.402 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -67.76 144.75 97.67 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-O 120.779 0.323 . . . . 0.0 111.528 -174.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 9.4 Cg_exo -71.52 124.91 10.72 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.777 2.318 . . . . 0.0 111.8 177.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.713 ' HB3' ' HD2' ' A' ' 114' ' ' LYS . 36.9 mt-10 -75.94 103.42 6.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.792 178.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.605 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 58.3 mt -70.01 136.36 26.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.626 -178.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -112.96 130.1 56.25 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.686 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.461 HG22 HG22 ' A' ' 82' ' ' ILE . 36.3 t -121.56 88.18 46.3 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.944 179.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -55.6 -29.53 70.54 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.999 2.466 . . . . 0.0 113.308 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -66.73 -36.25 82.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.777 0.322 . . . . 0.0 111.315 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 85.3 mt -90.96 1.06 57.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.972 0.415 . . . . 0.0 111.059 -177.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -65.24 109.58 2.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.821 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 98.58 -27.57 18.98 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 115.604 -0.725 . . . . 0.0 112.363 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -80.67 -12.41 59.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.888 0.375 . . . . 0.0 111.71 -175.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 t -137.81 148.2 45.26 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.923 0.392 . . . . 0.0 110.427 177.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -84.82 174.45 9.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.731 176.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' A' ' 108' ' ' LYS . 37.0 ttmt 66.87 12.13 8.73 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.57 0.7 . . . . 0.0 110.282 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 13.0 tpt -94.28 27.17 3.0 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.677 -173.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.687 ' O ' ' HG3' ' A' ' 111' ' ' ARG . 88.2 m-85 50.4 58.66 5.26 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.856 -177.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.687 ' HG3' ' O ' ' A' ' 110' ' ' TYR . 0.0 OUTLIER 50.32 16.02 0.24 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.372 1.069 . . . . 0.0 112.874 -176.601 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 105.48 123.21 5.16 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.974 -0.632 . . . . 0.0 112.741 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 129.09 -80.14 0.36 Allowed Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.437 175.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.713 ' HD2' ' HB3' ' A' ' 96' ' ' GLU . 71.3 mmtt -85.68 137.99 32.44 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.598 0.237 . . . . 0.0 110.625 -176.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.465 ' CD1' ' HB ' ' A' ' 97' ' ' ILE . 46.7 pt -76.83 157.61 5.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.428 0.633 . . . . 0.0 111.918 -178.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 49.5 t -125.29 113.53 17.73 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.1 173.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 88.3 mt -81.9 -82.2 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.015 0.436 . . . . 0.0 110.984 -176.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.6 t -163.39 154.42 16.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.368 -177.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -62.54 -30.03 71.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.504 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 43.6 t60 -73.4 -20.05 60.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.215 -175.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -68.54 -40.01 80.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.892 -174.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -61.35 -55.05 47.09 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -174.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.11 -32.77 83.35 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.702 1.601 . . . . 0.0 112.164 175.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.53 -43.51 76.58 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.892 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.534 ' O ' HG23 ' A' ' 129' ' ' VAL . 70.0 t-105 -61.56 -57.48 11.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.53 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.36 -30.06 68.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.929 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -77.7 -23.04 49.6 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.814 0.34 . . . . 0.0 111.529 -177.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.405 ' HB2' ' HE2' ' A' ' 132' ' ' PHE . 34.0 m-80 -106.0 10.29 32.29 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 125' ' ' TRP . 97.6 t -87.63 139.68 31.5 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 173.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.454 ' HA ' HG13 ' A' ' 129' ' ' VAL . 64.8 Cg_endo -95.6 -146.19 0.16 OUTLIER 'Cis proline' 0 C--N 1.353 0.77 0 C-N-CA 124.972 -0.845 . . . . 0.0 113.781 5.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.433 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 49.3 mtmt 75.07 11.06 3.63 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.698 -176.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . 0.405 ' HE2' ' HB2' ' A' ' 128' ' ' ASN . 0.2 OUTLIER -91.64 144.61 25.35 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.985 -179.863 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -146.57 167.42 28.09 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.47 -1.052 . . . . 0.0 110.47 178.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 43.6 tp -55.24 -33.13 62.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.143 0.471 . . . . 0.0 111.692 -177.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.87 -47.27 77.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.987 0.422 . . . . 0.0 111.43 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -71.29 -38.45 71.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.463 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.406 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 67.2 tp -65.33 -44.57 87.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.43 -177.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 15.8 tpt -66.56 -47.97 71.12 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.927 0.394 . . . . 0.0 110.916 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.417 ' O ' ' HD3' ' A' ' 144' ' ' PRO . . . -71.2 -44.8 64.7 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.131 -175.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.8 mt -94.74 -0.24 54.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.796 0.331 . . . . 0.0 111.665 -174.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -113.24 -75.12 0.69 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.282 -0.961 . . . . 0.0 112.722 -178.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.45 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 9.8 tt -67.49 -36.56 81.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.676 0.274 . . . . 0.0 110.832 -175.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.67 -61.85 6.86 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.177 -0.535 . . . . 0.0 113.274 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . 0.444 ' O ' HG23 ' A' ' 148' ' ' VAL . 32.9 Cg_exo -60.14 -33.04 95.32 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.549 2.166 . . . . 0.0 112.53 177.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 60.3 t90 -60.08 -39.55 86.48 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.903 0.383 . . . . 0.0 110.747 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 95.2 mt -58.04 -41.81 84.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.751 178.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.57 -15.06 63.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.819 -176.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 144' ' ' PRO . 56.3 t -88.06 -42.49 14.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.469 -177.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -104.02 -44.38 5.03 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -173.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.551 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.3 mm -55.99 -52.74 70.17 Favored Pre-proline 0 CA--C 1.54 0.562 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -170.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.551 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 51.8 Cg_exo -56.46 -31.62 86.47 Favored 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 122.01 1.807 . . . . 0.0 112.929 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -86.96 -26.72 23.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.833 0.349 . . . . 0.0 110.731 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.501 HD23 HD11 ' A' ' 159' ' ' ILE . 24.8 tp -70.21 -40.52 74.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.998 178.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 73.6 mt -63.19 -44.51 99.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.229 176.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.463 ' HA ' ' OE1' ' A' ' 155' ' ' GLN . 6.3 tp60 -69.44 -22.94 63.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.06 -177.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -83.19 -2.21 54.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.169 0.509 . . . . 0.0 110.303 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 72.05 24.18 76.88 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 115.817 -0.629 . . . . 0.0 113.025 175.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 40.2 t -84.53 -31.34 7.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.216 0.531 . . . . 0.0 110.722 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.501 HD11 HD23 ' A' ' 153' ' ' LEU . 53.8 mt -94.83 125.79 47.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.53 -179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -64.79 143.23 58.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.301 176.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -89.5 104.84 17.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.107 0.48 . . . . 0.0 109.905 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.88 159.74 16.03 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.756 -178.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 60.82 33.22 20.09 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 123.813 0.696 . . . . 0.0 111.551 -177.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.551 ' HA ' ' CD2' ' A' ' 76' ' ' LEU . 34.5 mtmm -62.03 -55.93 24.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.932 0.396 . . . . 0.0 110.421 -179.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 67.7 m -95.84 85.94 4.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.129 0.49 . . . . 0.0 109.982 176.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -98.85 -48.29 4.97 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.866 -178.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.442 ' HA ' ' OE1' ' A' ' 167' ' ' GLN . 5.9 tp60 -136.83 135.62 38.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.39 -174.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 58.6 tp -74.78 -37.56 62.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.605 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -89.71 125.17 35.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.67 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -113.64 -2.83 13.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.986 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -72.93 104.33 4.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.079 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -153.83 154.82 34.64 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.101 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -137.05 135.45 37.55 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.264 -177.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 12.0 p-80 -115.59 163.49 15.7 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 177.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 . . . . . 0 C--O 1.242 0.7 0 CA-C-O 118.516 -0.754 . . . . 0.0 109.658 176.903 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.08 131.62 21.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.584 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -80.42 -15.43 56.82 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.201 0.524 . . . . 0.0 110.393 178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -60.6 -46.39 90.43 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.71 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.457 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -56.81 -47.38 80.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.395 -179.071 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.7 m -64.0 -36.67 84.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.054 -179.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.17 -37.17 72.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.008 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -61.46 -38.84 88.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.894 0.378 . . . . 0.0 110.416 175.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 5' ' ' ALA . 88.5 t -57.28 -52.73 52.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.414 176.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 65.0 t -64.52 -35.32 74.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.504 -177.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.6 m -70.45 -36.28 73.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.801 -177.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.431 ' HB3' HD21 ' A' ' 45' ' ' ASN . 43.8 mt-10 -96.52 -16.93 20.84 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -176.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.446 HD12 HG13 ' A' ' 9' ' ' VAL . 25.6 mt -108.56 90.21 7.0 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 177.059 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -40.12 128.24 2.15 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.959 3.106 . . . . 0.0 113.872 -174.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.5 m -76.26 146.03 9.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.654 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.7 mp -100.94 131.64 46.72 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.109 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -110.7 -29.38 8.03 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.16 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.6 m -68.32 97.17 0.71 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.455 175.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -134.76 128.41 32.82 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.809 0.337 . . . . 0.0 110.588 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -146.97 -37.39 0.22 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.514 178.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.47 161.36 10.89 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.935 -0.65 . . . . 0.0 111.599 178.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -69.47 -7.45 20.99 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.73 2.286 . . . . 0.0 112.303 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.43 ' CG ' HG23 ' A' ' 88' ' ' ILE . 22.8 mmm180 -88.6 -3.01 58.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.718 178.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -112.76 103.55 11.56 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.607 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.3 OUTLIER -61.09 -52.18 66.01 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -170.28 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.607 ' HG3' HD22 ' A' ' 27' ' ' LEU . 11.0 pt-20 -72.87 -38.92 66.85 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.576 -0.45 . . . . 0.0 112.018 -171.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.607 HD22 ' HG3' ' A' ' 26' ' ' GLU . 4.0 mm? -71.98 -31.15 65.98 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.682 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 -68.21 -33.0 73.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.131 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 25' ' ' ARG . 67.0 t -58.2 -49.98 79.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.641 177.007 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -61.08 -47.25 87.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.784 0.326 . . . . 0.0 110.549 178.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.566 HH22 ' HA2' ' A' ' 133' ' ' GLY . 45.9 ttt-85 -64.44 -35.24 80.28 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -176.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.419 HD22 ' HA ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -60.59 -53.17 60.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.81 -177.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? -67.06 -41.14 86.96 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.046 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -64.71 -38.06 89.7 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.868 -179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -66.85 -36.32 82.07 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.442 ' O ' HG13 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -65.0 -46.94 79.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.25 178.731 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -63.03 -34.75 78.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.814 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -60.16 -46.64 88.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.866 174.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.524 ' O ' HG23 ' A' ' 43' ' ' VAL . 84.1 mt -61.02 -51.5 68.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.807 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.461 ' O ' ' HG3' ' A' ' 44' ' ' GLU . 80.5 mt -56.81 -40.84 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.339 -178.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -45.6 87.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.037 0.446 . . . . 0.0 110.304 178.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -67.63 -34.97 78.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.341 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 39' ' ' LEU . 84.1 t -62.35 -40.78 89.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.319 175.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 40' ' ' ILE . 49.3 mt-10 -58.78 -48.75 80.15 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.906 0.384 . . . . 0.0 110.198 175.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.431 HD21 ' HB3' ' A' ' 12' ' ' GLU . 6.5 m-20 -57.48 -40.25 78.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.837 177.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.52 -51.99 65.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.795 176.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.45 ' HE2' HG12 ' A' ' 43' ' ' VAL . 65.3 mttm -64.29 -28.86 70.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.384 -176.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -59.17 -41.03 87.44 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.638 175.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -90.56 -1.53 57.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.143 0.496 . . . . 0.0 110.49 177.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.0 t70 69.38 10.54 7.78 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.853 -178.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -95.76 68.17 2.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.521 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -81.67 86.6 6.38 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -97.85 -2.76 40.13 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -165.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -159.13 153.27 23.64 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.777 -0.769 . . . . 0.0 111.666 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -134.62 128.54 33.34 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 171.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.9 tp -131.08 125.13 32.38 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.58 -173.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -136.3 169.14 18.13 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.87 -0.419 . . . . 0.0 109.87 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.406 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 61.5 p -152.25 177.9 10.07 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.126 -179.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.466 ' OD1' ' HB2' ' A' ' 61' ' ' GLU . 4.2 p30 -71.52 163.89 26.88 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 168.569 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -73.38 -9.89 59.16 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.787 0.327 . . . . 0.0 111.737 -174.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.466 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 9.1 mm-40 -74.57 -36.43 63.06 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 171.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.99 20.97 69.11 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.509 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 15.3 p -90.74 -15.13 30.77 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.872 0.368 . . . . 0.0 111.556 -178.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 43.4 mtm180 -146.31 126.17 13.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.219 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.406 ' CD2' ' HB3' ' A' ' 58' ' ' SER . 50.0 m95 -114.26 158.27 21.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.693 -175.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -154.95 152.72 30.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.317 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.41 -162.61 29.47 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.336 178.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.413 ' HE3' ' HB2' ' A' ' 68' ' ' LYS . 35.6 ttmt -152.63 147.0 25.63 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.946 -0.391 . . . . 0.0 109.946 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 58.8 m -118.41 135.23 54.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.357 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 31.3 m-90 -114.52 121.69 44.28 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 176.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 73' ' ' HIS . 47.8 t80 -120.66 122.95 41.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.195 0.521 . . . . 0.0 110.56 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 27.8 mm -102.87 114.14 41.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.557 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 71' ' ' TYR . 14.5 t60 -130.21 105.23 7.78 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.137 179.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.3 t70 48.08 74.07 0.18 Allowed 'General case' 0 N--CA 1.465 0.297 0 O-C-N 124.307 1.004 . . . . 0.0 111.914 177.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 72.65 -33.52 0.27 Allowed 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.276 178.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.5 mt -74.87 123.56 25.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.032 0.444 . . . . 0.0 111.19 -178.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -115.66 119.01 34.7 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.213 177.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.417 ' CE1' ' HD2' ' A' ' 71' ' ' TYR . 7.1 p90 -140.03 144.96 37.17 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.503 177.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.04 148.8 50.12 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.333 -174.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -120.61 126.08 49.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.672 -177.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -88.2 114.85 25.23 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.525 HG22 HG22 ' A' ' 99' ' ' VAL . 47.9 pt -124.89 150.07 29.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.282 0.563 . . . . 0.0 112.137 -172.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -156.18 159.58 39.1 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.649 175.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.506 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 43.7 p90 -165.13 163.61 20.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.92 0.39 . . . . 0.0 110.741 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -112.16 157.6 20.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.654 -178.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.438 ' HA ' ' HD2' ' A' ' 87' ' ' PRO . 49.5 mm -107.26 90.32 5.57 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.657 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.438 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 19.8 Cg_endo -56.37 157.86 17.06 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 122.996 2.464 . . . . 0.0 112.948 -177.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.43 HG23 ' CG ' ' A' ' 23' ' ' ARG . 70.1 mt -61.85 -26.41 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.289 -179.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.7 p -81.41 9.24 7.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.112 -0.494 . . . . 0.0 112.228 -176.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.418 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 67.5 t80 -72.93 141.18 81.48 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.418 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 97.0 Cg_endo -96.68 14.23 36.98 Favored 'Cis proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.335 -1.111 . . . . 0.0 113.53 1.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.6 m -64.6 -35.53 81.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.372 0.606 . . . . 0.0 110.343 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.0 m -111.99 131.34 55.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 174.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.461 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . . . -77.59 143.29 67.62 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 120.634 0.254 . . . . 0.0 111.166 -178.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 94' ' ' ALA . 5.9 Cg_exo -79.97 123.51 5.19 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 123.208 2.606 . . . . 0.0 111.357 176.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 1.019 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 1.4 mp0 -84.59 126.16 33.09 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.178 -179.096 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.506 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 61.7 mt -72.86 134.6 29.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.459 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.436 ' HA ' ' HA ' ' A' ' 114' ' ' LYS . . . -105.89 128.93 54.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.721 0.296 . . . . 0.0 110.358 178.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.525 HG22 HG22 ' A' ' 82' ' ' ILE . 14.3 t -128.41 86.44 57.8 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.404 -178.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.8 -27.03 83.99 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 122.911 2.408 . . . . 0.0 112.814 -176.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -65.11 -27.37 68.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.122 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 72.7 mt -96.87 2.94 52.31 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.689 -176.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -64.15 118.76 9.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.792 0.329 . . . . 0.0 110.746 178.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 85.78 -21.94 13.17 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.995 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -74.61 -45.87 42.19 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 -179.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.7 t -107.5 155.55 19.95 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.628 176.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -85.36 -36.99 20.39 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.777 -177.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -82.18 50.5 1.6 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 121.141 0.496 . . . . 0.0 111.486 -174.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 54.7 ttm -125.49 124.22 40.87 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 172.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -85.36 159.57 19.98 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.216 0.531 . . . . 0.0 111.94 -172.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 60.1 mtm-85 -59.88 110.78 1.25 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.157 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 146.7 -27.06 1.64 Allowed Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 -174.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 102.13 -4.38 52.11 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.987 174.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 1.019 ' HD3' ' HB2' ' A' ' 96' ' ' GLU . 92.8 mttt -100.42 158.14 16.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.107 0.48 . . . . 0.0 111.211 -177.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 39.5 pt -78.96 176.57 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.846 -176.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 48.3 t -124.46 154.31 40.68 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.018 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 89.7 mt -124.97 -171.14 2.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.475 -176.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 7.1 t -89.91 158.48 17.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.919 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -62.93 -32.54 73.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.879 -177.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -73.95 -18.29 60.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.252 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -71.57 -38.27 70.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.344 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.465 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 73.4 mmtt -55.67 -58.76 13.97 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -176.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.465 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 38.2 Cg_endo -66.7 -34.61 31.22 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 121.744 1.629 . . . . 0.0 111.871 178.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.4 tp -60.83 -46.34 90.95 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.595 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.516 ' CZ3' HD13 ' A' ' 137' ' ' LEU . 40.8 t-105 -57.83 -57.08 14.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.698 178.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -64.87 -24.23 67.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.258 -174.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 -85.28 -20.52 29.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.714 0.292 . . . . 0.0 110.975 -177.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -105.81 36.53 2.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.125 0.488 . . . . 0.0 111.465 -177.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 98.2 t -116.77 130.96 24.18 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.469 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 89.6 Cg_endo -85.03 -149.64 0.49 Allowed 'Cis proline' 0 C--N 1.348 0.505 0 C-N-CA 123.973 -1.261 . . . . 0.0 113.267 1.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 99.3 mttt 75.98 9.16 3.41 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.862 0.865 . . . . 0.0 111.027 -174.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -114.94 165.6 12.69 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.566 ' HA2' HH22 ' A' ' 31' ' ' ARG . . . -163.15 175.17 39.49 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.957 -178.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 44.6 tp -67.61 -38.79 84.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.724 0.297 . . . . 0.0 110.606 -177.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.7 -35.94 77.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.399 0.618 . . . . 0.0 110.415 176.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -71.55 -33.5 69.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.305 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.516 HD13 ' CZ3' ' A' ' 125' ' ' TRP . 54.8 tp -64.21 -35.62 81.39 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.844 177.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.1 mmt -69.8 -45.03 68.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.919 0.39 . . . . 0.0 110.873 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.59 -44.12 67.98 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.856 -177.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.3 mt -96.42 0.85 51.06 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -174.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -123.54 -68.78 0.22 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.812 -178.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 58.6 tp -65.38 -41.0 94.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.663 0.268 . . . . 0.0 111.104 -176.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.0 -61.9 6.46 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.413 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . 0.488 ' O ' HG23 ' A' ' 148' ' ' VAL . 24.0 Cg_endo -64.19 -30.37 64.71 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.492 2.128 . . . . 0.0 112.728 177.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 85.4 t90 -59.66 -45.93 90.56 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.016 0.436 . . . . 0.0 110.479 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 96.7 mt -58.53 -35.36 72.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.953 179.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -80.28 0.41 32.9 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -176.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 144' ' ' PRO . 89.6 t -95.0 -55.39 6.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.893 0.378 . . . . 0.0 111.098 178.208 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -96.26 -41.3 8.74 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -173.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.554 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 44.6 mm -55.96 -53.61 61.32 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -169.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.554 ' HD3' ' HB ' ' A' ' 150' ' ' ILE . 50.9 Cg_exo -54.88 -42.73 66.13 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.853 1.702 . . . . 0.0 112.302 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -74.44 -29.59 61.55 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.476 0.655 . . . . 0.0 110.441 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.54 ' HB3' HD11 ' A' ' 159' ' ' ILE . 13.9 tp -69.1 -34.15 74.63 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.642 178.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.53 HG13 ' O ' ' A' ' 150' ' ' ILE . 79.8 mt -63.98 -43.21 97.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.375 175.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -66.11 -28.05 68.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.187 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . 0.52 ' HE2' HD12 ' A' ' 153' ' ' LEU . 37.2 mtmm -76.72 -20.6 56.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.816 0.341 . . . . 0.0 110.73 177.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 92.86 -8.02 76.58 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.916 -0.659 . . . . 0.0 114.045 170.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.4 p -67.06 -30.61 50.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 117.012 0.406 . . . . 0.0 111.642 -175.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.54 HD11 ' HB3' ' A' ' 153' ' ' LEU . 36.3 mt -67.68 153.11 9.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.518 178.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -50.84 138.32 19.01 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.081 0.467 . . . . 0.0 111.246 178.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 17.5 m80 -140.49 99.19 3.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.988 -177.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -94.88 -59.61 1.87 Allowed 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -89.17 147.24 24.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.419 174.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -126.82 -76.1 0.58 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.618 175.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 26.2 t 68.75 2.4 3.46 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.003 178.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -122.15 107.59 12.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.351 0.596 . . . . 0.0 110.149 178.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -89.91 75.8 7.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.62 0.724 . . . . 0.0 110.782 -174.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 98.3 mt -115.39 135.95 53.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 172.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -112.85 118.29 34.5 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.244 0.545 . . . . 0.0 112.094 -172.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 56.7 m170 -94.8 174.35 7.14 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 169.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 18.2 m80 -70.03 136.29 50.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.148 0.499 . . . . 0.0 110.518 178.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -67.54 -46.14 73.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.949 -169.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -78.27 130.77 36.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.269 0.557 . . . . 0.0 111.712 -175.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 23.0 p80 -152.6 171.67 17.79 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.23 -0.896 . . . . 0.0 108.851 172.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 45.6 p-80 . . . . . 0 C--O 1.247 0.945 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 175.398 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.3 mtt . . . . . 0 N--CA 1.481 1.089 0 CA-C-O 120.958 0.408 . . . . 0.0 109.983 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.87 164.35 35.59 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.294 -179.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.454 ' HA ' ' OG1' ' A' ' 6' ' ' THR . 38.8 t70 70.71 1.47 3.72 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.808 0.692 . . . . 0.0 111.834 176.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.1 -52.65 64.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.71 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.473 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -66.73 -40.57 88.42 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.281 -177.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.508 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.7 OUTLIER -66.54 -46.89 74.63 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -175.938 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -66.27 -28.0 68.37 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.044 0.45 . . . . 0.0 110.203 -179.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -67.7 -43.54 79.85 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.154 175.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 5' ' ' ALA . 86.2 t -63.41 -40.72 90.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.462 177.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 6' ' ' THR . 91.6 t -64.12 -27.29 42.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.95 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.6 m -69.12 -26.68 65.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.737 0.303 . . . . 0.0 110.832 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -94.12 -7.82 41.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.772 0.32 . . . . 0.0 111.843 176.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.448 HG12 ' HB2' ' A' ' 42' ' ' TYR . 45.6 mt -118.55 86.75 29.68 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 175.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.656 ' HD2' ' HA ' ' A' ' 38' ' ' SER . 73.2 Cg_exo -49.3 151.99 6.04 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.71 2.94 . . . . 0.0 113.878 -172.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.605 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 30.2 m -85.15 151.83 3.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.414 178.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.506 ' O ' ' HA ' ' A' ' 131' ' ' LYS . 7.1 mp -86.81 134.57 33.54 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.316 -179.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -91.41 -44.15 9.31 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.064 178.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 m -66.13 -74.8 0.1 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.627 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.459 ' OD1' ' HG3' ' A' ' 91' ' ' PRO . 38.8 t30 45.83 43.66 10.19 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.333 176.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.59 -84.49 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.378 -176.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 167.12 172.54 34.45 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.86 178.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -71.0 -11.34 29.09 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 123.184 2.589 . . . . 0.0 112.464 -178.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 mtp-105 -66.94 -48.6 68.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.616 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.497 ' HB3' HD23 ' A' ' 27' ' ' LEU . 15.0 m-20 -84.31 104.9 14.72 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.567 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 72.5 mtm180 -58.12 -51.8 68.19 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.551 ' HG2' HD22 ' A' ' 27' ' ' LEU . 1.4 pm0 -72.83 -26.28 61.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.642 0.258 . . . . 0.0 111.405 -177.059 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.551 HD22 ' HG2' ' A' ' 26' ' ' GLU . 3.9 mm? -80.29 -30.95 38.31 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.709 0.29 . . . . 0.0 110.653 178.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.43 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 60.5 t-105 -67.35 -46.83 72.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.167 177.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 90.9 t -60.74 -38.36 78.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.943 0.402 . . . . 0.0 110.445 177.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -70.55 -32.89 70.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.901 0.382 . . . . 0.0 110.161 177.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 67.0 ttt-85 -69.21 -33.16 72.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.123 177.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 28' ' ' TRP . 90.5 mt -58.39 -42.48 87.18 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.975 174.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -59.55 -47.52 85.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.282 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -54.94 -48.37 73.23 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.945 178.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -61.84 -48.2 81.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.084 178.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -65.11 -32.3 73.93 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -178.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -58.96 -45.3 90.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.228 0.537 . . . . 0.0 109.994 174.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.656 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 8.3 m -70.77 -44.22 67.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.57 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.448 ' O ' HG23 ' A' ' 43' ' ' VAL . 80.1 mt -60.17 -55.35 34.86 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.25 -179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 85.9 mt -58.05 -46.52 88.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.72 -176.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -58.81 -49.03 79.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.649 -0.25 . . . . 0.0 110.786 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.448 ' HB2' HG12 ' A' ' 13' ' ' ILE . 67.6 t80 -63.06 -49.85 72.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.711 0.291 . . . . 0.0 111.106 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.623 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 93.8 t -59.49 -45.69 93.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.904 -177.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -67.29 -35.0 78.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.667 0.27 . . . . 0.0 111.109 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -60.14 -39.9 87.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.749 0.309 . . . . 0.0 110.256 173.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.443 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 4.9 m-20 -71.65 -32.44 67.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.856 177.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.623 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 34.0 mmtp -57.79 -43.86 85.9 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.209 0.528 . . . . 0.0 110.047 174.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -72.76 -21.46 61.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.933 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -91.72 2.17 56.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.361 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.7 t70 63.43 23.76 13.84 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.583 0.706 . . . . 0.0 110.874 178.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.443 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 16.9 t30 -125.3 66.52 1.14 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.691 0.758 . . . . 0.0 110.48 -178.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -86.27 106.45 17.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.283 -0.871 . . . . 0.0 108.882 174.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 45.9 p-90 -120.61 6.85 10.52 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -168.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 69' ' ' CYS . 13.8 p90 -162.83 154.23 17.65 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.826 -0.75 . . . . 0.0 112.157 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -138.54 124.4 19.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.003 167.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.7 tp -117.13 124.54 49.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.709 -177.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -131.55 155.56 47.27 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.841 -174.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.6 t -149.12 176.99 10.01 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.105 0.479 . . . . 0.0 110.827 -177.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -86.11 176.73 7.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.463 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 41.5 mmtm -66.53 -19.94 65.9 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -174.753 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -87.36 -17.58 32.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.714 0.292 . . . . 0.0 110.408 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.13 28.63 73.17 Favored Glycine 0 C--N 1.332 0.354 0 C-N-CA 121.133 -0.556 . . . . 0.0 112.552 -179.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.5 p -85.83 -33.1 21.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.04 0.448 . . . . 0.0 111.812 -177.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -129.18 116.1 18.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.661 -179.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -102.33 128.19 49.0 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -136.5 159.46 41.72 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.978 -176.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 172.34 -165.75 38.39 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 119.867 -1.159 . . . . 0.0 112.372 178.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.5 pttm -142.38 139.74 31.82 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.041 0.448 . . . . 0.0 110.624 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 54' ' ' PHE . 45.7 m -112.49 153.31 27.63 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.263 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 26.0 m-90 -117.67 123.57 46.43 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.025 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -117.96 120.56 38.21 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 177.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.9 mm -88.21 114.71 27.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.892 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -148.35 110.63 4.64 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.401 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.7 t70 66.83 62.93 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.338 175.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 94.3 mt 68.57 -13.12 0.33 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.143 -0.935 . . . . 0.0 113.158 173.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 78.9 mt -109.06 136.67 48.19 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.259 0.552 . . . . 0.0 111.869 -175.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -93.44 112.22 24.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.287 174.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -97.86 130.26 44.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.715 -0.22 . . . . 0.0 111.043 -178.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -96.97 136.1 38.02 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -126.19 123.93 39.3 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -88.82 131.3 35.14 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.144 0.497 . . . . 0.0 110.054 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.52 HG22 HG22 ' A' ' 99' ' ' VAL . 46.5 pt -131.78 151.37 35.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.602 -178.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -153.22 155.33 36.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.83 174.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 35.3 p90 -159.05 152.73 23.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.4 176.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.54 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 2.2 p30 -97.94 155.24 17.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.673 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.6 mm -106.25 91.12 5.3 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.979 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.54 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 51.4 Cg_exo -54.75 153.89 22.81 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.882 2.388 . . . . 0.0 112.373 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 43.4 mt -61.25 -24.93 34.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.179 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.2 p -88.83 13.32 12.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.049 -178.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.542 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 61.4 t80 -77.59 145.65 71.78 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 176.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.542 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 50.2 Cg_endo -91.45 14.25 50.44 Favored 'Cis proline' 0 C--N 1.349 0.571 0 C-N-CA 124.305 -1.123 . . . . 0.0 114.072 0.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 86.4 m -62.02 -44.65 96.25 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.02 0.438 . . . . 0.0 110.128 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 39.2 m -102.64 119.39 38.75 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.036 174.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -70.71 144.48 91.05 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -78.81 172.73 14.6 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 122.9 2.4 . . . . 0.0 112.868 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.611 ' HB2' ' HD3' ' A' ' 114' ' ' LYS . 19.5 mt-10 -107.75 122.18 46.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.197 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.418 ' O ' HG12 ' A' ' 115' ' ' ILE . 34.8 mm -75.55 124.38 33.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.508 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.578 ' HB2' ' HG2' ' A' ' 114' ' ' LYS . . . -109.38 129.53 55.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.928 0.394 . . . . 0.0 111.162 179.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.52 HG22 HG22 ' A' ' 82' ' ' ILE . 21.9 t -123.52 86.58 52.39 Favored Pre-proline 0 C--O 1.237 0.401 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.832 178.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.69 -31.36 94.7 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.289 2.659 . . . . 0.0 113.753 -173.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -68.58 -28.8 67.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.842 0.353 . . . . 0.0 110.973 -177.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 82.4 mt -97.42 13.26 30.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.666 0.269 . . . . 0.0 111.175 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.75 106.39 0.4 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.715 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 88.8 -1.15 83.26 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.974 178.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -93.55 -16.0 24.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.887 0.375 . . . . 0.0 110.842 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.521 ' HB ' HD21 ' A' ' 153' ' ' LEU . 3.3 t -135.88 151.34 49.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.098 -178.033 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -84.32 0.97 47.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.964 179.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -86.96 16.48 4.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.955 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.507 ' HG2' HG23 ' A' ' 106' ' ' THR . 22.8 mmt -97.01 130.79 44.28 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.952 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 5.0 m-30 -109.22 -72.99 0.7 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.189 0.519 . . . . 0.0 110.426 176.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -94.19 85.89 4.79 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.566 -175.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 65.73 -102.47 0.7 Allowed Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.112 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -106.66 6.6 38.34 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.192 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.611 ' HD3' ' HB2' ' A' ' 96' ' ' GLU . 84.5 mttt -86.31 124.4 32.63 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.084 0.469 . . . . 0.0 110.419 177.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.418 HG12 ' O ' ' A' ' 97' ' ' ILE . 37.4 pt -76.73 158.01 5.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.227 -176.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 25.8 p -91.94 124.04 35.75 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.604 178.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 89.0 mt -86.71 161.1 18.61 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.3 173.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.405 ' O ' ' HB3' ' A' ' 121' ' ' PHE . 6.1 t -69.95 153.51 43.15 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.002 0.43 . . . . 0.0 111.268 -173.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -58.13 -49.62 76.32 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.883 -177.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -68.61 -4.07 14.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.69 -176.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.405 ' HB3' ' O ' ' A' ' 118' ' ' THR . 75.5 t80 -66.13 -47.39 74.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.863 -0.153 . . . . 0.0 110.96 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.535 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 39.6 mmtm -59.65 -51.97 77.29 Favored Pre-proline 0 CA--C 1.537 0.449 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.52 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.535 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 50.0 Cg_exo -56.44 -41.4 76.57 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 121.941 1.761 . . . . 0.0 112.193 174.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 45.4 tp -67.14 -38.04 84.83 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.01 0.433 . . . . 0.0 110.673 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.401 ' O ' HG23 ' A' ' 129' ' ' VAL . 66.8 t-105 -59.07 -57.44 13.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.294 178.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -67.21 -21.7 65.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.562 -178.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 123' ' ' PRO . 48.5 ttt180 -71.54 -29.34 64.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.482 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -98.61 -39.61 8.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.503 -177.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.644 HG13 ' HA ' ' A' ' 130' ' ' PRO . 70.5 t -57.52 142.84 76.35 Favored Pre-proline 0 CA--C 1.533 0.319 0 O-C-N 123.373 0.421 . . . . 0.0 110.261 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.644 ' HA ' HG13 ' A' ' 129' ' ' VAL . 5.0 Cg_exo -79.12 -163.07 3.21 Favored 'Cis proline' 0 C--N 1.355 0.872 0 C-N-CA 125.008 -0.83 . . . . 0.0 113.838 2.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.605 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 96.7 mttt 72.81 -18.53 0.35 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.545 0.738 . . . . 0.0 111.611 -178.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . 0.417 ' H ' ' C ' ' A' ' 130' ' ' PRO . 8.8 t80 -77.01 158.51 30.55 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.131 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -159.63 -179.59 34.54 Favored Glycine 0 C--O 1.236 0.235 0 C-N-CA 119.999 -1.096 . . . . 0.0 112.84 -174.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.427 HD12 HD23 ' A' ' 137' ' ' LEU . 58.8 tp -64.38 -37.48 87.67 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 122.999 0.52 . . . . 0.0 111.195 -175.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -56.63 -40.68 75.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.523 0.678 . . . . 0.0 110.66 177.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -71.32 -35.37 71.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.968 178.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.427 HD23 HD12 ' A' ' 134' ' ' LEU . 50.2 tp -66.07 -37.12 85.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.167 178.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . 0.468 ' HA ' ' CE ' ' A' ' 138' ' ' MET . 17.9 mmt -62.21 -48.18 81.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.865 0.364 . . . . 0.0 110.441 177.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.89 -49.12 49.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.086 -177.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 96.8 mt -95.4 10.18 37.3 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -172.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -124.23 -67.19 0.2 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.295 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.596 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 53.7 tp -65.79 -42.51 90.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.788 -0.206 . . . . 0.0 111.038 -177.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.43 -61.44 6.99 Favored Glycine 0 CA--C 1.525 0.662 0 CA-C-N 116.111 -0.495 . . . . 0.0 113.627 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . 0.431 ' O ' HG23 ' A' ' 148' ' ' VAL . 17.0 Cg_endo -59.59 -37.38 88.75 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.555 2.17 . . . . 0.0 112.799 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 68.6 t90 -61.44 -44.38 97.21 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.963 0.411 . . . . 0.0 110.248 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 94.2 mt -59.04 -36.19 74.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.007 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.0 -15.64 61.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.85 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 144' ' ' PRO . 61.4 t -93.02 -53.96 7.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.282 -178.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -90.75 -43.53 10.04 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -171.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.479 ' HB ' ' HD3' ' A' ' 151' ' ' PRO . 46.3 mm -59.51 -49.91 89.82 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -169.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.511 ' HD3' ' O ' ' A' ' 146' ' ' LEU . 50.5 Cg_exo -56.06 -30.81 80.27 Favored 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 122.105 1.87 . . . . 0.0 112.879 -178.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -87.26 -37.87 16.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 109.994 177.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.611 HD22 ' HD3' ' A' ' 156' ' ' LYS . 0.2 OUTLIER -59.24 -42.76 91.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.554 -179.865 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 72.0 mt -64.47 -39.63 86.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.018 0.437 . . . . 0.0 110.353 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -66.09 -27.31 67.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.026 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . 0.611 ' HD3' HD22 ' A' ' 153' ' ' LEU . 59.6 mtpt -63.93 -22.25 66.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.788 175.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 72.74 16.45 77.95 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.409 178.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 17.0 m -92.46 -6.18 10.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.072 0.463 . . . . 0.0 111.308 -178.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.469 HD11 HD12 ' A' ' 153' ' ' LEU . 55.6 mt -94.74 101.48 12.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.125 175.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . 0.491 ' OE1' ' HA ' ' A' ' 160' ' ' GLN . 6.0 tp60 -79.17 123.31 27.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 176.599 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -142.57 147.48 35.97 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -175.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.46 ' HD2' ' N ' ' A' ' 162' ' ' LYS . 4.0 mptp? -69.76 167.49 17.03 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.02 -164.88 1.62 Allowed 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.838 -172.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -78.82 -18.82 53.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 -169.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 49.3 t -71.0 -33.12 70.09 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.056 -0.403 . . . . 0.0 110.746 -177.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -90.67 18.88 5.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.769 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -62.86 147.12 51.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.974 0.416 . . . . 0.0 110.773 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 58.6 tp -130.33 122.38 27.8 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.611 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -76.96 95.13 4.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.85 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 15.2 p80 -86.82 65.39 8.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.858 0.837 . . . . 0.0 111.083 -177.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -136.73 92.06 2.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.747 174.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 -87.81 -39.88 14.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.344 -172.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.59 147.7 26.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.415 -177.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -83.81 -38.44 21.25 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 174.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 24.5 m80 . . . . . 0 C--O 1.247 0.929 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.498 172.564 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ptm . . . . . 0 N--CA 1.482 1.174 0 CA-C-O 120.688 0.28 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.34 86.62 6.53 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -174.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 70.34 135.15 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 O-C-N 123.953 0.783 . . . . 0.0 113.112 173.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -72.88 -27.66 62.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.374 177.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.469 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -67.63 -42.83 81.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.969 -178.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.452 ' O ' HG23 ' A' ' 10' ' ' VAL . 6.0 m -56.5 -54.52 44.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.097 -178.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -64.91 -31.89 73.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.091 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -64.3 -44.36 91.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.606 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 5' ' ' ALA . 66.0 t -62.86 -38.51 82.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.469 179.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 6' ' ' THR . 61.6 t -62.66 -33.1 58.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.178 179.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -69.92 -25.66 63.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.479 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.428 ' O ' ' HD3' ' A' ' 14' ' ' PRO . 42.6 mt-10 -93.63 -13.07 28.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.882 0.373 . . . . 0.0 111.227 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.7 mt -113.76 87.06 11.63 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.428 ' HD3' ' O ' ' A' ' 12' ' ' GLU . 50.9 Cg_exo -54.58 147.04 50.44 Favored 'Trans proline' 0 C--O 1.237 0.463 0 C-N-CA 123.453 2.768 . . . . 0.0 113.175 -173.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.48 ' HB ' ' HB3' ' A' ' 131' ' ' LYS . 27.7 m -72.34 161.38 4.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.192 176.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.719 HD23 ' HG3' ' A' ' 31' ' ' ARG . 10.2 mp -79.97 134.7 36.27 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.114 0.483 . . . . 0.0 111.532 -173.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.477 ' HB3' ' HG3' ' A' ' 34' ' ' GLU . 59.6 tttm -60.25 -44.08 95.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.852 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.547 HG21 HD12 ' A' ' 27' ' ' LEU . 31.7 m -129.38 130.02 45.49 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.946 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.67 ' HA ' ' HD3' ' A' ' 31' ' ' ARG . 16.8 m120 -120.43 119.63 33.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.752 0.311 . . . . 0.0 110.519 174.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -153.75 170.7 20.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.084 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.45 167.19 42.64 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.291 -178.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -72.56 3.65 4.1 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.397 2.732 . . . . 0.0 113.027 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.613 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 1.1 mmp_? -94.17 -26.24 16.77 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.308 0.575 . . . . 0.0 109.903 174.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -83.43 75.87 9.96 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.38 -0.971 . . . . 0.0 108.38 172.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -53.98 -41.95 68.45 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -169.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -58.25 -52.1 67.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.212 0.53 . . . . 0.0 110.911 179.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.547 HD12 HG21 ' A' ' 18' ' ' THR . 3.1 mm? -76.7 -23.51 53.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.743 -177.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.559 ' CH2' HG21 ' A' ' 86' ' ' ILE . 28.5 t-105 -64.29 -52.1 60.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.462 175.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.5 t -63.5 -33.71 63.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.084 0.468 . . . . 0.0 110.054 178.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -70.28 -42.81 71.6 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.495 178.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.719 ' HG3' HD23 ' A' ' 16' ' ' LEU . 51.5 ttp85 -64.54 -42.96 95.38 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 176.32 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -54.53 -50.01 68.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.722 -177.74 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.04 -33.13 71.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.532 0.206 . . . . 0.0 111.143 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.477 ' HG3' ' HB3' ' A' ' 17' ' ' LYS . 71.0 mm-40 -70.23 -45.63 66.12 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.286 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.565 ' HB3' HD21 ' A' ' 16' ' ' LEU . 15.3 pt-20 -75.01 -27.46 60.13 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.161 177.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.524 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -55.28 -44.27 75.53 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 169.445 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -63.96 -38.81 92.45 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.691 176.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.9 t -61.44 -40.23 93.71 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.031 -0.532 . . . . 0.0 109.711 174.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.426 ' O ' HG23 ' A' ' 43' ' ' VAL . 52.7 mt -63.31 -40.51 97.54 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.659 174.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 36' ' ' TYR . 77.4 mt -61.43 -35.56 67.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.868 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' A' ' 44' ' ' GLU . 0.5 OUTLIER -66.75 -36.33 82.19 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 177.115 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -68.74 -47.74 65.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.928 176.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 39' ' ' LEU . 87.4 t -62.05 -32.6 54.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.328 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.448 ' HB3' ' O ' ' A' ' 41' ' ' ARG . 28.1 tt0 -52.89 -59.21 4.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.361 176.188 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -57.21 -36.77 71.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.289 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -64.02 -43.82 94.42 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.679 176.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.516 ' HA ' ' HE2' ' A' ' 47' ' ' LYS . 7.6 mmpt? -68.52 -37.01 79.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.78 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -57.9 -35.3 70.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.98 0.419 . . . . 0.0 110.47 177.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -96.23 -2.29 46.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.091 178.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.9 t70 60.36 20.93 10.49 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 121.907 0.861 . . . . 0.0 110.442 -177.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -112.87 60.15 0.64 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.59 -177.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -85.9 86.15 7.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 122.045 0.926 . . . . 0.0 109.902 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -83.22 -7.37 59.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.06 -177.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.47 ' HZ ' HD22 ' A' ' 56' ' ' LEU . 60.6 t80 -115.49 122.39 45.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.829 -173.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -127.68 124.48 38.01 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 176.185 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.47 HD22 ' HZ ' ' A' ' 54' ' ' PHE . 19.3 tp -144.94 124.95 13.53 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.772 -175.176 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -109.09 159.6 16.74 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.031 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 m -132.88 161.74 33.41 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.636 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -93.53 171.74 8.71 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 173.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -62.0 -28.3 69.48 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 -175.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.0 -23.7 48.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.791 0.329 . . . . 0.0 110.607 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.21 7.88 84.96 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.954 -0.641 . . . . 0.0 111.584 -172.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.9 p -83.24 -14.85 52.34 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -174.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -134.11 130.54 37.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.064 0.459 . . . . 0.0 111.029 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 46.0 m95 -118.65 126.29 51.62 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.342 175.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -139.82 140.3 36.57 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.088 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -175.68 -160.35 23.16 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.216 -0.993 . . . . 0.0 112.554 -178.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.537 ' HG2' ' HA ' ' A' ' 81' ' ' ASP . 96.7 mttt -144.19 154.93 43.64 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.956 0.408 . . . . 0.0 110.769 -176.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 62.6 m -112.35 132.13 55.16 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.795 175.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.512 ' CD1' ' HG2' ' A' ' 79' ' ' GLU . 3.2 m-90 -107.58 122.59 46.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.213 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -130.45 120.03 23.57 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.058 0.456 . . . . 0.0 109.823 172.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.445 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.7 mp -98.53 117.29 43.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.639 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.441 ' HB3' ' HE2' ' A' ' 78' ' ' TYR . 39.3 t60 -139.06 117.97 12.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.99 -176.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 60.34 52.21 4.95 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.812 0.695 . . . . 0.0 111.037 176.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.0 mt 70.62 1.96 3.91 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.631 176.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.427 HD23 ' HG3' ' A' ' 164' ' ' LYS . 63.1 mt -111.08 128.71 55.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.088 0.471 . . . . 0.0 111.512 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -93.24 107.22 19.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.424 174.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.441 ' HE2' ' HB3' ' A' ' 73' ' ' HIS . 77.8 m-85 -89.93 123.37 33.8 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.512 ' HG2' ' CD1' ' A' ' 70' ' ' TRP . 33.1 mt-10 -111.08 134.92 52.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.809 -179.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -132.93 117.72 18.01 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.537 ' HA ' ' HG2' ' A' ' 68' ' ' LYS . 5.7 p-10 -87.84 136.91 32.75 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.156 0.503 . . . . 0.0 111.031 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.499 HG22 ' HB ' ' A' ' 99' ' ' VAL . 37.0 pt -136.22 149.66 27.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.486 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.48 153.04 37.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.351 0.596 . . . . 0.0 110.938 173.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -161.7 158.2 25.58 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.109 177.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -107.16 173.29 6.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.143 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.559 HG21 ' CH2' ' A' ' 28' ' ' TRP . 50.4 mm -111.81 89.22 10.92 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.922 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 86' ' ' ILE . 32.3 Cg_endo -63.89 162.61 28.18 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.446 2.097 . . . . 0.0 111.905 177.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.439 HD12 ' N ' ' A' ' 88' ' ' ILE . 3.0 mp -61.97 -23.41 31.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.271 -177.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.545 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 12.1 p -68.36 -18.74 64.55 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.873 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.597 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 62.8 t80 -77.02 141.32 67.46 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.597 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 83.7 Cg_endo -95.44 11.39 44.44 Favored 'Cis proline' 0 N--CA 1.458 -0.595 0 C-N-CA 124.454 -1.061 . . . . 0.0 113.749 2.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 33.3 m -60.77 -42.17 96.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.428 0.632 . . . . 0.0 110.18 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.545 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 31.9 m -121.7 125.98 47.88 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.464 175.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.68 144.0 98.75 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.605 -0.271 . . . . 0.0 110.713 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.414 ' HD3' ' CD1' ' A' ' 90' ' ' TYR . 82.6 Cg_endo -82.0 150.18 15.9 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.65 2.234 . . . . 0.0 112.135 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -79.94 100.35 8.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.911 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.541 ' HB ' HD11 ' A' ' 115' ' ' ILE . 56.6 mt -67.38 130.75 32.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.18 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -105.19 137.47 42.91 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.947 0.403 . . . . 0.0 110.711 -178.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.499 ' HB ' HG22 ' A' ' 82' ' ' ILE . 3.8 p -128.8 88.09 52.91 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-O 121.478 0.656 . . . . 0.0 110.431 177.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 99' ' ' VAL . 16.1 Cg_endo -56.29 -30.47 80.69 Favored 'Trans proline' 0 CA--C 1.529 0.255 0 C-N-CA 123.258 2.638 . . . . 0.0 113.496 -174.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -67.79 -40.4 83.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.906 0.384 . . . . 0.0 111.183 -179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.486 HD23 ' HG3' ' A' ' 105' ' ' LYS . 87.7 mt -85.99 5.47 33.16 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -174.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.17 -17.12 62.55 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.081 0.467 . . . . 0.0 110.673 -176.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -128.43 11.54 6.39 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.125 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.486 ' HG3' HD23 ' A' ' 102' ' ' LEU . 75.3 mmtt -95.63 -53.16 3.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.261 0.553 . . . . 0.0 109.627 179.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.539 ' HB ' HD13 ' A' ' 153' ' ' LEU . 13.3 t -113.23 146.35 39.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.529 -176.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -95.44 14.42 22.68 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.217 0.532 . . . . 0.0 110.782 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.442 ' HD3' ' OG1' ' A' ' 106' ' ' THR . 26.2 mtpt -101.18 22.33 12.55 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.686 -177.589 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.425 ' HG2' HG23 ' A' ' 106' ' ' THR . 25.0 mmt -100.66 163.3 12.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.047 -179.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.692 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 45.2 m-85 -91.86 178.02 6.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.745 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 60.3 mtp85 -81.23 109.31 15.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.34 -177.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 116.7 -134.59 11.42 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -176.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -118.48 70.22 0.32 Allowed Glycine 0 N--CA 1.447 -0.587 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 177.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.692 ' HB2' ' HB2' ' A' ' 110' ' ' TYR . 42.1 mttm -131.89 122.76 26.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.823 -0.189 . . . . 0.0 111.197 -172.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.541 HD11 ' HB ' ' A' ' 97' ' ' ILE . 46.2 pt -113.65 143.71 22.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 172.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.541 ' HB2' ' HE2' ' A' ' 110' ' ' TYR . 49.4 t -119.44 125.86 49.95 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.777 0.322 . . . . 0.0 110.206 -179.594 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.565 HD13 ' HA3' ' A' ' 141' ' ' GLY . 47.5 mt -77.65 -80.4 0.11 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.198 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.554 ' OG1' ' HB2' ' A' ' 121' ' ' PHE . 24.0 p -141.85 156.75 45.53 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.67 -43.0 77.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.902 0.382 . . . . 0.0 110.613 -177.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.442 ' C ' ' HD2' ' A' ' 123' ' ' PRO . 5.9 p80 -76.63 -5.54 48.23 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.56 -176.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.554 ' HB2' ' OG1' ' A' ' 118' ' ' THR . 56.4 t80 -71.22 -34.61 70.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.077 0.465 . . . . 0.0 109.868 176.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.639 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 16.6 mtpp -60.56 -52.28 73.86 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.787 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.639 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 31.6 Cg_exo -60.2 -41.25 52.73 Favored 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 121.769 1.646 . . . . 0.0 112.113 172.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 52.1 tp -61.31 -44.0 97.93 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.97 -177.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.463 ' O ' HG23 ' A' ' 129' ' ' VAL . 50.4 t-105 -61.42 -57.16 13.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.319 179.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.01 -29.43 69.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.954 -0.567 . . . . 0.0 112.037 -176.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -66.01 -43.07 88.77 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.507 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.525 ' HB2' ' CE2' ' A' ' 132' ' ' PHE . 55.5 m-80 -97.41 -0.11 46.82 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -168.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 125' ' ' TRP . 97.7 t -55.67 136.19 71.37 Favored Pre-proline 0 N--CA 1.466 0.346 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 174.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.487 ' HB2' ' H ' ' A' ' 131' ' ' LYS . 70.3 Cg_endo -97.11 -142.25 0.14 OUTLIER 'Cis proline' 0 C--N 1.352 0.712 0 C-N-CA 124.73 -0.946 . . . . 0.0 113.589 4.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.487 ' H ' ' HB2' ' A' ' 130' ' ' PRO . 35.8 mtmm 75.53 1.4 3.61 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.875 0.87 . . . . 0.0 111.119 -176.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . 0.525 ' CE2' ' HB2' ' A' ' 128' ' ' ASN . 11.3 m-85 -79.95 160.39 25.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.675 175.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -166.01 170.41 40.71 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 -178.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 33.4 tp -59.57 -35.23 73.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.952 0.376 . . . . 0.0 111.306 -174.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.05 -41.31 83.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.06 0.457 . . . . 0.0 110.969 177.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -71.75 -37.1 70.58 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.506 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 63.7 tp -65.53 -46.53 79.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.245 -178.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 24.2 mmt -67.45 -39.61 85.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.295 -178.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -70.49 -47.53 60.08 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -176.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.8 mt -83.45 -16.44 45.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.314 -175.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.565 ' HA3' HD13 ' A' ' 117' ' ' LEU . . . -112.32 -74.88 0.71 Allowed Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.316 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 40.6 tp -61.02 -41.96 97.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.77 -62.87 5.77 Favored Glycine 0 CA--C 1.524 0.597 0 C-N-CA 121.074 -0.584 . . . . 0.0 113.423 -177.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -66.2 -27.42 48.74 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.285 1.99 . . . . 0.0 112.285 178.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 59.1 t90 -63.52 -52.56 60.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.284 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 91.2 mt -61.62 -32.8 72.96 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.623 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.13 -15.78 63.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.484 -178.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 92.5 t -106.58 -45.23 7.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.792 0.33 . . . . 0.0 110.727 177.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 23.1 tp10 -67.53 -52.57 37.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.74 -175.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.479 ' O ' HG13 ' A' ' 154' ' ' ILE . 46.3 mm -55.92 -54.35 53.12 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -172.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 17.4 Cg_endo -58.35 -39.56 83.15 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 121.84 1.694 . . . . 0.0 112.257 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -68.23 -38.3 81.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.272 0.558 . . . . 0.0 110.246 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.601 HD12 ' HD3' ' A' ' 156' ' ' LYS . 31.1 tp -70.14 -36.03 74.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.948 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 150' ' ' ILE . 77.2 mt -64.25 -41.93 93.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.991 0.424 . . . . 0.0 110.33 176.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -67.1 -13.93 62.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.545 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . 0.601 ' HD3' HD12 ' A' ' 153' ' ' LEU . 21.4 mtpp -69.17 -16.93 63.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.687 0.279 . . . . 0.0 110.939 174.098 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 81.0 7.49 88.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.366 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . 0.714 HG23 HG13 ' A' ' 159' ' ' ILE . 27.7 m -88.31 -15.39 9.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.155 0.502 . . . . 0.0 110.437 178.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.714 HG13 HG23 ' A' ' 158' ' ' VAL . 56.8 mt -127.2 152.11 34.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.562 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 75.32 80.26 0.1 Allowed 'General case' 0 N--CA 1.461 0.122 0 O-C-N 124.05 0.844 . . . . 0.0 111.092 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . 0.427 ' H ' ' CD2' ' A' ' 161' ' ' HIS . 7.9 p80 -81.17 -38.91 26.33 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.537 175.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.659 ' HG2' ' OE1' ' A' ' 163' ' ' GLU . 16.6 ttpp 179.47 162.5 0.88 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 177.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.659 ' OE1' ' HG2' ' A' ' 162' ' ' LYS . 0.0 OUTLIER -75.86 -175.75 3.12 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.078 0.466 . . . . 0.0 111.596 -176.583 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.469 ' NZ ' ' HB3' ' A' ' 164' ' ' LYS . 7.7 mtpm? -79.45 -29.47 41.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.768 -174.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 2.3 p -89.17 -179.22 5.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.993 0.425 . . . . 0.0 111.926 -174.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -110.42 -41.4 4.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.097 -178.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -137.35 107.28 6.29 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.477 179.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 3.1 pp -97.06 -13.64 22.1 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.163 -179.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -78.13 166.65 22.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.484 0.659 . . . . 0.0 112.174 -176.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 -94.79 -179.36 4.83 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.377 -177.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -87.63 -48.54 7.81 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -90.08 95.61 10.29 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -79.35 85.64 5.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.384 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -81.68 -24.65 36.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.797 178.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 82.8 t60 . . . . . 0 C--O 1.247 0.923 0 CA-C-O 118.301 -0.857 . . . . 0.0 109.291 174.554 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 120.64 0.257 . . . . 0.0 111.471 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.0 107.74 18.88 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -170.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 53.78 34.71 19.72 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.681 171.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.448 ' HA ' ' HG3' ' A' ' 7' ' ' ARG . 11.0 pt-20 -64.55 -28.08 69.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.771 179.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.444 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -65.55 -48.36 72.72 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.988 176.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.7 m -59.18 -49.57 77.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.331 -179.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.45 ' HD3' ' N ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -68.9 -23.63 64.21 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.533 -177.875 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.455 HH11 ' HD2' ' A' ' 8' ' ' ARG . 10.2 ttp180 -71.92 -39.13 69.71 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.835 0.35 . . . . 0.0 110.188 177.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 5' ' ' ALA . 95.0 t -61.56 -45.2 99.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.591 177.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.9 t -67.17 -33.5 63.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.024 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.3 t -73.37 -41.76 63.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.39 -175.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -87.78 -0.76 57.37 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -175.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.427 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 57.8 mt -115.06 89.07 18.75 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 173.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 13' ' ' ILE . 9.2 Cg_endo -49.99 151.22 8.92 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.951 3.101 . . . . 0.0 113.904 -172.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.7 m -83.39 157.83 3.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.744 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.428 HD12 ' N ' ' A' ' 16' ' ' LEU . 6.2 mp -100.48 147.63 25.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.509 -177.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -83.07 -39.61 20.96 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 175.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.9 m -87.59 121.4 29.97 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.738 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -145.72 120.65 9.99 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.784 172.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -159.07 -55.17 0.06 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.17 -178.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 121.82 -169.19 14.64 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.721 -0.752 . . . . 0.0 111.94 177.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -72.75 5.13 3.08 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.102 2.535 . . . . 0.0 112.04 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -74.23 -30.97 62.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.184 178.67 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.562 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 1.4 t0 -120.38 104.39 9.98 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 79.1 mtp180 -61.83 -40.92 96.98 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -170.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -66.09 -43.51 87.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.146 0.498 . . . . 0.0 110.244 179.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.562 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 3.8 mm? -74.05 -23.53 59.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.668 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 46.5 t-105 -63.65 -39.05 93.36 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.452 174.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.415 HG12 ' HE3' ' A' ' 33' ' ' LYS . 60.0 t -64.5 -41.99 93.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.008 175.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.2 mm100 -59.17 -44.99 92.17 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.522 175.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.522 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 25.1 tpt180 -60.3 -44.71 95.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.546 178.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 1.4 mm? -58.41 -49.29 77.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.061 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HB3' ' HE2' ' A' ' 33' ' ' LYS . 15.2 ptpt -70.76 -38.07 73.45 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.882 -175.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -66.95 -43.3 83.5 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.363 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.579 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 11.4 tp10 -68.88 -30.54 69.07 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.229 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.428 ' O ' HG13 ' A' ' 40' ' ' ILE . 1.2 t80 -64.31 -43.48 94.54 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -60.14 -43.44 95.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.316 0.579 . . . . 0.0 109.858 174.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.424 ' HB3' ' O ' ' A' ' 35' ' ' GLU . 16.9 t -56.38 -46.57 80.04 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.848 175.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.651 HD23 ' HB2' ' A' ' 135' ' ' ALA . 82.2 mt -61.6 -55.34 31.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.913 178.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 36' ' ' TYR . 89.7 mt -52.22 -43.78 39.91 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.098 -178.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -45.28 91.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.86 -179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -71.3 -42.43 68.66 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.049 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.507 HG12 ' HE3' ' A' ' 47' ' ' LYS . 88.8 t -61.17 -44.31 98.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.767 0.317 . . . . 0.0 110.385 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.3 -38.6 85.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.626 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -57.65 -40.48 79.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.45 176.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.525 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 96.1 m-20 -62.24 -44.65 96.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.818 0.342 . . . . 0.0 110.487 177.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.507 ' HE3' HG12 ' A' ' 43' ' ' VAL . 89.4 mttt -64.64 -37.36 87.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.107 0.479 . . . . 0.0 110.647 178.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -70.68 -19.94 62.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.018 178.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -97.23 -1.38 44.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.287 175.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.3 t70 65.27 30.69 11.1 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.994 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.525 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 8.2 t30 -131.52 93.52 3.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.925 0.393 . . . . 0.0 111.016 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -99.35 110.33 22.84 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 176.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 51.8 p-90 -124.24 -0.12 8.32 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -172.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.439 ' HA ' ' HA ' ' A' ' 69' ' ' CYS . 11.0 p90 -161.14 141.49 11.05 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.382 177.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -135.12 129.81 34.48 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 174.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.4 tp -147.23 126.52 13.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.931 -168.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -111.74 163.51 14.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.798 0.332 . . . . 0.0 110.28 176.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.458 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 10.9 p -125.41 157.34 37.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.109 -178.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -68.92 167.94 14.68 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.75 171.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -70.24 -19.15 63.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.393 0.616 . . . . 0.0 109.37 173.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -72.46 -32.94 66.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.16 173.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.8 8.85 84.91 Favored Glycine 0 C--N 1.333 0.411 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.079 -174.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.0 p -89.56 -30.21 18.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.028 0.442 . . . . 0.0 111.308 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 64' ' ' ARG . 65.9 mtt180 -114.77 133.8 55.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.58 179.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.458 ' CD2' ' HB3' ' A' ' 58' ' ' SER . 49.9 m95 -124.12 126.65 46.55 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.004 175.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -136.04 148.23 48.27 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.036 -174.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.89 -144.18 8.36 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.183 -0.767 . . . . 0.0 111.183 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.3 ptpp? -159.77 150.69 19.33 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 117.037 0.419 . . . . 0.0 110.959 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 54' ' ' PHE . 25.0 p -116.06 147.67 41.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.379 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.566 ' CD1' ' HB3' ' A' ' 79' ' ' GLU . 29.5 m-90 -115.15 129.16 56.59 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.351 179.202 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -118.53 124.21 46.98 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 44.3 mm -86.0 120.2 35.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.155 178.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -124.28 108.42 12.21 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.732 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.3 t0 64.44 -85.02 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.197 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 75' ' ' LEU . 2.3 mm? -132.64 6.61 4.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.751 0.31 . . . . 0.0 111.218 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.8 mp -112.38 147.25 36.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.17 0.51 . . . . 0.0 111.21 -175.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -116.54 98.19 6.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.578 -177.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.527 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 74.8 m-85 -93.14 133.22 36.55 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.301 -175.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.566 ' HB3' ' CD1' ' A' ' 70' ' ' TRP . 0.8 OUTLIER -110.28 136.54 49.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.409 0.623 . . . . 0.0 110.861 175.567 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.485 ' O ' HG23 ' A' ' 82' ' ' ILE . 91.4 m-85 -122.12 117.02 25.27 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.347 175.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.85 117.65 9.25 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.485 HG23 ' O ' ' A' ' 80' ' ' PHE . 36.8 pt -118.51 161.64 17.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.475 0.655 . . . . 0.0 111.855 -171.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -165.42 161.83 19.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.007 175.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.597 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 55.6 p90 -162.64 167.16 23.62 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 123.182 0.301 . . . . 0.0 110.339 173.057 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -119.02 158.42 25.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.404 -178.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.1 mm -106.93 90.4 5.27 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.828 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -60.14 160.95 20.86 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.579 2.186 . . . . 0.0 112.087 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 27.2 mt -73.84 -5.2 6.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.475 0.655 . . . . 0.0 110.727 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.83 8.4 17.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.291 176.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 91' ' ' PRO . 76.3 t80 -77.64 142.0 65.58 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 174.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.404 ' HA ' ' HA ' ' A' ' 90' ' ' TYR . 98.1 Cg_endo -97.31 16.72 32.57 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.229 -1.155 . . . . 0.0 113.043 -1.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.2 m -59.56 -37.81 79.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.463 0.649 . . . . 0.0 110.453 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.9 m -122.66 142.26 50.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.606 176.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.81 144.8 96.32 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.823 178.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.0 144.7 99.44 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.87 2.38 . . . . 0.0 112.364 177.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.23 104.54 14.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.517 -176.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.597 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 58.8 mt -72.7 131.4 34.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.424 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.461 ' HA ' ' O ' ' A' ' 113' ' ' GLY . . . -92.62 -74.81 0.51 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.103 -173.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.455 HG22 HG22 ' A' ' 82' ' ' ILE . 17.7 t 61.49 82.38 0.22 Allowed Pre-proline 0 N--CA 1.466 0.369 0 CA-C-O 121.249 0.547 . . . . 0.0 110.233 -174.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.71 -14.51 42.03 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 123.263 2.642 . . . . 0.0 113.74 -170.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -79.36 -31.41 42.94 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.718 0.294 . . . . 0.0 111.12 -177.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 88.7 mt -83.5 -7.67 59.49 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.726 -174.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -61.81 124.0 19.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.735 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 89.97 -8.3 80.08 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.552 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -101.08 -55.28 2.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.91 0.386 . . . . 0.0 110.259 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.1 t -87.88 150.75 23.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.84 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -98.34 4.08 48.61 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.853 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -95.07 20.61 8.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.514 -177.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 54.1 mtt -111.6 142.52 43.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.211 175.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -126.54 154.55 43.68 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.618 ' HE ' ' HA ' ' A' ' 111' ' ' ARG . 2.5 tpm_? 72.38 -50.18 0.7 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.91 0.757 . . . . 0.0 111.059 -176.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 171.45 -109.24 0.31 Allowed Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 178.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . 0.461 ' O ' ' HA ' ' A' ' 98' ' ' ALA . . . -86.74 60.61 4.46 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.434 177.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -147.1 116.73 7.09 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 177.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 39.7 pt -75.92 153.86 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.002 0.43 . . . . 0.0 111.202 -177.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 27.4 t -105.1 123.76 48.37 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.044 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 90.9 mt -71.58 161.86 30.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.261 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.3 p -67.88 159.74 29.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.025 0.441 . . . . 0.0 111.568 -176.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -61.51 -24.94 66.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.335 -0.848 . . . . 0.0 112.125 -173.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -93.39 -37.29 12.06 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.989 -0.285 . . . . 0.0 111.18 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -71.94 -35.84 69.73 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 -173.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.423 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 63.2 tttm -57.97 -52.28 75.62 Favored Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -177.064 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.423 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 56.6 Cg_endo -72.23 -25.44 18.81 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 121.826 1.684 . . . . 0.0 112.396 175.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 53.1 tp -62.44 -38.18 88.77 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.686 178.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.467 ' O ' HG23 ' A' ' 129' ' ' VAL . 57.1 t-105 -54.53 -55.44 29.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.941 0.401 . . . . 0.0 110.557 177.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -71.52 -14.19 62.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.163 -177.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.436 ' HD3' ' O ' ' A' ' 127' ' ' ARG . 3.3 tmt_? -80.54 -28.24 37.37 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -88.14 -39.14 14.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.572 -177.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.482 HG13 ' HA ' ' A' ' 130' ' ' PRO . 95.6 t -49.67 135.53 19.12 Favored Pre-proline 0 N--CA 1.472 0.653 0 O-C-N 123.512 0.508 . . . . 0.0 111.198 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.482 ' HA ' HG13 ' A' ' 129' ' ' VAL . 59.7 Cg_endo -86.51 -146.61 0.32 Allowed 'Cis proline' 0 C--N 1.353 0.77 0 C-N-CA 124.425 -1.073 . . . . 0.0 113.48 5.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 42.9 mmtm 72.89 -37.61 0.39 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.32 0.648 . . . . 0.0 112.035 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.97 158.05 26.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.007 0.432 . . . . 0.0 111.215 -178.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.522 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -141.66 175.16 22.65 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.753 -175.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.42 ' H ' ' CD ' ' A' ' 35' ' ' GLU . 53.0 tp -72.29 -39.7 68.1 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.724 0.409 . . . . 0.0 111.33 -174.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.651 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -60.72 -30.82 70.21 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.481 0.657 . . . . 0.0 110.444 177.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -67.68 -32.98 74.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.055 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.422 ' HB2' ' CZ3' ' A' ' 125' ' ' TRP . 59.4 tp -68.6 -36.72 79.07 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.914 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 59.5 mtt -65.73 -42.01 91.52 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.309 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -77.82 -50.32 12.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.227 -177.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 90.7 mt -93.62 -6.14 47.16 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -171.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -117.02 -67.56 0.38 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.263 -0.97 . . . . 0.0 112.753 -177.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.421 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 58.8 tp -60.33 -48.93 79.63 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 122.154 0.182 . . . . 0.0 111.482 -175.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.74 -61.64 6.87 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 121.256 -0.497 . . . . 0.0 113.143 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . 0.422 ' O ' HG23 ' A' ' 148' ' ' VAL . 50.8 Cg_exo -56.08 -37.71 95.92 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.629 2.219 . . . . 0.0 112.797 177.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 64.8 t90 -61.99 -46.69 88.11 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.914 0.388 . . . . 0.0 110.569 -179.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 142' ' ' LEU . 97.2 mt -61.7 -37.69 85.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.187 0.518 . . . . 0.0 110.647 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.13 -9.72 56.5 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.798 -178.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 144' ' ' PRO . 85.0 t -70.53 -55.98 12.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.648 -179.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -141.81 11.16 2.03 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -175.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.494 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 29.7 mm -69.3 -50.75 19.12 Favored Pre-proline 0 CA--C 1.535 0.404 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.502 174.018 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 15.0 Cg_endo -59.12 -31.23 95.09 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.763 1.642 . . . . 0.0 111.189 171.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 156' ' ' LYS . 30.0 t70 -66.39 -45.0 81.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.402 178.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.598 ' HA ' ' HD3' ' A' ' 156' ' ' LYS . 41.0 tp -56.01 -38.81 71.0 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.518 178.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 62.7 mt -68.19 -44.41 84.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.669 177.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -69.98 -23.07 63.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.356 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . 0.598 ' HD3' ' HA ' ' A' ' 153' ' ' LEU . 28.8 mtpp -65.67 -18.19 65.14 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.849 176.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 85.8 26.1 36.08 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.67 -177.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 54.6 t -86.52 -43.85 16.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.976 0.417 . . . . 0.0 110.14 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 60.6 mt -107.73 114.53 46.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.48 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -113.61 122.17 46.4 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 177.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -133.16 132.72 41.93 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.802 0.334 . . . . 0.0 110.799 -173.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -77.21 -82.41 0.08 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.733 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 82.0 mm-40 -113.1 170.83 7.93 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.352 -175.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -93.9 -41.41 9.62 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 173.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 69.6 m 70.13 -13.21 0.45 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 114.619 -1.173 . . . . 0.0 112.526 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -101.43 143.79 31.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.179 0.514 . . . . 0.0 110.607 177.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -104.11 132.91 49.88 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.504 177.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 45.1 tp -71.7 103.16 2.99 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 173.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -61.46 144.88 53.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.254 -170.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -108.14 101.53 10.75 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.916 -174.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -122.49 121.54 36.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.475 -0.784 . . . . 0.0 108.97 177.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -85.66 149.0 25.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.535 0.683 . . . . 0.0 112.38 -172.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -84.44 123.08 29.85 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.995 -1.002 . . . . 0.0 108.369 171.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -54.11 -38.87 65.86 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 -171.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 44.7 t60 . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.463 -0.779 . . . . 0.0 109.442 175.769 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 121.009 0.433 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.83 40.55 1.0 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.523 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -64.06 124.91 22.84 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.724 -179.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -67.73 -30.92 70.53 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.707 -178.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.409 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -54.67 -48.91 71.79 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.85 0.357 . . . . 0.0 110.814 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.494 ' O ' HG23 ' A' ' 10' ' ' VAL . 28.1 m -60.54 -53.84 52.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.433 -179.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.419 ' HD3' ' N ' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -64.65 -28.9 69.92 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.807 0.337 . . . . 0.0 111.325 -176.063 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.419 ' N ' ' HD3' ' A' ' 7' ' ' ARG . 54.3 mtp180 -70.5 -36.56 73.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.679 0.276 . . . . 0.0 110.912 178.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 5' ' ' ALA . 99.5 t -72.88 -44.08 58.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.389 176.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 6' ' ' THR . 44.4 t -68.0 -14.36 18.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 121.196 0.522 . . . . 0.0 110.711 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.2 t -69.09 -34.33 74.94 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.127 174.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -96.65 -21.29 17.71 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.985 0.421 . . . . 0.0 110.369 178.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.3 mt -117.42 81.81 14.4 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 174.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -76.81 174.25 13.16 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 123.142 2.561 . . . . 0.0 113.852 -168.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.1 m -79.66 152.3 4.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.308 176.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.45 ' O ' ' HG2' ' A' ' 131' ' ' LYS . 9.4 mp -86.9 134.66 33.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.771 -177.189 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.528 ' HD2' ' N ' ' A' ' 17' ' ' LYS . 12.2 mptt -87.2 -31.61 20.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.049 0.452 . . . . 0.0 110.238 -178.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.453 ' O ' ' HG3' ' A' ' 31' ' ' ARG . 11.6 m -93.64 105.76 17.78 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.603 176.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -125.24 133.36 52.73 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.803 0.335 . . . . 0.0 111.27 -177.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -165.63 167.62 17.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.088 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.76 170.67 23.18 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.685 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -61.85 -10.62 17.86 Favored 'Trans proline' 0 N--CA 1.476 0.465 0 C-N-CA 123.232 2.621 . . . . 0.0 112.999 -177.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.856 ' HE ' ' HA ' ' A' ' 23' ' ' ARG . 0.4 OUTLIER -69.24 -27.02 65.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.953 177.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -112.91 97.52 6.59 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 29' ' ' VAL . 37.3 mtt180 -66.8 -29.68 69.69 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -176.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -62.68 -53.36 55.58 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.086 0.47 . . . . 0.0 110.195 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 27' ' ' LEU . 4.3 mm? -75.62 -26.74 58.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.829 178.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.473 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 74.7 t-105 -64.42 -46.5 82.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.768 177.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 25' ' ' ARG . 68.1 t -60.03 -40.9 84.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 120.743 0.306 . . . . 0.0 110.455 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -67.42 -42.69 82.81 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.67 177.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 18' ' ' THR . 38.6 ttt-85 -65.18 -34.45 78.4 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.532 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -63.56 -43.92 95.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.567 -178.237 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.5 ' HB3' ' NZ ' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -74.32 -26.92 60.46 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.933 179.778 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -71.57 -35.91 70.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.141 0.496 . . . . 0.0 109.858 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.427 ' CD ' ' H ' ' A' ' 134' ' ' LEU . 10.1 tp10 -64.42 -40.73 96.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.395 174.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.41 ' HD2' ' HA ' ' A' ' 33' ' ' LYS . 5.3 m-85 -55.03 -40.39 70.16 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.913 175.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 71.8 mm-40 -58.71 -49.26 78.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.208 0.528 . . . . 0.0 110.261 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.6 t -62.16 -39.56 93.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.656 179.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.536 HD23 ' HB2' ' A' ' 135' ' ' ALA . 94.4 mt -65.09 -54.94 22.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.155 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 83.6 mt -54.13 -45.32 65.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.061 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -43.99 97.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.035 179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -65.12 -43.69 91.16 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.745 0.307 . . . . 0.0 110.906 -179.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 39' ' ' LEU . 55.3 t -73.39 -43.0 56.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.475 -176.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.63 -29.01 64.18 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -178.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -65.63 -31.38 72.38 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 174.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.585 ' HB3' ' O ' ' A' ' 51' ' ' ASN . 13.1 m-80 -71.49 -39.34 70.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.319 175.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.401 ' NZ ' HG12 ' A' ' 43' ' ' VAL . 59.0 mttp -62.6 -33.28 74.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.049 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -66.82 -14.8 63.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 111.07 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -106.04 5.03 29.93 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.326 175.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.8 t70 63.33 27.7 15.44 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.99 0.9 . . . . 0.0 109.985 -176.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.585 ' O ' ' HB3' ' A' ' 46' ' ' ASN . 11.9 t30 -122.07 72.06 1.02 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.692 -175.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -92.56 88.99 6.54 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . . . . . . . . . 9.6 p-90 -99.89 -8.15 24.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.498 -0.773 . . . . 0.0 112.363 -170.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -161.43 144.88 12.68 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.707 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 55' ' ' ARG . 37.2 mtm180 -143.16 124.31 14.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.066 171.511 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.494 HD21 ' HB3' ' A' ' 65' ' ' TRP . 5.1 tt -131.05 127.81 39.0 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.439 -169.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -121.41 177.06 5.35 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.121 -175.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.448 ' HB3' ' CD2' ' A' ' 65' ' ' TRP . 78.6 p -146.26 174.72 11.09 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.518 ' OD1' ' HB2' ' A' ' 61' ' ' GLU . 4.8 p30 -73.12 166.57 22.86 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 167.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.681 ' HA ' ' HE3' ' A' ' 60' ' ' LYS . 0.3 OUTLIER -76.12 -5.57 47.25 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.026 0.441 . . . . 0.0 111.264 -175.31 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.518 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 6.7 mm-40 -78.89 -32.68 45.93 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 171.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.34 13.39 83.63 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.662 177.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 p -92.26 -5.53 52.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.861 0.363 . . . . 0.0 111.791 -177.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.473 ' HB3' HD21 ' A' ' 59' ' ' ASN . 15.3 ttm180 -151.2 128.01 10.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.016 177.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.494 ' HB3' HD21 ' A' ' 56' ' ' LEU . 46.6 m95 -115.37 149.57 37.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.368 -176.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -156.11 140.65 16.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.473 -178.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.488 ' HA3' ' HA ' ' A' ' 56' ' ' LEU . . . -175.41 -174.91 42.4 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 119.897 -1.144 . . . . 0.0 112.637 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.7 mttp -117.8 145.25 44.66 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.9 0.381 . . . . 0.0 110.735 -178.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 48.5 t -130.75 127.5 38.89 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.528 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . 0.565 ' HB3' ' HB3' ' A' ' 79' ' ' GLU . 7.8 p90 -130.28 132.77 46.07 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.66 -178.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -118.29 143.71 46.38 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 42.8 mm -105.24 116.15 48.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 120.842 0.353 . . . . 0.0 110.829 -175.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -127.47 106.6 9.3 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 177.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 5.1 m-20 52.22 58.49 5.37 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.918 0.761 . . . . 0.0 111.247 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 74' ' ' ASP . 4.2 mm? 73.34 -22.46 0.23 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.44 176.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.22 118.07 14.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.713 0.292 . . . . 0.0 110.404 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -105.96 135.7 46.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.204 178.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.418 ' O ' ' HA ' ' A' ' 70' ' ' TRP . 7.4 p90 -143.74 114.73 7.81 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.688 179.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.565 ' HB3' ' HB3' ' A' ' 70' ' ' TRP . 0.6 OUTLIER -106.09 136.43 45.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.559 177.914 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -117.04 139.19 51.0 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.469 178.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -93.15 115.62 28.25 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.175 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 pt -127.13 152.34 35.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.483 -178.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.11 161.71 42.22 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.992 0.425 . . . . 0.0 110.303 176.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.575 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 48.0 p90 -160.09 152.06 20.34 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.44 -179.47 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.524 ' O ' ' HD3' ' A' ' 87' ' ' PRO . 7.2 p-10 -100.8 167.91 9.99 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.978 0.418 . . . . 0.0 110.14 178.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.1 mm -109.2 89.5 6.99 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.399 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.524 ' HD3' ' O ' ' A' ' 85' ' ' ASP . 37.1 Cg_exo -56.55 164.11 6.05 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 123.095 2.53 . . . . 0.0 112.529 -178.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 35.0 mt -74.36 -10.96 14.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.365 0.603 . . . . 0.0 110.226 -178.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.1 p -80.91 -6.82 59.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.948 176.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.515 ' CG ' ' HA ' ' A' ' 91' ' ' PRO . 51.2 t80 -75.86 144.15 75.78 Favored Pre-proline 0 C--N 1.328 -0.352 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.515 ' HA ' ' CG ' ' A' ' 90' ' ' TYR . 24.2 Cg_endo -94.04 11.82 49.31 Favored 'Cis proline' 0 N--CA 1.458 -0.614 0 C-N-CA 124.244 -1.148 . . . . 0.0 113.937 2.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 19.1 m -65.04 -36.11 83.32 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.175 0.512 . . . . 0.0 110.355 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 49.9 m -113.43 140.56 47.97 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.739 175.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.52 146.24 95.99 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.752 179.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.53 153.91 76.27 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.646 2.231 . . . . 0.0 112.5 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -81.66 90.74 6.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.956 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.575 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 65.3 mt -74.9 119.84 23.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.263 179.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -107.06 130.75 54.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.787 0.327 . . . . 0.0 111.505 -176.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 19.7 t -130.55 77.27 76.16 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 173.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -66.25 -21.79 54.34 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 123.073 2.515 . . . . 0.0 112.538 -176.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -57.88 -33.33 68.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.894 0.378 . . . . 0.0 111.272 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 87.5 mt -86.72 1.97 50.23 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -173.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.18 -16.14 63.87 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.39 0.614 . . . . 0.0 110.772 -176.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -131.21 26.3 3.96 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.631 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -117.88 -59.33 1.92 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.123 0.487 . . . . 0.0 109.876 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.3 t -108.27 -164.74 0.98 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.438 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -55.43 148.64 14.85 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.14 0.275 . . . . 0.0 110.308 178.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.451 ' HB2' ' HE3' ' A' ' 108' ' ' LYS . 18.9 ptmt -69.35 150.75 46.99 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.348 0.594 . . . . 0.0 111.312 -173.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 25.3 mmt -88.83 163.55 15.61 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.275 176.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -70.5 -54.46 12.13 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.283 -176.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -161.93 129.19 3.91 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.203 -177.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 85.0 8.14 82.75 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.791 -0.719 . . . . 0.0 113.802 169.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 63.14 24.35 67.06 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.126 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -86.99 149.49 24.73 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 42.9 pt -73.05 146.23 10.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.489 . . . . 0.0 111.362 -175.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 33.8 m -100.02 128.4 46.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.53 -179.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 91.9 mt -120.61 159.8 24.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.535 -178.095 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.0 t -65.0 150.13 48.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.632 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.16 -21.39 59.31 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.25 176.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -66.54 -30.26 70.53 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.945 0.402 . . . . 0.0 110.802 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -68.96 -34.7 75.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.331 -175.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.523 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 50.1 mtpt -58.66 -58.65 17.64 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.752 -174.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.523 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 43.2 Cg_endo -69.06 -31.09 24.39 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.796 1.664 . . . . 0.0 112.075 176.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 55.6 tp -60.42 -49.38 77.79 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.479 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.539 ' O ' HG23 ' A' ' 129' ' ' VAL . 51.2 t-105 -60.03 -56.38 22.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.687 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.05 -24.73 68.05 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -174.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -78.77 -26.11 44.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.961 0.41 . . . . 0.0 110.759 -179.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -96.07 5.4 51.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.042 -177.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 125' ' ' TRP . 86.3 t -96.15 138.11 21.64 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 174.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.473 ' O ' ' HB2' ' A' ' 131' ' ' LYS . 63.0 Cg_endo -90.8 -160.92 1.28 Allowed 'Cis proline' 0 C--N 1.347 0.463 0 C-N-CA 124.302 -1.124 . . . . 0.0 113.49 4.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 53.8 mttp 75.09 5.14 4.27 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.999 0.812 . . . . 0.0 111.861 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -90.82 134.66 34.27 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -108.21 155.42 16.2 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.402 -177.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.427 ' H ' ' CD ' ' A' ' 35' ' ' GLU . 52.7 tp -64.34 -37.85 88.97 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 122.824 0.45 . . . . 0.0 111.39 -174.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.536 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -54.66 -30.32 55.04 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.393 0.616 . . . . 0.0 111.337 179.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -67.66 -31.26 71.12 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.385 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 58.7 tp -65.15 -35.38 80.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.715 178.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -65.61 -44.8 85.46 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.97 0.414 . . . . 0.0 110.522 176.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -73.61 -41.12 63.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.254 -176.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.0 mt -98.1 -6.94 30.6 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -173.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -129.29 -63.69 0.11 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.174 -1.012 . . . . 0.0 113.203 -177.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 52.6 tp -57.82 -50.97 71.51 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -175.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.55 -62.0 6.79 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.16 -0.543 . . . . 0.0 113.598 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . 0.405 ' O ' HG23 ' A' ' 148' ' ' VAL . 12.3 Cg_endo -58.47 -31.69 94.77 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.498 2.132 . . . . 0.0 113.107 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 51.1 t90 -65.9 -50.08 65.75 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.044 0.45 . . . . 0.0 110.033 179.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 97.0 mt -64.11 -37.92 89.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.668 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.25 -14.25 60.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.185 -176.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 144' ' ' PRO . 96.1 t -105.45 -50.54 8.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.8 0.333 . . . . 0.0 111.689 -179.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -81.68 -32.76 31.62 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -171.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.498 ' N ' ' HD2' ' A' ' 151' ' ' PRO . 38.7 mm -67.2 -54.32 20.23 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -175.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 150' ' ' ILE . 9.4 Cg_endo -52.45 -41.02 70.04 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 122.446 2.097 . . . . 0.0 112.8 -178.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 156' ' ' LYS . 32.2 t70 -67.89 -37.16 81.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.577 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.476 ' HG ' HG13 ' A' ' 159' ' ' ILE . 30.9 tp -69.62 -31.41 69.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.696 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 150' ' ' ILE . 72.2 mt -67.19 -53.82 29.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.41 176.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -70.42 -15.98 62.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.4 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 152' ' ' ASP . 20.3 ttmm -68.64 -18.18 64.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.921 175.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 87.83 21.32 47.25 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.281 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 51.7 t -99.96 -44.95 11.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.731 0.301 . . . . 0.0 111.115 -178.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . 0.476 HG13 ' HG ' ' A' ' 153' ' ' LEU . 52.2 mt -79.53 93.06 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.378 0.608 . . . . 0.0 110.458 -179.373 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -120.14 86.34 2.55 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.811 178.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -84.99 -34.0 22.46 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.168 -176.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 59.4 tptt -156.38 152.61 27.76 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.411 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.13 163.19 5.06 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 172.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -48.25 -56.65 7.44 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 123.326 0.391 . . . . 0.0 111.666 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . 0.4 ' C ' ' H ' ' A' ' 167' ' ' GLN . 33.7 m 54.64 43.73 29.73 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.031 0.443 . . . . 0.0 110.607 178.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -75.85 29.25 0.11 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.035 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.4 ' H ' ' C ' ' A' ' 165' ' ' CYS . 1.1 tm0? -74.81 93.04 2.56 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 173.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 83.9 mt -84.96 130.29 34.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.823 -174.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -82.0 135.07 35.4 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.091 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -81.44 112.96 19.17 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.672 177.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -88.11 115.18 25.41 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 35.9 m80 -48.77 -58.01 5.46 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.556 0.535 . . . . 0.0 111.508 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -141.78 125.8 17.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.886 0.375 . . . . 0.0 111.104 176.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 32.4 p-80 -99.88 -30.85 11.8 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 170.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 . . . . . 0 C--O 1.243 0.734 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.827 173.293 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.7 tpp . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 121.079 0.466 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.14 140.14 27.78 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.192 177.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -71.92 125.5 27.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.685 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -64.61 -32.6 74.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.615 -176.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.466 ' O ' HG23 ' A' ' 9' ' ' VAL . . . -69.02 -45.4 70.61 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.875 0.369 . . . . 0.0 110.495 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.471 ' O ' HG23 ' A' ' 10' ' ' VAL . 88.8 m -58.77 -48.39 81.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.384 179.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.0 ppt_? -70.08 -20.22 63.22 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.104 -178.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -71.23 -46.09 61.84 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 171.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 5' ' ' ALA . 83.7 t -57.21 -45.05 84.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.419 176.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 6' ' ' THR . 85.6 t -57.73 -43.18 83.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.643 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.4 p -70.29 -20.64 63.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.795 0.331 . . . . 0.0 111.542 -178.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -97.55 0.72 47.94 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 121.118 0.485 . . . . 0.0 110.584 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 9' ' ' VAL . 60.3 mt -113.74 88.57 14.12 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 115.409 -0.814 . . . . 0.0 108.82 173.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.437 ' HD2' ' HA ' ' A' ' 38' ' ' SER . 78.0 Cg_exo -47.16 141.96 12.37 Favored 'Trans proline' 0 C--O 1.237 0.431 0 C-N-CA 123.605 2.87 . . . . 0.0 113.798 -171.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.7 m -82.61 165.71 2.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.735 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.847 HD21 ' HB3' ' A' ' 35' ' ' GLU . 7.6 mp -101.76 134.89 44.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.97 -176.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -87.81 -34.01 18.42 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.584 0.707 . . . . 0.0 109.64 174.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.547 HG21 ' HB3' ' A' ' 30' ' ' GLN . 19.7 m -110.82 118.78 37.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.233 -177.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.437 ' HA ' ' CG ' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -152.89 136.81 16.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.27 0.557 . . . . 0.0 111.674 176.382 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -157.13 173.15 17.43 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.154 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.0 161.31 52.06 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.211 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -67.15 3.32 1.68 Allowed 'Trans proline' 0 N--CA 1.473 0.273 0 C-N-CA 123.074 2.516 . . . . 0.0 112.554 -178.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -72.61 -23.83 60.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.864 176.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -112.24 108.91 18.3 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.514 ' O ' HG23 ' A' ' 29' ' ' VAL . 64.0 mtt180 -69.66 -36.24 75.87 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -173.412 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -71.96 -46.09 58.68 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.091 -175.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 27' ' ' LEU . 4.5 mm? -69.42 -25.88 64.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 177.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 64.0 t-105 -69.3 -45.3 69.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.385 176.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 25' ' ' ARG . 73.1 t -60.75 -42.47 92.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 110.718 177.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.547 ' HB3' HG21 ' A' ' 18' ' ' THR . 9.8 tt0 -70.12 -31.82 69.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.135 0.493 . . . . 0.0 110.032 178.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.598 ' NH2' ' HA2' ' A' ' 133' ' ' GLY . 2.9 tmt_? -61.44 -40.07 93.13 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 174.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 36' ' ' TYR . 6.5 mp -62.43 -41.74 98.93 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.894 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 7.7 ptmm? -66.31 -33.3 75.41 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.597 -178.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 30' ' ' GLN . 21.6 mm-40 -64.6 -51.83 60.65 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.166 0.508 . . . . 0.0 110.385 177.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.847 ' HB3' HD21 ' A' ' 16' ' ' LEU . 17.2 pt-20 -75.34 -29.19 59.89 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.503 -176.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.436 ' HB2' ' O ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -60.36 -43.58 96.39 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 176.481 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -62.04 -38.13 87.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.403 175.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.437 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 8.8 t -62.71 -46.76 86.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.202 176.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.476 HD22 ' HZ ' ' A' ' 54' ' ' PHE . 66.2 mt -60.12 -55.61 31.71 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.083 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 77.9 mt -59.19 -39.21 78.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.15 -176.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.0 tpp180 -63.12 -45.53 91.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.479 -178.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -67.22 -44.55 79.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.956 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 39' ' ' LEU . 93.5 t -61.89 -42.45 94.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.254 178.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -57.67 -49.31 76.92 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.57 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -54.11 -45.36 71.85 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.322 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -77.33 -28.47 53.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.879 0.371 . . . . 0.0 110.67 -177.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -61.66 -26.58 68.1 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.657 174.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -65.8 -17.62 64.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.932 177.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -99.95 11.0 40.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.211 176.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 32.4 t70 68.83 15.54 8.94 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.115 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -120.24 99.75 6.77 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.408 179.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -76.49 124.6 27.82 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 175.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.522 ' HE3' ' HB3' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -63.56 -58.66 6.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.269 -171.433 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.522 ' HB3' ' HE3' ' A' ' 53' ' ' TRP . 35.7 p90 -154.57 161.21 41.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.019 0.438 . . . . 0.0 110.914 -174.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.0 mtt180 -134.0 121.78 22.09 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.62 HD21 ' HB3' ' A' ' 65' ' ' TRP . 5.7 tt -157.3 137.73 12.92 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -167.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.427 ' N ' HD23 ' A' ' 56' ' ' LEU . 17.6 mm-40 -126.16 168.99 13.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.853 0.359 . . . . 0.0 110.391 -175.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.0 t -143.67 172.46 12.79 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.197 -178.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -68.04 173.71 4.38 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.468 174.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -72.91 -27.01 61.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.114 0.483 . . . . 0.0 109.732 177.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -79.64 -14.02 59.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.396 172.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.74 32.59 84.69 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.739 -179.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 40.4 p -89.28 -29.15 19.4 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -176.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 -130.46 123.49 29.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.62 ' HB3' HD21 ' A' ' 56' ' ' LEU . 47.3 m95 -109.61 132.91 53.7 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.129 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -143.39 139.12 29.84 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.445 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.431 ' HA3' ' HA ' ' A' ' 56' ' ' LEU . . . 172.17 -166.98 39.89 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.118 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.483 ' HZ1' ' HB2' ' A' ' 81' ' ' ASP . 23.0 mtpp -133.65 156.28 48.17 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -178.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.663 ' SG ' ' HB2' ' A' ' 80' ' ' PHE . 5.1 p -118.65 149.64 41.06 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.214 175.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 11.8 m-90 -120.97 138.59 54.07 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.841 -176.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -146.23 120.09 9.31 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.008 0.432 . . . . 0.0 110.332 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.415 ' N ' HD12 ' A' ' 72' ' ' ILE . 3.6 mp -95.62 127.84 47.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 175.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -130.07 108.35 10.01 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -179.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 64.53 -85.95 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.639 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -123.57 -11.63 7.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.192 -176.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 84.8 mt -103.27 145.84 29.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.17 0.51 . . . . 0.0 111.64 -174.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.421 ' HE3' ' HB3' ' A' ' 77' ' ' LYS . 1.1 tmmt? -128.52 120.99 27.82 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -132.42 153.12 51.14 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.958 0.409 . . . . 0.0 111.152 -176.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -116.79 139.21 50.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.698 -176.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.663 ' HB2' ' SG ' ' A' ' 69' ' ' CYS . 46.7 m-85 -121.51 117.37 26.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.855 0.36 . . . . 0.0 110.477 175.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.486 ' H ' ' CB ' ' A' ' 101' ' ' GLU . 9.6 t70 -83.18 130.86 35.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.082 179.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.507 HG22 HG22 ' A' ' 99' ' ' VAL . 23.2 pt -133.92 147.47 30.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.946 -177.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -154.75 151.84 29.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.61 176.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.436 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . 50.3 p90 -167.93 170.31 10.69 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.186 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -114.15 166.4 11.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.415 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 46.2 mm -107.12 90.23 5.31 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.696 178.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.33 164.47 17.54 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.86 2.374 . . . . 0.0 112.697 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.1 mm -63.74 -27.35 42.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.892 -179.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.46 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 3.7 p -75.69 -14.02 60.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.998 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.488 ' CD1' ' HA ' ' A' ' 91' ' ' PRO . 73.3 t80 -78.11 143.58 65.78 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.488 ' HA ' ' CD1' ' A' ' 90' ' ' TYR . 89.4 Cg_endo -95.63 9.73 45.03 Favored 'Cis proline' 0 C--N 1.35 0.641 0 C-N-CA 124.488 -1.047 . . . . 0.0 113.509 1.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.411 ' HA ' HG11 ' A' ' 129' ' ' VAL . 21.5 m -61.03 -31.02 70.66 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.392 0.615 . . . . 0.0 110.201 178.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.46 ' HB ' ' HB ' ' A' ' 89' ' ' THR . 22.9 m -126.33 144.3 50.86 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.195 173.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.83 143.95 82.09 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 120.54 0.21 . . . . 0.0 111.2 -178.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -86.73 171.88 6.91 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.993 2.462 . . . . 0.0 112.421 179.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.806 ' HB3' ' HD3' ' A' ' 114' ' ' LYS . 40.6 mt-10 -101.5 113.53 26.73 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.625 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.436 ' HA ' ' HB3' ' A' ' 84' ' ' PHE . 57.7 mt -92.79 141.42 14.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.726 -177.451 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -118.27 140.31 50.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.733 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.507 HG22 HG22 ' A' ' 82' ' ' ILE . 27.6 t -119.57 86.43 34.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 120.851 0.357 . . . . 0.0 110.288 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.65 -18.51 48.26 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 123.184 2.589 . . . . 0.0 113.138 -175.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.486 ' CB ' ' H ' ' A' ' 81' ' ' ASP . 4.7 tp10 -74.83 -19.0 60.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.036 0.446 . . . . 0.0 110.9 -177.064 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 66.8 mt -97.66 14.47 26.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.239 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -58.89 131.52 51.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.178 -176.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 61.5 23.73 63.03 Favored Glycine 0 C--N 1.334 0.435 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.51 176.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -133.85 -38.0 0.9 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.984 0.421 . . . . 0.0 110.436 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.7 t -80.65 172.85 13.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.837 176.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -74.1 -154.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.025 0.44 . . . . 0.0 111.054 178.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.34 119.93 15.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.011 0.434 . . . . 0.0 110.994 -177.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 6.9 mmt -87.5 178.14 6.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.975 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -92.21 179.71 5.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.363 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -51.85 109.47 0.37 Allowed 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -175.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 92.32 22.57 29.16 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.974 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 76.48 28.34 59.81 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.366 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.806 ' HD3' ' HB3' ' A' ' 96' ' ' GLU . 53.8 mttp -93.56 156.5 16.7 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.486 HD12 HD21 ' A' ' 117' ' ' LEU . 30.3 pt -74.25 139.11 19.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.041 0.448 . . . . 0.0 111.401 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 18.6 t -94.11 109.06 20.86 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.486 HD21 HD12 ' A' ' 115' ' ' ILE . 96.0 mt -91.19 175.62 6.87 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.23 -177.252 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.565 HG23 ' HB2' ' A' ' 121' ' ' PHE . 4.7 t -71.98 146.2 47.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.904 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.463 ' HA ' ' HE3' ' A' ' 122' ' ' LYS . 13.4 t70 -65.49 -30.26 71.01 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.621 -176.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 59.4 t60 -80.03 -15.57 56.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.753 -172.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.565 ' HB2' HG23 ' A' ' 118' ' ' THR . 49.1 t80 -70.93 -34.15 71.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.006 -176.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.53 ' HB2' ' HD3' ' A' ' 123' ' ' PRO . 42.3 mttt -57.81 -58.67 16.87 Favored Pre-proline 0 CA--C 1.539 0.522 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.085 -176.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.53 ' HD3' ' HB2' ' A' ' 122' ' ' LYS . 29.0 Cg_endo -64.37 -34.87 53.04 Favored 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 121.83 1.687 . . . . 0.0 111.976 178.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 42.3 tp -61.62 -45.24 94.92 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 120.837 0.351 . . . . 0.0 110.349 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.47 ' O ' HG23 ' A' ' 129' ' ' VAL . 57.2 t-105 -59.23 -57.26 13.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.587 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.03 -32.17 71.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.884 -175.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -70.36 -36.56 74.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.903 0.382 . . . . 0.0 111.169 -178.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -89.36 -31.16 17.91 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.061 -173.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.562 HG13 ' HA ' ' A' ' 130' ' ' PRO . 51.2 t -53.64 138.95 51.05 Favored Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 176.128 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.562 ' HA ' HG13 ' A' ' 129' ' ' VAL . 6.9 Cg_endo -88.59 -151.64 0.52 Allowed 'Cis proline' 0 C--N 1.349 0.591 0 C-N-CA 124.727 -0.947 . . . . 0.0 114.453 6.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 130' ' ' PRO . 9.4 mtmp? 75.24 36.66 0.5 Allowed 'General case' 0 C--N 1.343 0.309 0 C-N-CA 123.759 0.823 . . . . 0.0 110.427 -172.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -128.01 152.9 47.37 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.828 -179.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.598 ' HA2' ' NH2' ' A' ' 31' ' ' ARG . . . -146.1 175.17 25.72 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 47.6 tp -58.45 -38.25 77.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 117.355 0.578 . . . . 0.0 111.497 -176.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.12 -43.85 70.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.732 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 29.5 m80 -70.33 -36.61 74.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.682 0.277 . . . . 0.0 110.73 -178.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 60.6 tp -66.75 -50.57 62.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.283 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 21.8 ptm -71.69 -31.67 67.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.55 -175.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -73.22 -45.35 56.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.682 0.277 . . . . 0.0 111.418 -179.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 91.2 mt -85.72 -15.98 40.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.569 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -98.79 -69.44 0.93 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.433 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' LEU . . . . . 0.589 ' O ' ' HG ' ' A' ' 146' ' ' LEU . 94.9 mt -65.97 -38.69 89.19 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -176.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.32 -62.28 6.15 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 121.086 -0.578 . . . . 0.0 113.352 -177.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -64.4 -31.17 62.38 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.55 2.167 . . . . 0.0 112.414 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' TRP . . . . . . . . . . . . . 38.3 t90 -62.57 -39.51 93.9 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.009 0.433 . . . . 0.0 110.621 -178.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.624 ' O ' ' HB ' ' A' ' 150' ' ' ILE . 98.7 mt -60.1 -34.52 73.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.876 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.02 -4.89 41.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.759 -176.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 61.4 t -85.47 -56.12 5.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.702 -0.226 . . . . 0.0 111.511 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -107.07 -29.49 9.36 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -172.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.624 ' HB ' ' O ' ' A' ' 146' ' ' LEU . 1.7 mp -57.91 -48.7 96.67 Favored Pre-proline 0 CA--C 1.541 0.622 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -175.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' PRO . . . . . 0.448 ' O ' ' HG3' ' A' ' 155' ' ' GLN . 54.3 Cg_exo -54.59 -37.87 90.65 Favored 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 121.79 1.66 . . . . 0.0 112.346 175.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.31 -44.4 87.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.401 179.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 9.8 mp -60.84 -36.9 80.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.887 176.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 150' ' ' ILE . 64.9 mt -66.48 -41.18 88.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.816 178.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 151' ' ' PRO . 52.8 mt-30 -62.89 -39.06 93.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.023 0.439 . . . . 0.0 111.326 178.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -85.98 -5.58 59.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.633 -178.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 71.8 38.31 60.78 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.06 -0.591 . . . . 0.0 112.781 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 5.4 t -91.07 4.17 6.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.546 0.689 . . . . 0.0 110.105 -178.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ILE . . . . . . . . . . . . . 47.8 mm -71.48 130.13 35.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.174 179.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -64.04 -34.73 78.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.095 -178.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -78.54 123.4 27.04 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -88.44 -164.21 1.09 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.244 0.545 . . . . 0.0 111.574 -175.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -60.61 162.76 6.1 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.452 179.068 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 164' ' ' LYS . 32.4 mmtp -82.67 -13.54 56.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.363 -177.429 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' CYS . . . . . . . . . . . . . 43.3 t -68.72 95.55 0.67 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.198 -0.456 . . . . 0.0 109.979 175.045 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.41 177.41 10.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.962 -178.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -85.13 160.84 19.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.208 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -65.9 116.87 7.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.1 178.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -86.36 122.23 30.03 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.826 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -82.14 109.35 16.37 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.73 -9.24 58.37 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.056 0.455 . . . . 0.0 111.176 -175.129 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 33.5 t-80 -147.36 134.15 20.08 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 51.8 m170 -93.94 154.2 17.81 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.023 0.439 . . . . 0.0 110.891 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -101.49 -174.87 2.7 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.566 178.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 79.0 m-70 . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.683 -0.675 . . . . 0.0 109.305 176.051 . . . . . . . . 0 0 . 1 stop_ save_