data_1mvz_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 1mvz _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 ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.8 p -122.49 -168.75 1.78 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.425 1.49 . . . . 0.0 109.832 -172.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.1 t -165.99 179.22 5.95 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 170.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -132.71 -74.94 0.5 Allowed 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 170.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -90.33 115.75 27.76 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 171.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 30.0 p -119.96 72.52 17.39 Favored Pre-proline 0 CA--C 1.532 0.285 0 C-N-CA 123.571 0.748 . . . . 0.0 112.277 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -75.55 161.3 37.35 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.638 2.225 . . . . 0.0 110.758 176.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.0 m -139.27 158.48 44.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.206 1.002 . . . . 0.0 110.694 -179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.7 p -77.88 157.06 29.99 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 169.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -106.89 36.47 2.65 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.76 0.824 . . . . 0.0 109.604 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.2 p -86.52 179.46 6.83 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.924 1.69 . . . . 0.0 110.328 175.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -126.16 104.74 25.58 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 125.28 1.432 . . . . 0.0 107.888 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.34 159.06 97.95 Favored 'Cis proline' 0 CA--C 1.536 0.593 0 CA-C-N 119.619 0.9 . . . . 0.0 110.297 -3.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -75.73 142.12 25.36 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.272 2.648 . . . . 0.0 109.885 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.87 126.98 55.69 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.57 1.148 . . . . 0.0 107.976 171.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.3 m -104.82 151.3 23.96 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.668 1.187 . . . . 0.0 109.339 175.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -141.86 -179.58 6.29 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 123.997 0.919 . . . . 0.0 109.866 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 93.3 m -110.83 141.61 43.96 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 167.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.7 p -117.64 34.28 5.22 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 166.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -81.66 149.77 28.38 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.526 0.679 . . . . 0.0 110.259 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 62.6 t -142.7 122.13 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 C-N-CA 126.004 1.722 . . . . 0.0 106.415 -177.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -162.91 -150.25 0.16 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -166.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -68.72 -142.96 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 162.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -67.48 158.37 32.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 120.876 -1.14 . . . . 0.0 111.827 -174.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.6 p -74.12 159.2 32.93 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.569 1.548 . . . . 0.0 111.643 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -80.62 177.37 9.06 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -169.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.5 t -78.48 21.59 0.37 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.5 -1.227 . . . . 0.0 113.054 -172.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -155.3 64.34 0.62 Allowed 'General case' 0 C--N 1.341 0.236 0 CA-C-N 118.741 0.7 . . . . 0.0 109.797 173.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 76.5 m -123.79 127.93 48.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.868 0.867 . . . . 0.0 109.327 179.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -102.86 -36.52 8.21 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.769 1.628 . . . . 0.0 107.806 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -106.03 114.87 29.28 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 162.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 24.9 t -134.17 132.64 40.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.622 1.569 . . . . 0.0 107.445 169.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.2 tp -157.34 157.3 33.87 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.6 m -122.22 166.17 15.03 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.827 0.851 . . . . 0.0 110.352 -174.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.7 t -89.73 150.25 22.38 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 168.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -82.88 0.93 41.91 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.149 1.38 . . . . 0.0 112.403 177.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 m -69.33 -178.09 1.28 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.036 1.334 . . . . 0.0 111.512 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -120.3 111.05 35.41 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.727 1.211 . . . . 0.0 108.163 175.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -74.36 149.86 94.62 Favored 'Cis proline' 0 N--CA 1.458 -0.611 0 CA-C-N 119.972 1.026 . . . . 0.0 110.611 0.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -75.94 108.58 2.71 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.754 2.303 . . . . 0.0 108.338 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -104.4 140.17 38.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -177.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 65.8 m -107.07 151.04 25.89 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 123.843 0.857 . . . . 0.0 109.701 -172.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.0 mtm105 -144.86 143.27 30.52 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.528 -1.215 . . . . 0.0 108.668 -156.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 46.5 t -112.05 131.92 55.13 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 124.072 0.949 . . . . 0.0 109.014 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -127.43 37.35 4.25 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.286 1.434 . . . . 0.0 109.942 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -56.33 154.99 7.41 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.242 1.017 . . . . 0.0 111.628 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.7 mm -115.25 111.72 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 171.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.3 p -130.5 163.53 26.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.933 1.293 . . . . 0.0 108.135 173.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -70.02 -21.27 63.22 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.895 -0.503 . . . . 0.0 111.54 174.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -130.55 -179.29 5.19 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.898 1.279 . . . . 0.0 111.911 -165.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.8 t -112.78 147.88 35.97 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.642 1.977 . . . . 0.0 109.992 177.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -97.58 159.37 31.23 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 125.914 1.686 . . . . 0.0 109.566 176.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.2 164.5 22.47 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.284 2.656 . . . . 0.0 112.266 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.22 141.61 58.7 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.469 1.107 . . . . 0.0 112.178 -174.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.135 0 C-N-CA 124.55 1.14 . . . . 0.0 111.81 -178.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.986 0.422 . . . . 0.0 111.371 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.4 p -127.46 -175.77 3.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.436 1.494 . . . . 0.0 109.785 -176.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 46.4 t -172.0 160.55 5.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.642 1.977 . . . . 0.0 107.329 171.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -108.44 -77.01 0.6 Allowed 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 171.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -88.52 111.49 21.9 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.8 p -118.14 67.08 6.34 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 124.749 1.22 . . . . 0.0 111.377 -177.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.93 145.67 56.85 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.624 2.216 . . . . 0.0 110.453 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.1 m -132.46 159.06 40.43 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.049 0.94 . . . . 0.0 110.933 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.0 p -90.04 157.85 17.61 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.648 1.179 . . . . 0.0 108.932 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.5 mtm105 -108.47 35.92 3.01 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.914 0.886 . . . . 0.0 109.515 176.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 76.1 p -89.15 -176.67 5.2 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.902 1.281 . . . . 0.0 110.264 175.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.5 mm -129.71 113.08 17.72 Favored Pre-proline 0 CA--C 1.536 0.41 0 C-N-CA 124.75 1.22 . . . . 0.0 108.842 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.44 151.63 90.79 Favored 'Cis proline' 0 CA--C 1.538 0.679 0 N-CA-C 109.131 -1.142 . . . . 0.0 109.131 -9.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -75.25 132.54 15.21 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.209 2.606 . . . . 0.0 109.417 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.9 137.17 43.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 173.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 54.0 m -107.74 149.85 27.67 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.227 1.411 . . . . 0.0 108.744 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -135.71 172.19 13.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.134 1.374 . . . . 0.0 108.432 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 18.5 m -127.47 134.42 49.83 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 172.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 67.5 p -115.68 24.97 11.12 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.439 1.096 . . . . 0.0 109.953 174.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -70.82 150.38 45.89 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 123.514 0.726 . . . . 0.0 109.696 172.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 69.2 t -136.51 126.04 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 126.231 1.812 . . . . 0.0 106.244 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.06 -156.37 0.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 -165.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -78.67 -137.89 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.934 1.294 . . . . 0.0 108.438 175.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -63.38 161.82 13.47 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.12 0.873 . . . . 0.0 111.758 -176.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 m -76.11 152.26 36.81 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.368 1.467 . . . . 0.0 108.893 -175.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -76.83 165.82 24.18 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.6 t -49.41 -40.17 35.35 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 126.083 1.753 . . . . 0.0 111.851 -179.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.29 32.21 4.82 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 124.267 1.027 . . . . 0.0 111.742 -177.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 20.4 t -99.69 126.46 45.73 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.637 0.775 . . . . 0.0 109.196 176.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.9 tttm -106.55 -45.36 4.26 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.017 0.927 . . . . 0.0 110.75 -174.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 t -105.28 126.06 51.67 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 172.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.2 t -147.78 142.1 26.27 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.531 1.133 . . . . 0.0 108.172 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.3 tp -148.2 151.77 36.08 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.0 m -126.27 166.18 17.59 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.917 0.887 . . . . 0.0 110.837 -172.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.7 p -83.47 153.52 24.41 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.287 0.635 . . . . 0.0 109.59 171.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -87.55 15.14 7.05 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.675 0.79 . . . . 0.0 111.859 172.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 80.0 p -76.97 -176.45 3.96 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.337 1.055 . . . . 0.0 111.6 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -134.93 114.67 11.92 Favored Pre-proline 0 N--CA 1.451 -0.411 0 C-N-CA 125.007 1.323 . . . . 0.0 108.86 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.06 142.46 72.94 Favored 'Cis proline' 0 N--CA 1.457 -0.659 0 CA-C-N 119.655 0.912 . . . . 0.0 110.033 -1.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.26 125.56 11.48 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.925 2.417 . . . . 0.0 109.097 177.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 30.8 mm100 -106.28 129.85 54.23 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 62.4 m -106.21 149.38 26.9 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.827 0.851 . . . . 0.0 109.325 -175.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.2 mtm105 -142.56 120.79 12.25 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 -160.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 48.4 t -83.8 124.96 31.47 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -178.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -117.97 26.57 9.57 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.266 1.426 . . . . 0.0 111.386 -179.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -57.71 147.2 28.51 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.572 0.749 . . . . 0.0 110.164 -178.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.3 mm -102.32 130.91 51.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 106.198 -1.779 . . . . 0.0 106.198 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 35.5 p -139.81 -171.56 3.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.99 1.316 . . . . 0.0 108.15 -170.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -128.66 15.53 6.47 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.493 1.117 . . . . 0.0 109.922 172.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -159.02 176.91 11.71 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.031 1.333 . . . . 0.0 110.394 -165.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.0 t -123.42 144.81 49.25 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 125.269 1.427 . . . . 0.0 109.63 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -92.51 157.41 40.21 Favored Pre-proline 0 N--CA 1.451 -0.389 0 C-N-CA 125.444 1.498 . . . . 0.0 109.367 175.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.37 162.73 29.3 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.967 2.445 . . . . 0.0 110.789 174.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.08 138.64 58.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 123.825 0.85 . . . . 0.0 112.128 -172.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.529 0.146 0 C-N-CA 123.624 0.77 . . . . 0.0 111.359 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.147 0 N-CA-C 110.724 -0.102 . . . . 0.0 110.724 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.1 p -119.89 -179.2 3.84 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 122.099 0.952 . . . . 0.0 111.023 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.5 t -176.4 175.29 1.81 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 128.17 2.588 . . . . 0.0 105.516 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -142.84 -62.99 0.42 Allowed 'General case' 0 CA--C 1.527 0.083 0 CA-C-N 119.446 1.021 . . . . 0.0 108.833 164.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -90.86 104.78 17.33 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.3 p -118.04 75.01 10.61 Favored Pre-proline 0 CA--C 1.532 0.271 0 C-N-CA 124.852 1.261 . . . . 0.0 111.694 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.42 156.58 65.56 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.707 2.272 . . . . 0.0 110.662 170.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.5 m -142.67 166.2 25.3 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.059 0.944 . . . . 0.0 111.164 -172.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.9 p -82.74 162.0 21.89 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.163 0.985 . . . . 0.0 109.243 166.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -108.24 36.86 2.65 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.884 0.874 . . . . 0.0 109.59 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.7 p -85.15 -177.15 6.45 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.416 1.086 . . . . 0.0 111.018 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.3 tp -123.57 96.65 43.21 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 125.828 1.651 . . . . 0.0 109.474 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.02 163.47 89.38 Favored 'Cis proline' 0 CA--C 1.535 0.558 0 CA-C-N 119.747 0.945 . . . . 0.0 110.549 -3.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -76.89 149.17 28.96 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 123.371 2.714 . . . . 0.0 110.165 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -125.14 133.77 52.69 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.283 1.433 . . . . 0.0 108.413 175.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 77.7 m -109.89 152.73 25.43 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.308 1.443 . . . . 0.0 110.278 176.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -139.42 152.61 47.21 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.136 0.975 . . . . 0.0 108.894 172.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 23.4 m -103.45 118.0 35.74 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 125.03 1.332 . . . . 0.0 107.664 -176.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 50.5 p -107.89 15.95 23.97 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.46 1.104 . . . . 0.0 111.829 -164.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -65.31 152.59 43.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.022 0.439 . . . . 0.0 109.919 167.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.5 t -132.73 119.09 36.63 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.114 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 -176.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.1 mmm-85 -158.79 -162.93 1.16 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.597 1.159 . . . . 0.0 108.857 -162.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.99 -144.92 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.041 0.936 . . . . 0.0 109.082 170.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -61.85 154.62 25.49 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 121.299 -0.876 . . . . 0.0 110.755 -174.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 96.4 m -78.22 168.8 19.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.982 0.913 . . . . 0.0 110.621 -174.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.0 p80 -86.27 171.75 11.0 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.679 0.752 . . . . 0.0 112.818 -175.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.6 t -57.55 -34.42 69.15 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.52 1.528 . . . . 0.0 112.697 -176.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -105.96 44.59 1.03 Allowed 'General case' 0 C--N 1.338 0.096 0 C-N-CA 124.068 0.947 . . . . 0.0 109.723 -175.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 15.9 t -147.57 114.89 6.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -104.6 -36.63 7.42 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.756 1.223 . . . . 0.0 110.549 -162.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.9 t -102.66 108.89 20.31 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 171.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 44.3 t -118.27 129.19 55.32 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.647 1.979 . . . . 0.0 106.833 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -135.02 147.97 49.81 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 125.074 1.349 . . . . 0.0 108.056 -171.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 m -135.44 157.53 46.66 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.371 0.668 . . . . 0.0 110.832 -173.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -84.74 154.37 22.46 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.173 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -90.31 10.74 23.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.693 1.197 . . . . 0.0 111.971 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -70.78 -179.35 2.17 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.681 1.192 . . . . 0.0 111.058 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -120.55 115.17 32.57 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.463 1.105 . . . . 0.0 108.22 171.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -71.97 151.64 96.02 Favored 'Cis proline' 0 N--CA 1.456 -0.681 0 CA-C-N 119.627 0.902 . . . . 0.0 110.04 -2.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -72.25 137.29 28.3 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.458 2.105 . . . . 0.0 107.923 167.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -149.83 145.43 26.57 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -171.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 72.5 m -111.46 162.76 14.75 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.627 0.771 . . . . 0.0 112.658 -161.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 ttp85 -152.44 154.7 36.06 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 127.199 2.2 . . . . 0.0 108.292 -167.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 8.8 m -89.05 125.73 35.13 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.026 0.93 . . . . 0.0 110.23 173.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -105.91 20.33 19.11 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.885 1.274 . . . . 0.0 109.439 169.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -84.25 149.81 25.86 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.702 1.201 . . . . 0.0 109.755 -177.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.9 mm -108.74 135.51 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 124.86 1.264 . . . . 0.0 108.488 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.9 p -139.37 151.21 46.15 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 165.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -64.37 -37.25 86.86 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.635 0.374 . . . . 0.0 110.737 170.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.0 p90 -102.43 -172.94 2.22 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.179 1.792 . . . . 0.0 111.142 -172.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 35.2 t -142.35 149.92 40.05 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.451 1.9 . . . . 0.0 108.763 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -91.65 155.9 43.4 Favored Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 124.914 1.285 . . . . 0.0 109.582 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -63.33 159.69 38.57 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.629 2.219 . . . . 0.0 110.578 175.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.1 m -62.31 143.77 56.52 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 121.252 0.549 . . . . 0.0 111.995 -171.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.454 -0.241 0 C-N-CA 124.956 1.303 . . . . 0.0 110.673 -179.17 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.205 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.0 p -135.49 162.99 31.1 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.264 1.026 . . . . 0.0 111.255 178.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.4 t -171.35 142.02 1.64 Allowed 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 125.939 1.696 . . . . 0.0 108.544 -174.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -103.61 -73.02 0.68 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.195 0.998 . . . . 0.0 108.567 -174.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -77.05 108.05 9.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.0 p -132.94 62.65 63.34 Favored Pre-proline 0 N--CA 1.452 -0.339 0 C-N-CA 124.488 1.115 . . . . 0.0 111.497 -173.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.72 159.38 52.98 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.708 2.272 . . . . 0.0 111.031 178.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 24.1 m -131.3 153.98 49.01 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.839 0.856 . . . . 0.0 110.004 177.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.1 p -82.15 164.12 21.49 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.139 1.375 . . . . 0.0 109.691 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -106.81 25.54 11.15 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.188 0.995 . . . . 0.0 110.744 -177.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.5 p -81.97 -179.68 7.49 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.715 1.206 . . . . 0.0 110.432 176.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -126.84 106.38 22.71 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 124.797 1.239 . . . . 0.0 108.188 179.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.26 159.31 96.06 Favored 'Cis proline' 0 N--CA 1.458 -0.602 0 CA-C-N 119.373 0.812 . . . . 0.0 110.094 -4.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.0 138.23 22.75 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.869 2.38 . . . . 0.0 109.368 173.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -106.52 135.19 48.47 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 173.002 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.8 m -107.1 143.54 35.09 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.283 1.033 . . . . 0.0 108.876 175.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -146.15 159.26 43.55 Favored 'General case' 0 N--CA 1.457 -0.095 0 C-N-CA 124.175 0.99 . . . . 0.0 108.964 -173.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.0 m -106.26 137.47 44.16 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.851 0.86 . . . . 0.0 109.614 -178.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.1 p -120.57 -12.91 8.84 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.429 1.092 . . . . 0.0 112.041 -174.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -65.36 150.38 48.39 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.481 0.582 . . . . 0.0 110.804 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.7 t -118.02 118.16 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 125.186 1.394 . . . . 0.0 107.907 -170.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -141.67 -166.76 2.28 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.781 1.633 . . . . 0.0 108.676 -171.461 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -77.26 -132.86 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 167.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -60.94 150.54 32.96 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.917 1.235 . . . . 0.0 111.31 -173.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.1 p -87.77 151.8 22.61 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 126.357 1.863 . . . . 0.0 109.831 -176.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.3 p80 -72.9 168.24 19.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -159.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.2 t -51.32 -38.09 51.16 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 126.232 1.813 . . . . 0.0 112.188 -178.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.54 31.3 4.77 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.295 1.038 . . . . 0.0 111.513 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 18.2 t -104.48 128.06 52.32 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.153 0.981 . . . . 0.0 108.806 175.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -107.73 -46.68 3.76 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.473 1.109 . . . . 0.0 110.704 -173.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 t -104.97 131.01 53.02 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 172.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 44.8 t -154.75 145.73 22.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.669 1.188 . . . . 0.0 108.434 -174.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 7.4 tt -148.77 150.22 32.71 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.7 m -127.75 159.17 35.61 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.4 1.08 . . . . 0.0 110.211 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 69.0 p -81.56 155.58 25.65 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.569 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.6 ptt85 -93.47 26.01 3.19 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.304 1.441 . . . . 0.0 110.09 170.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.4 m -87.74 178.81 6.63 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.243 1.417 . . . . 0.0 110.66 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -129.19 105.08 17.93 Favored Pre-proline 0 N--CA 1.441 -0.895 0 C-N-CA 126.751 2.021 . . . . 0.0 108.122 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -72.55 155.4 99.01 Favored 'Cis proline' 0 CA--C 1.537 0.653 0 CA-C-N 119.802 0.965 . . . . 0.0 111.054 -1.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -75.84 130.43 12.44 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.604 2.869 . . . . 0.0 109.459 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -121.66 136.64 54.94 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.019 1.328 . . . . 0.0 109.038 -176.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 66.6 m -108.79 156.46 19.6 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.42 1.088 . . . . 0.0 111.556 -172.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -152.85 143.64 22.86 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 124.327 1.051 . . . . 0.0 109.768 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 33.0 t -92.53 121.15 33.69 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 124.928 1.291 . . . . 0.0 109.363 -177.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.07 20.84 18.45 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.874 1.269 . . . . 0.0 111.14 -174.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -62.7 150.33 41.39 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.658 0.783 . . . . 0.0 110.964 -175.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.1 mm -105.77 126.41 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 70.4 p -136.34 -169.37 2.43 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.01 1.324 . . . . 0.0 108.714 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -128.83 9.03 5.8 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.392 1.477 . . . . 0.0 110.983 173.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -148.9 -176.11 5.21 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 126.008 1.723 . . . . 0.0 109.811 -169.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.4 t -132.11 144.4 50.69 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.714 1.206 . . . . 0.0 109.207 174.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -88.58 160.27 44.98 Favored Pre-proline 0 CA--C 1.534 0.348 0 C-N-CA 125.14 1.376 . . . . 0.0 109.089 174.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -61.23 162.52 19.74 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.185 1.924 . . . . 0.0 111.198 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.61 138.79 33.7 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.929 1.291 . . . . 0.0 112.076 -177.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.071 0 C-N-CA 124.406 1.082 . . . . 0.0 110.347 178.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.107 0 CA-C-O 120.373 0.13 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.6 p -129.73 -176.17 3.83 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 124.844 1.258 . . . . 0.0 109.329 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 49.6 t -171.98 158.22 4.65 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 126.16 1.784 . . . . 0.0 107.447 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -105.67 -60.91 1.56 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -114.8 115.31 26.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.799 1.239 . . . . 0.0 108.54 -177.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 11.0 p -131.81 78.88 69.29 Favored Pre-proline 0 N--CA 1.453 -0.322 0 C-N-CA 125.037 1.335 . . . . 0.0 112.063 -173.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -71.09 161.89 44.47 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.628 2.219 . . . . 0.0 110.919 173.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.0 m -133.03 156.99 46.34 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.382 1.073 . . . . 0.0 109.462 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.1 p -84.5 164.96 18.48 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.098 1.359 . . . . 0.0 110.31 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.7 ptt-85 -108.52 5.49 25.22 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.881 1.272 . . . . 0.0 112.463 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.3 p -73.19 175.99 6.29 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.047 1.339 . . . . 0.0 110.857 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 tp -124.74 115.38 26.65 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 125.001 1.32 . . . . 0.0 108.943 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -70.48 152.23 93.97 Favored 'Cis proline' 0 N--CA 1.458 -0.589 0 CA-C-N 119.798 0.964 . . . . 0.0 109.869 -6.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -79.48 136.77 12.64 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.018 2.478 . . . . 0.0 109.779 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -108.43 149.93 28.08 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.454 1.501 . . . . 0.0 109.715 170.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 96.6 m -112.47 148.69 33.88 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.515 1.526 . . . . 0.0 109.287 170.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -156.1 169.68 23.94 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.63 1.172 . . . . 0.0 108.981 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 92.3 m -106.87 141.64 37.78 Favored 'General case' 0 CA--C 1.521 -0.173 0 C-N-CA 123.135 0.574 . . . . 0.0 110.916 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.2 t -108.52 -26.17 10.56 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.97 1.308 . . . . 0.0 110.668 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -58.67 142.36 49.88 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-O 121.561 0.696 . . . . 0.0 111.198 -177.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.6 t -113.25 133.96 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 C-N-CA 125.8 1.64 . . . . 0.0 107.471 -172.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.7 tpp180 -160.84 -150.47 0.21 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -174.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -80.05 -150.48 0.06 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.668 0.787 . . . . 0.0 108.93 173.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -60.17 158.12 11.98 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.476 0.655 . . . . 0.0 110.912 -177.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 65.1 m -80.45 163.12 24.04 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.127 -170.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -80.04 172.67 13.47 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.513 0.673 . . . . 0.0 112.242 -174.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.2 t -55.12 -28.93 56.24 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.466 1.507 . . . . 0.0 113.003 -176.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.86 48.59 0.84 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.441 1.096 . . . . 0.0 110.161 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 84.5 m -128.92 133.69 47.97 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 164.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -103.96 -42.19 5.64 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.167 1.387 . . . . 0.0 108.925 -177.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.9 t -105.95 130.04 53.97 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 171.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.8 t -138.91 132.92 31.17 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 125.707 1.603 . . . . 0.0 107.023 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -138.23 148.36 44.69 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 124.205 1.002 . . . . 0.0 109.06 -170.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.0 m -136.41 158.86 43.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.716 0.806 . . . . 0.0 110.318 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.2 t -87.36 155.38 20.06 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 123.516 0.51 . . . . 0.0 110.118 175.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -90.15 8.89 30.61 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.879 1.271 . . . . 0.0 111.578 174.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.6 m -65.55 177.19 1.24 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.244 1.018 . . . . 0.0 110.934 174.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -122.93 113.4 30.02 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 174.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.55 147.37 89.01 Favored 'Cis proline' 0 CA--C 1.538 0.698 0 CA-C-N 119.788 0.96 . . . . 0.0 111.13 0.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.03 106.02 2.19 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.493 2.795 . . . . 0.0 108.772 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -107.9 147.98 30.24 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.051 0.94 . . . . 0.0 109.516 -173.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 91.8 m -116.62 159.68 21.81 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.322 1.049 . . . . 0.0 112.043 -166.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.7 ttp-105 -155.56 149.4 25.37 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 125.05 1.34 . . . . 0.0 109.722 -174.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 44.6 t -82.66 136.59 34.73 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.906 1.282 . . . . 0.0 109.882 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -122.36 18.0 10.59 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.171 1.389 . . . . 0.0 110.917 -178.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -79.25 149.1 31.96 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.036 0.934 . . . . 0.0 110.114 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 52.1 mm -108.73 133.73 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 C-N-CA 124.693 1.197 . . . . 0.0 108.763 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 67.4 p -138.9 -169.87 2.73 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.065 1.346 . . . . 0.0 108.233 175.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -117.66 5.71 12.37 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.05 1.34 . . . . 0.0 111.393 171.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -142.33 -178.0 5.53 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.233 1.413 . . . . 0.0 110.39 -171.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 41.5 t -140.54 145.5 36.87 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.546 1.138 . . . . 0.0 109.223 174.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -79.67 157.6 74.31 Favored Pre-proline 0 N--CA 1.451 -0.382 0 C-N-CA 125.097 1.359 . . . . 0.0 109.793 176.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -60.85 154.35 56.55 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.651 2.234 . . . . 0.0 110.823 177.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.2 138.04 57.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.594 0.758 . . . . 0.0 112.49 -168.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.531 0.246 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.035 176.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.273 0 CA-C-O 121.009 0.433 . . . . 0.0 110.423 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.7 p -120.17 -168.12 1.57 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 125.765 1.626 . . . . 0.0 109.875 -176.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.8 t -163.05 -178.87 6.31 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.442 1.497 . . . . 0.0 107.296 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -140.34 -56.61 0.53 Allowed 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 164.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 14.4 m-30 -93.43 112.66 24.63 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 176.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.1 m -113.2 68.38 1.2 Allowed Pre-proline 0 CA--C 1.537 0.443 0 C-N-CA 125.723 1.609 . . . . 0.0 111.303 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -79.85 165.15 22.4 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 121.631 1.554 . . . . 0.0 109.854 171.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.6 t -156.69 163.58 39.13 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.957 -178.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 70.6 p -72.96 175.98 6.13 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.981 171.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -106.48 4.93 28.81 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.317 1.047 . . . . 0.0 111.569 170.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 55.8 p -81.2 179.69 7.74 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.7 1.2 . . . . 0.0 112.043 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.5 tp -132.68 107.25 12.94 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 126.337 1.855 . . . . 0.0 108.194 -174.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -70.05 158.75 91.57 Favored 'Cis proline' 0 N--CA 1.457 -0.67 0 CA-C-N 119.808 0.967 . . . . 0.0 111.783 -1.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -78.74 135.95 13.16 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 124.067 3.178 . . . . 0.0 110.315 178.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -106.35 101.82 11.26 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 176.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 38.7 m -108.13 143.25 37.15 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.301 1.04 . . . . 0.0 108.783 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -139.46 177.24 8.07 Favored 'General case' 0 C--N 1.339 0.136 0 O-C-N 123.686 0.616 . . . . 0.0 111.294 -171.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 53.3 m -106.71 131.67 53.58 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 163.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 53.5 p -120.92 -1.71 9.86 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -67.01 137.77 56.73 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 118.507 0.594 . . . . 0.0 110.342 174.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.7 t -112.54 120.78 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 -170.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.1 mmm-85 -150.53 -161.11 1.27 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.225 1.41 . . . . 0.0 108.293 -164.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -68.38 -153.6 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 165.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -56.77 150.74 15.53 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -170.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.6 p -64.02 145.7 55.42 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 113.92 -1.491 . . . . 0.0 110.954 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.1 p80 -71.92 176.04 5.34 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -164.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.5 t -75.05 26.42 0.09 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.857 1.263 . . . . 0.0 113.18 -175.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -157.03 62.79 0.5 Allowed 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.622 0.769 . . . . 0.0 109.693 171.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.2 m -127.07 130.93 50.87 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.935 0.894 . . . . 0.0 109.82 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -105.48 -45.33 4.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.494 1.518 . . . . 0.0 107.572 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.2 t -107.88 139.64 42.17 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 166.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 18.8 t -156.28 147.54 22.4 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.536 1.534 . . . . 0.0 107.914 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.4 tp -156.53 157.05 34.71 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.4 m -126.41 160.69 29.77 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.029 0.932 . . . . 0.0 109.807 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 60.3 p -77.18 155.14 32.47 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.509 0.723 . . . . 0.0 110.596 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -91.25 10.65 26.34 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.918 0.887 . . . . 0.0 111.932 173.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 p -73.31 176.55 5.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.965 0.906 . . . . 0.0 111.071 176.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -128.16 112.23 19.94 Favored Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 124.645 1.178 . . . . 0.0 108.008 174.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.32 150.25 91.27 Favored 'Cis proline' 0 N--CA 1.456 -0.707 0 CA-C-N 119.517 0.863 . . . . 0.0 110.392 -1.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.06 154.6 47.44 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.31 2.673 . . . . 0.0 109.1 172.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -149.92 137.85 20.23 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.121 0.568 . . . . 0.0 109.487 -172.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.3 m -108.22 154.75 21.31 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 123.638 0.775 . . . . 0.0 112.542 -164.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -152.24 148.16 27.24 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.399 1.08 . . . . 0.0 109.526 -176.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 36.2 t -99.71 118.94 37.29 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 125.95 1.7 . . . . 0.0 109.157 -176.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -107.49 26.41 10.27 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.945 0.898 . . . . 0.0 111.704 -171.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -62.11 138.82 58.45 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.526 0.73 . . . . 0.0 110.4 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 19.3 mm -105.4 111.62 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.3 p -138.05 161.15 37.49 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.775 0.83 . . . . 0.0 109.767 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -74.73 -20.7 59.72 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.21 0.604 . . . . 0.0 111.774 173.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 36.0 p90 -115.3 -172.54 2.16 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 125.936 1.694 . . . . 0.0 109.982 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.5 t -145.74 155.45 42.96 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.37 1.068 . . . . 0.0 109.066 171.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -82.64 157.22 67.47 Favored Pre-proline 0 N--CA 1.451 -0.391 0 C-N-CA 124.252 1.021 . . . . 0.0 109.642 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.38 176.23 8.27 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.064 2.509 . . . . 0.0 111.442 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 p -63.3 141.72 58.66 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.948 0.899 . . . . 0.0 112.123 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.532 0.276 0 C-N-CA 124.539 1.136 . . . . 0.0 111.238 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.465 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.0 p -143.15 169.32 17.82 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 122.1 0.952 . . . . 0.0 111.505 178.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.8 t -158.32 153.13 24.96 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 126.234 1.814 . . . . 0.0 107.113 -168.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -107.26 -70.79 0.78 Allowed 'General case' 0 C--N 1.339 0.109 0 C-N-CA 123.406 0.682 . . . . 0.0 109.751 -170.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -89.89 111.68 22.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 173.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 4.8 t -126.68 69.1 70.47 Favored Pre-proline 0 CA--C 1.533 0.302 0 O-C-N 123.853 0.721 . . . . 0.0 112.461 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.1 158.99 55.69 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.8 2.333 . . . . 0.0 110.924 174.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.1 m -136.75 158.09 45.26 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.972 0.909 . . . . 0.0 110.926 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.3 p -79.2 163.83 24.69 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.618 0.767 . . . . 0.0 109.082 172.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 68.9 mtp85 -113.36 33.39 5.14 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.827 0.851 . . . . 0.0 109.862 172.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.3 p -78.71 176.91 9.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.507 1.123 . . . . 0.0 109.687 168.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.6 mm -127.76 111.72 20.56 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.577 1.151 . . . . 0.0 108.203 176.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.1 157.67 89.93 Favored 'Cis proline' 0 CA--C 1.537 0.668 0 CA-C-N 119.206 0.752 . . . . 0.0 110.218 -5.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -82.46 146.87 13.91 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.866 3.044 . . . . 0.0 110.734 175.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -120.64 130.14 54.02 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.673 1.589 . . . . 0.0 108.106 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 80.1 m -106.93 144.39 33.64 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.979 1.311 . . . . 0.0 109.164 174.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -140.74 160.34 40.26 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.103 1.361 . . . . 0.0 109.652 -176.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.6 m -107.29 125.96 51.82 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 124.271 1.028 . . . . 0.0 109.535 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.1 p -108.95 -17.8 13.83 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.475 1.11 . . . . 0.0 112.157 -172.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -62.34 142.84 57.59 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.127 0.571 . . . . 0.0 111.191 176.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.8 t -114.16 137.32 47.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 125.342 1.457 . . . . 0.0 107.838 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -160.07 -153.63 0.35 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 -174.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -76.72 -153.83 0.05 Allowed 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.834 0.854 . . . . 0.0 108.887 167.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 158.44 7.75 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.368 0.667 . . . . 0.0 112.017 -171.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.2 m -72.51 164.83 25.78 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.997 0.919 . . . . 0.0 111.424 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 22.7 p80 -78.07 168.76 19.37 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.79 0.805 . . . . 0.0 112.689 -171.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.7 t -58.62 -23.14 58.34 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 114.055 -1.43 . . . . 0.0 113.401 -172.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -119.74 29.57 7.5 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.373 1.069 . . . . 0.0 112.11 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.9 t -88.16 139.16 30.79 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 172.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -104.31 -51.9 3.02 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.649 1.18 . . . . 0.0 109.92 -175.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.3 t -107.22 119.67 40.03 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 48.8 t -126.81 138.92 53.42 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 125.441 1.497 . . . . 0.0 108.107 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.6 tp -144.29 153.31 41.89 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.7 m -130.41 156.28 45.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.053 0.941 . . . . 0.0 109.666 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -90.31 152.55 20.98 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 123.446 0.467 . . . . 0.0 110.002 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -88.54 15.3 8.21 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.222 1.009 . . . . 0.0 111.887 174.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 m -67.24 172.87 4.3 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.883 0.873 . . . . 0.0 110.545 173.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -125.93 113.14 24.44 Favored Pre-proline 0 CA--C 1.532 0.264 0 C-N-CA 124.018 0.927 . . . . 0.0 109.075 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.03 154.02 93.86 Favored 'Cis proline' 0 CA--C 1.54 0.783 0 CA-C-N 119.56 0.879 . . . . 0.0 110.92 -2.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -84.43 126.38 3.6 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.221 3.281 . . . . 0.0 109.987 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -113.83 158.44 21.02 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.555 1.142 . . . . 0.0 109.237 174.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 98.6 m -113.64 159.53 19.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.871 1.269 . . . . 0.0 110.52 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -156.19 144.8 20.12 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.699 1.2 . . . . 0.0 108.786 -174.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 53.1 t -91.64 122.36 34.14 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.655 -175.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -103.68 5.15 36.14 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.459 1.504 . . . . 0.0 111.286 -174.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -59.93 127.91 34.26 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.669 0.788 . . . . 0.0 109.787 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 35.8 mm -106.72 129.68 59.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 p -142.99 153.83 43.39 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 123.163 0.585 . . . . 0.0 109.648 178.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -62.83 -39.77 95.37 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.154 0.581 . . . . 0.0 110.67 172.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -88.89 -176.65 5.27 Favored 'General case' 0 N--CA 1.458 -0.071 0 C-N-CA 124.36 1.064 . . . . 0.0 110.045 173.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 10.6 t -151.78 153.16 33.73 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.464 0.706 . . . . 0.0 110.112 165.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -73.95 153.32 88.88 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 124.58 1.152 . . . . 0.0 109.464 175.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -72.75 179.9 4.82 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.097 2.531 . . . . 0.0 111.291 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.96 136.63 51.75 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.613 1.165 . . . . 0.0 112.132 -176.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.097 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.78 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.6 p -156.7 166.1 34.36 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.897 0.856 . . . . 0.0 111.932 170.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 t -168.08 156.48 8.9 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.496 1.918 . . . . 0.0 108.122 -176.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -104.22 -68.2 0.86 Allowed 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -84.63 99.23 10.65 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.7 t -117.14 77.49 9.38 Favored Pre-proline 0 CA--C 1.531 0.227 0 C-N-CA 124.233 1.013 . . . . 0.0 111.292 178.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -74.44 159.64 42.88 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.02 1.813 . . . . 0.0 110.242 170.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.5 m -134.39 156.85 47.79 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.669 1.188 . . . . 0.0 108.638 173.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.4 p -77.84 170.13 17.11 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.501 0.721 . . . . 0.0 109.984 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -108.28 10.09 27.8 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.813 1.245 . . . . 0.0 112.309 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.4 p -73.17 179.78 3.7 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.559 1.544 . . . . 0.0 111.868 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 tp -128.4 101.42 21.61 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 125.858 1.663 . . . . 0.0 108.966 -176.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -75.12 155.31 99.83 Favored 'Cis proline' 0 CA--C 1.536 0.61 0 CA-C-N 119.788 0.96 . . . . 0.0 110.492 -2.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -81.64 140.5 11.81 Favored 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 123.245 2.63 . . . . 0.0 109.712 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.46 141.13 40.79 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.27 1.428 . . . . 0.0 108.004 174.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 93.0 m -107.54 144.69 34.18 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.879 1.272 . . . . 0.0 109.333 176.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -144.27 -179.84 6.78 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.641 1.576 . . . . 0.0 108.576 -173.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 8.2 m -135.05 146.58 49.1 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 120.97 0.414 . . . . 0.0 111.352 175.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 80.7 p -121.64 17.51 11.18 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.271 1.428 . . . . 0.0 110.518 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -75.13 150.9 38.64 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.987 0.915 . . . . 0.0 108.98 174.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.8 t -141.46 112.35 3.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 C-N-CA 125.029 1.332 . . . . 0.0 108.536 -170.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.1 mtp-105 -144.07 -153.3 0.46 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.833 0.853 . . . . 0.0 108.8 -171.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -76.2 -131.03 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 169.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -63.7 162.82 12.53 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.46 1.027 . . . . 0.0 112.098 -174.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.7 m -88.11 151.01 23.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.374 1.469 . . . . 0.0 109.347 -172.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.0 p80 -84.03 174.72 10.06 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 121.934 0.873 . . . . 0.0 113.131 -172.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.7 t -59.11 -34.99 72.66 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.568 1.547 . . . . 0.0 112.873 -173.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.59 46.23 0.98 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.122 0.969 . . . . 0.0 110.164 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 11.2 t -144.13 103.3 3.99 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 175.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -102.77 -35.2 8.73 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 125.801 1.64 . . . . 0.0 109.255 -166.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t -102.81 125.33 49.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 170.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 11.0 t -154.87 144.29 21.27 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.57 1.148 . . . . 0.0 107.953 -172.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.5 tp -146.95 141.39 26.43 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -176.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.1 m -113.0 153.94 27.26 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.215 1.006 . . . . 0.0 110.488 -174.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.7 t -89.75 154.76 19.67 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.364 -175.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -90.13 16.33 8.65 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.76 1.224 . . . . 0.0 111.572 174.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 m -75.44 178.47 5.89 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.209 1.004 . . . . 0.0 110.547 174.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -126.88 115.65 22.26 Favored Pre-proline 0 CA--C 1.535 0.388 0 C-N-CA 124.441 1.096 . . . . 0.0 108.47 174.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.0 146.57 87.04 Favored 'Cis proline' 0 N--CA 1.456 -0.708 0 CA-C-N 119.772 0.954 . . . . 0.0 110.509 0.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -76.73 121.53 5.96 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 123.05 2.5 . . . . 0.0 109.485 176.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -120.78 156.89 30.91 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.265 1.426 . . . . 0.0 109.401 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.9 m -108.08 142.48 38.2 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.508 0.723 . . . . 0.0 110.608 -176.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.4 mtm-85 -126.71 131.63 51.32 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 126.782 2.033 . . . . 0.0 106.783 -167.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 5.8 m -76.36 136.1 39.52 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.171 0.441 . . . . 0.0 110.023 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -118.34 15.46 13.91 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.64 1.576 . . . . 0.0 109.866 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -82.01 152.25 26.76 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.529 1.132 . . . . 0.0 111.299 -169.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 45.6 mm -116.5 132.65 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 124.963 1.305 . . . . 0.0 108.202 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.9 p -134.95 177.89 7.45 Favored 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 159.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -78.64 -20.56 50.04 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.974 -0.454 . . . . 0.0 111.145 172.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -123.47 174.36 7.43 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 126.045 1.738 . . . . 0.0 111.721 -169.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 7.6 m -107.55 157.13 18.29 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.314 1.446 . . . . 0.0 110.33 176.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -100.27 156.9 34.73 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 126.67 1.988 . . . . 0.0 108.086 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -69.19 174.33 9.16 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.04 2.493 . . . . 0.0 112.073 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.7 p -63.11 145.14 56.11 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.92 0.888 . . . . 0.0 112.105 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.177 0 C-N-CA 125.115 1.366 . . . . 0.0 111.903 -173.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.258 0 CA-C-O 120.572 0.225 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.9 p -146.25 -179.97 7.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.582 1.153 . . . . 0.0 109.705 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 44.5 t -170.68 156.97 5.48 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.176 1.79 . . . . 0.0 107.2 174.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -105.57 -64.63 1.12 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.379 0.671 . . . . 0.0 109.552 -176.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -101.46 112.1 24.53 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 172.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 9.1 t -130.29 75.75 78.75 Favored Pre-proline 0 CA--C 1.531 0.227 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.84 158.29 53.28 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 122.605 2.203 . . . . 0.0 111.149 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.6 m -136.97 156.95 47.79 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.27 1.028 . . . . 0.0 110.61 -178.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 74.7 p -82.54 159.45 22.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 168.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 -106.65 31.21 5.41 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.506 0.722 . . . . 0.0 109.929 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.8 p -75.21 176.96 6.85 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.034 1.334 . . . . 0.0 110.167 173.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 34.4 mm -125.4 106.41 27.42 Favored Pre-proline 0 CA--C 1.533 0.292 0 C-N-CA 124.525 1.13 . . . . 0.0 108.384 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -72.8 161.38 93.55 Favored 'Cis proline' 0 CA--C 1.539 0.742 0 N-CA-C 109.856 -0.863 . . . . 0.0 109.856 -5.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -74.93 151.6 40.11 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 123.393 2.729 . . . . 0.0 110.418 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -122.32 119.26 30.58 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.941 1.296 . . . . 0.0 108.171 176.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 75.5 m -106.93 141.52 38.02 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.055 1.342 . . . . 0.0 109.492 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.19 162.41 36.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.919 1.288 . . . . 0.0 110.579 -178.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.3 m -104.29 131.28 51.79 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.977 1.311 . . . . 0.0 109.385 -176.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 47.4 p -107.55 -26.36 10.94 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.293 1.037 . . . . 0.0 111.124 -178.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -61.67 144.01 55.22 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.076 0.465 . . . . 0.0 109.82 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.5 t -118.73 142.34 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -158.23 -150.84 0.27 Allowed 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -170.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -74.75 -149.57 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 162.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -64.14 160.19 18.85 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.951 0.881 . . . . 0.0 112.267 -170.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 7.4 p -67.22 162.12 23.32 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.193 1.797 . . . . 0.0 111.626 176.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -82.0 173.11 12.51 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.032 0.933 . . . . 0.0 113.123 -172.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.8 t -57.75 -33.09 68.11 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.551 1.541 . . . . 0.0 112.943 -173.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.57 42.8 1.27 Allowed 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 124.064 0.946 . . . . 0.0 110.574 -177.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.6 t -117.59 128.95 55.45 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.03 0.932 . . . . 0.0 108.936 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.0 tttp -104.78 -47.31 4.08 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 124.064 0.945 . . . . 0.0 110.113 -171.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.0 p -103.61 125.85 50.38 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 125.639 1.576 . . . . 0.0 106.993 172.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 38.5 t -148.95 140.22 23.19 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.474 1.11 . . . . 0.0 108.244 -166.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.88 156.82 46.03 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 124.178 0.991 . . . . 0.0 109.673 -167.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 34.1 m -138.59 161.69 36.45 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.069 0.948 . . . . 0.0 109.815 174.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 44.9 p -87.28 150.78 23.65 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.046 0.938 . . . . 0.0 110.082 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -85.55 10.36 13.34 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.784 0.833 . . . . 0.0 112.411 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.0 p -71.28 176.41 4.59 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.859 1.264 . . . . 0.0 111.145 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -129.68 114.72 18.0 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.625 171.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.09 145.43 82.28 Favored 'Cis proline' 0 CA--C 1.54 0.806 0 CA-C-N 119.596 0.891 . . . . 0.0 110.743 -0.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.33 125.18 8.94 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.372 2.714 . . . . 0.0 109.43 177.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -109.36 143.0 39.49 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.635 1.174 . . . . 0.0 109.269 -178.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 64.1 m -113.5 160.81 18.09 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.043 0.937 . . . . 0.0 111.754 -169.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -159.5 163.68 35.05 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.75 1.22 . . . . 0.0 110.142 -170.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 52.8 t -99.28 142.6 30.56 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.746 1.218 . . . . 0.0 109.441 175.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -111.91 -12.17 13.8 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.441 1.097 . . . . 0.0 111.635 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.31 142.72 54.34 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.335 1.054 . . . . 0.0 112.708 -174.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.0 mm -105.96 133.27 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 125.748 1.619 . . . . 0.0 107.597 -172.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.8 p -131.88 158.23 41.9 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.088 0.47 . . . . 0.0 111.137 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -74.42 -44.08 53.46 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.023 1.329 . . . . 0.0 110.627 172.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -93.06 -167.95 1.83 Allowed 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 124.96 1.304 . . . . 0.0 108.294 170.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 7.8 t -147.61 154.96 41.31 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 157.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -72.27 153.4 92.28 Favored Pre-proline 0 N--CA 1.451 -0.424 0 C-N-CA 124.693 1.197 . . . . 0.0 109.817 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -72.7 174.83 11.14 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.277 2.652 . . . . 0.0 111.472 -176.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.38 132.06 43.38 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.491 1.116 . . . . 0.0 111.88 -176.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.6 t . . . . . 0 N--CA 1.457 -0.092 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.02 177.12 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.198 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.1 p -141.29 -179.59 6.21 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.08 0.952 . . . . 0.0 110.197 -175.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 29.5 t -173.68 150.63 1.75 Allowed 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.459 1.904 . . . . 0.0 106.582 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -106.0 -70.9 0.77 Allowed 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -174.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -85.04 109.33 18.13 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 174.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.4 t -126.2 73.16 72.05 Favored Pre-proline 0 CA--C 1.528 0.134 0 C-N-CA 122.721 0.408 . . . . 0.0 111.453 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -69.27 162.11 43.15 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.284 1.989 . . . . 0.0 110.504 172.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 21.3 m -136.12 158.68 43.83 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.944 0.898 . . . . 0.0 109.803 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.9 p -80.86 163.51 23.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.71 0.804 . . . . 0.0 109.324 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 85.4 mtm180 -108.73 32.26 5.01 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.782 0.833 . . . . 0.0 110.665 175.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 29.9 p -87.6 -177.54 5.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.576 1.151 . . . . 0.0 110.92 179.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.2 tp -127.1 100.6 26.8 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 125.519 1.528 . . . . 0.0 109.568 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.62 159.14 97.93 Favored 'Cis proline' 0 N--CA 1.458 -0.575 0 CA-C-N 119.684 0.923 . . . . 0.0 110.357 -3.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -80.12 147.85 18.86 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.162 2.575 . . . . 0.0 109.775 171.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.64 137.68 52.48 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.342 1.457 . . . . 0.0 107.985 172.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.6 m -108.23 144.77 35.24 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.992 1.317 . . . . 0.0 108.724 173.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -150.63 155.91 40.31 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.989 1.316 . . . . 0.0 108.47 -171.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.8 m -104.63 128.44 52.66 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.344 0.657 . . . . 0.0 109.671 -174.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 46.3 p -108.78 1.86 21.31 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.934 0.894 . . . . 0.0 111.802 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -71.17 154.03 42.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.39 0.614 . . . . 0.0 109.949 170.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.8 t -142.42 131.8 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 125.276 1.43 . . . . 0.0 107.409 -175.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.4 ttp85 -156.43 -145.76 0.16 Allowed 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 -173.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -69.05 -92.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.098 1.759 . . . . 0.0 109.96 -176.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -105.05 168.69 8.89 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.334 1.453 . . . . 0.0 109.136 168.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.2 p -82.51 169.61 16.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.654 1.582 . . . . 0.0 110.804 170.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -84.51 175.17 9.47 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.91 0.884 . . . . 0.0 111.687 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.8 t -61.71 -30.85 71.03 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.684 1.194 . . . . 0.0 112.832 -176.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.79 45.78 0.96 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.048 0.939 . . . . 0.0 110.196 -174.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -130.69 124.31 31.28 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.134 1.374 . . . . 0.0 108.844 170.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -106.27 -32.06 8.35 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 125.943 1.697 . . . . 0.0 110.133 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.1 p -99.55 57.61 1.03 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.283 1.433 . . . . 0.0 107.843 -175.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.3 t -106.97 131.49 53.98 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.1 -1.864 . . . . 0.0 108.717 -172.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.3 tp -155.48 141.92 18.64 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -172.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 m -120.08 151.57 38.84 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.251 1.02 . . . . 0.0 110.472 -173.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -85.19 154.18 22.16 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 -176.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.7 mtm105 -91.59 11.83 22.97 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.449 1.1 . . . . 0.0 111.498 176.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -72.5 178.94 3.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.586 1.154 . . . . 0.0 109.919 175.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -123.99 118.71 26.8 Favored Pre-proline 0 CA--C 1.532 0.27 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -75.03 143.58 78.24 Favored 'Cis proline' 0 CA--C 1.539 0.739 0 CA-C-N 119.664 0.916 . . . . 0.0 110.932 2.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -77.09 106.45 2.25 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.453 2.768 . . . . 0.0 109.122 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -110.74 150.42 29.1 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.926 1.29 . . . . 0.0 109.758 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -108.83 147.76 31.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.92 167.32 17.57 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.334 1.854 . . . . 0.0 109.13 -178.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 44.7 t -135.84 135.37 39.75 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.506 1.122 . . . . 0.0 110.449 174.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -112.97 42.25 1.92 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.621 1.568 . . . . 0.0 110.624 -173.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -62.75 158.24 19.14 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -174.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 30.3 mm -133.65 104.05 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 176.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.5 p -138.23 152.13 48.3 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.082 0.553 . . . . 0.0 109.879 175.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -66.65 -41.11 88.73 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.934 0.494 . . . . 0.0 110.242 172.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -88.8 -173.46 4.12 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.532 1.133 . . . . 0.0 109.447 172.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 6.6 t -156.58 159.65 38.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.768 0.827 . . . . 0.0 109.468 165.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -74.85 148.81 85.16 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 123.61 0.764 . . . . 0.0 109.527 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.28 171.32 16.29 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.133 2.556 . . . . 0.0 111.229 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.26 131.86 46.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.467 1.107 . . . . 0.0 111.737 -177.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.53 0.21 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.108 174.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.147 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.2 p -135.12 -176.21 4.18 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.09 0.956 . . . . 0.0 110.542 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 39.1 t -166.33 167.07 16.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.37 1.868 . . . . 0.0 107.313 175.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -113.98 -66.24 1.11 Allowed 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 168.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -80.33 110.42 15.76 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.292 1.037 . . . . 0.0 109.959 178.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.1 m -117.35 69.74 5.79 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 124.869 1.267 . . . . 0.0 111.055 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -76.81 162.4 32.5 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.083 1.856 . . . . 0.0 110.634 171.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 43.8 t -154.28 157.58 38.89 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.113 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.4 p -90.37 157.0 17.84 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.221 1.009 . . . . 0.0 109.066 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.9 mtm105 -106.88 42.59 1.27 Allowed 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.913 0.885 . . . . 0.0 109.823 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 p -96.6 179.77 4.88 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 126.066 1.746 . . . . 0.0 110.153 177.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -131.58 101.68 15.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 124.927 1.291 . . . . 0.0 107.989 -178.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -71.82 156.96 97.34 Favored 'Cis proline' 0 CA--C 1.537 0.642 0 CA-C-N 119.407 0.824 . . . . 0.0 110.615 -1.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -74.66 141.92 28.35 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 123.476 2.784 . . . . 0.0 110.542 174.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -104.77 109.6 21.61 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 171.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 68.4 m -107.21 148.1 29.33 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 125.009 1.324 . . . . 0.0 109.297 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -153.55 163.0 40.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.484 -167.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.1 t -107.77 128.46 54.6 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.651 1.18 . . . . 0.0 108.537 174.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 77.2 p -122.56 6.96 9.48 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.426 0.691 . . . . 0.0 112.385 -172.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -67.05 143.31 56.8 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 119.029 0.831 . . . . 0.0 111.345 179.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.9 t -108.69 126.35 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 125.947 1.699 . . . . 0.0 106.733 -178.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -165.8 -160.52 0.45 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -166.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -72.53 -153.07 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.594 0.758 . . . . 0.0 109.017 168.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -58.85 151.2 22.07 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.514 0.674 . . . . 0.0 112.051 -169.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 p -71.92 148.91 45.59 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.228 1.411 . . . . 0.0 111.037 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.2 p80 -75.02 170.75 15.39 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.459 -0.791 . . . . 0.0 113.097 -169.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.5 t -60.45 -31.83 70.81 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.774 1.23 . . . . 0.0 112.355 -174.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.39 36.59 2.55 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.993 0.917 . . . . 0.0 111.118 -177.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 48.7 t -114.56 136.2 53.29 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 125.409 1.483 . . . . 0.0 107.832 174.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -105.84 -54.91 2.4 Favored 'General case' 0 CA--C 1.522 -0.097 0 C-N-CA 124.116 0.966 . . . . 0.0 109.684 -168.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.3 t -105.35 137.1 43.69 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 107.381 -1.341 . . . . 0.0 107.381 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.6 t -154.42 143.71 21.29 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.167 0.987 . . . . 0.0 109.164 -168.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 64.6 tp -152.41 151.75 31.18 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 124.458 1.103 . . . . 0.0 108.874 -175.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.2 m -130.28 163.95 25.65 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.874 0.87 . . . . 0.0 110.866 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.8 p -84.25 156.99 21.73 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.84 0.856 . . . . 0.0 110.39 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.5 ptt180 -93.46 12.82 23.69 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.342 1.057 . . . . 0.0 111.753 174.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.3 p -77.35 -179.96 6.05 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 124.467 1.107 . . . . 0.0 111.687 -177.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -130.24 106.71 16.21 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.784 1.234 . . . . 0.0 108.391 174.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.66 152.84 96.76 Favored 'Cis proline' 0 N--CA 1.456 -0.7 0 CA-C-N 119.513 0.862 . . . . 0.0 110.862 1.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.16 153.83 46.45 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.184 2.589 . . . . 0.0 108.713 170.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -148.58 135.81 20.24 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -174.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 74.8 m -107.3 157.45 17.92 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.067 0.947 . . . . 0.0 111.32 -168.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 19.8 ttp-105 -154.23 153.13 31.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.916 1.286 . . . . 0.0 108.879 -171.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.7 m -89.43 152.41 21.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.584 1.154 . . . . 0.0 110.754 173.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -130.41 21.93 5.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.109 1.764 . . . . 0.0 109.384 170.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -67.48 124.75 24.06 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.022 1.329 . . . . 0.0 109.796 -177.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 32.3 mm -107.84 122.05 61.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.9 p -139.41 179.46 6.53 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.264 1.426 . . . . 0.0 108.662 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -78.57 -9.64 59.43 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.967 -0.458 . . . . 0.0 111.431 172.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -138.02 -170.22 2.74 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.94 1.696 . . . . 0.0 110.34 -170.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 35.4 t -154.51 153.11 30.94 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.353 1.461 . . . . 0.0 108.506 171.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -78.9 151.59 76.5 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.975 0.91 . . . . 0.0 110.44 -176.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -70.13 173.47 11.25 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.053 2.502 . . . . 0.0 112.062 -173.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.1 p -59.28 133.59 56.24 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.115 0.966 . . . . 0.0 112.413 -174.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.239 0 CA-C-N 114.341 -1.299 . . . . 0.0 110.903 178.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.162 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.0 p -149.65 -171.34 3.87 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 123.779 0.831 . . . . 0.0 110.07 -170.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 t -169.96 -177.34 2.57 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.101 1.76 . . . . 0.0 106.906 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -108.42 -52.65 2.74 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 171.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -147.89 146.64 29.13 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.302 1.041 . . . . 0.0 108.601 162.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -136.03 96.34 12.98 Favored Pre-proline 0 N--CA 1.448 -0.541 0 C-N-CA 124.916 1.286 . . . . 0.0 111.139 -175.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.01 166.68 28.68 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.578 2.185 . . . . 0.0 110.819 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.4 m -128.71 153.44 47.33 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.213 1.005 . . . . 0.0 110.215 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.4 p -84.31 158.78 21.08 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.834 1.653 . . . . 0.0 108.998 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 42.1 mtm105 -106.13 36.71 2.48 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.083 0.953 . . . . 0.0 109.825 -177.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -90.83 178.04 6.15 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.786 1.634 . . . . 0.0 110.124 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.9 tp -131.18 98.68 18.46 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 125.481 1.513 . . . . 0.0 108.849 -175.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -73.95 154.96 99.87 Favored 'Cis proline' 0 CA--C 1.536 0.622 0 CA-C-N 119.693 0.926 . . . . 0.0 111.126 0.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -78.82 140.25 16.17 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 123.54 2.826 . . . . 0.0 109.924 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -107.24 159.15 16.56 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.696 1.198 . . . . 0.0 108.833 173.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 72.8 m -132.12 142.53 49.53 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.9 1.28 . . . . 0.0 109.132 179.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -143.8 174.25 10.98 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.211 1.004 . . . . 0.0 108.605 -173.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.1 m -102.68 150.89 22.99 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 174.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.6 t -104.68 -9.52 18.14 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.366 163.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -55.92 149.7 14.64 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.986 1.314 . . . . 0.0 112.313 173.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.6 t -144.23 147.15 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 127.763 2.425 . . . . 0.0 105.914 174.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -155.19 -152.41 0.4 Allowed 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 -173.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -78.9 -116.3 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 155.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -68.53 158.27 34.22 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.894 1.225 . . . . 0.0 111.855 -178.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 4.1 p -82.59 163.3 21.55 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.49 1.916 . . . . 0.0 110.754 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.406 ' HD1' ' H ' ' A' ' 34' ' ' ALA . 33.5 p80 -71.22 168.05 18.1 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -167.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.4 t -52.02 -37.85 54.87 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.871 1.668 . . . . 0.0 112.634 -173.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.406 ' H ' ' HD1' ' A' ' 32' ' ' HIS . . . -107.35 24.77 12.34 Favored 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 124.367 1.067 . . . . 0.0 112.513 -175.357 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.9 t -91.21 127.46 36.65 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 175.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 tttp -104.85 -45.25 4.62 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.573 0.749 . . . . 0.0 110.452 -172.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.5 t -104.67 129.55 52.82 Favored 'General case' 0 CA--C 1.523 -0.085 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 172.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.6 t -150.38 140.66 22.26 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.006 0.922 . . . . 0.0 108.634 -168.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 22.4 tp -153.38 158.97 42.27 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.875 0.87 . . . . 0.0 109.436 -169.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 24.6 m -123.74 165.98 16.35 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.344 0.657 . . . . 0.0 111.102 -175.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -93.18 150.67 20.33 Favored 'General case' 0 C--N 1.341 0.221 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 169.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -91.69 15.24 13.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.54 1.136 . . . . 0.0 111.922 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -67.2 172.36 4.79 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 123.86 0.864 . . . . 0.0 110.593 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -121.07 110.32 34.75 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 172.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -74.21 152.7 98.56 Favored 'Cis proline' 0 CA--C 1.54 0.816 0 CA-C-N 119.592 0.89 . . . . 0.0 110.775 -0.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -82.01 131.76 7.07 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 124.148 3.232 . . . . 0.0 109.942 173.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -113.4 152.01 30.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.611 1.565 . . . . 0.0 108.063 174.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 92.1 m -113.53 154.4 27.17 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.606 0.762 . . . . 0.0 110.931 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.4 mtm105 -147.79 147.26 29.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.305 1.042 . . . . 0.0 109.448 -155.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 43.2 t -84.67 136.72 33.62 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 172.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -106.62 -23.59 12.4 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.109 1.364 . . . . 0.0 110.585 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -47.66 143.69 3.69 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 126.045 1.738 . . . . 0.0 113.26 -172.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.0 mm -106.37 127.92 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 C-N-CA 125.122 1.369 . . . . 0.0 107.327 -176.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.1 p -126.99 173.1 9.91 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.538 0.735 . . . . 0.0 109.476 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -88.99 -9.6 50.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.633 0.773 . . . . 0.0 111.328 174.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -133.75 173.28 11.7 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 125.43 1.492 . . . . 0.0 110.95 -174.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.1 t -110.12 137.06 48.38 Favored 'General case' 0 N--CA 1.458 -0.07 0 C-N-CA 125.853 1.661 . . . . 0.0 108.86 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -75.29 157.97 84.31 Favored Pre-proline 0 N--CA 1.449 -0.49 0 C-N-CA 126.635 1.974 . . . . 0.0 109.881 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -67.59 158.11 58.67 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 122.071 1.847 . . . . 0.0 109.817 170.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.0 p -67.41 149.27 50.49 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 120.937 0.399 . . . . 0.0 111.21 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.266 0 C-N-CA 124.548 1.139 . . . . 0.0 110.6 -178.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.275 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.7 p -143.63 164.86 29.21 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.439 0.638 . . . . 0.0 112.001 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 53.3 t -174.32 143.53 0.87 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.869 -166.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -104.8 -65.99 1.0 Allowed 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.743 0.817 . . . . 0.0 108.915 -174.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -85.81 107.79 17.81 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 26.5 p -124.26 61.11 25.83 Favored Pre-proline 0 CA--C 1.535 0.396 0 C-N-CA 124.914 1.286 . . . . 0.0 111.292 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -71.56 159.73 50.39 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.561 2.174 . . . . 0.0 111.042 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 24.9 m -129.19 157.4 41.92 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.035 0.934 . . . . 0.0 110.263 178.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.6 p -73.82 173.03 10.46 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.488 0.715 . . . . 0.0 110.289 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -106.05 10.67 32.09 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.663 1.185 . . . . 0.0 111.61 176.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 p -73.58 172.72 10.84 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 124.264 1.026 . . . . 0.0 111.681 179.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.8 tp -128.79 100.09 21.87 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 126.012 1.725 . . . . 0.0 108.727 -177.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.92 158.48 96.35 Favored 'Cis proline' 0 CA--C 1.534 0.51 0 CA-C-N 119.68 0.921 . . . . 0.0 111.616 0.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.79 145.99 14.6 Favored 'Trans proline' 0 N--CA 1.451 -0.978 0 C-N-CA 123.305 2.67 . . . . 0.0 110.236 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -113.71 131.54 56.14 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.029 1.731 . . . . 0.0 106.739 175.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 88.7 m -105.5 144.2 32.6 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 123.724 0.81 . . . . 0.0 108.866 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -143.58 159.71 41.95 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.137 0.975 . . . . 0.0 108.763 -171.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 18.2 m -107.35 121.24 44.17 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.671 0.788 . . . . 0.0 109.317 178.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 70.8 p -107.9 22.85 15.36 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.419 1.087 . . . . 0.0 109.948 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -76.13 148.61 37.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 170.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.2 t -143.1 127.4 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 125.102 1.361 . . . . 0.0 107.787 -173.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -165.25 -156.06 0.27 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.227 0.611 . . . . 0.0 109.48 -173.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -57.69 -81.01 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.109 0.964 . . . . 0.0 110.664 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -116.12 169.86 8.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.297 1.439 . . . . 0.0 111.712 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 p -96.54 159.31 15.0 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.838 2.055 . . . . 0.0 111.424 177.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -88.47 172.29 9.46 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.021 0.928 . . . . 0.0 113.47 -170.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.4 t -51.93 -39.51 59.29 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.975 1.71 . . . . 0.0 112.797 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.81 42.79 1.34 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.176 0.991 . . . . 0.0 110.871 -174.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 51.1 t -123.26 119.8 31.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 173.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -102.51 -40.76 6.53 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.837 1.255 . . . . 0.0 110.188 -165.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.9 t -104.11 118.72 37.33 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 170.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.3 t -144.98 133.06 21.42 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.903 1.681 . . . . 0.0 107.322 -175.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.2 tt -153.68 140.44 19.05 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -172.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.4 m -118.87 159.67 23.33 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.437 1.095 . . . . 0.0 111.311 -169.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.6 t -78.83 148.15 32.97 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 29.6 ptt-85 -93.81 41.06 1.08 Allowed 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.881 1.272 . . . . 0.0 110.447 -175.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 t -163.23 -160.8 0.63 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.334 0.654 . . . . 0.0 110.056 -174.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -107.79 131.62 21.6 Favored Pre-proline 0 N--CA 1.442 -0.867 0 C-N-CA 127.124 2.169 . . . . 0.0 108.648 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -73.53 145.96 85.55 Favored 'Cis proline' 0 N--CA 1.456 -0.71 0 N-CA-C 109.283 -1.084 . . . . 0.0 109.283 -4.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -77.71 84.36 1.99 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.115 2.543 . . . . 0.0 108.953 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -107.2 145.99 31.94 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.485 1.514 . . . . 0.0 108.547 -177.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -116.13 148.19 40.57 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.422 0.629 . . . . 0.0 112.486 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 27.8 mtm-85 -119.67 156.64 30.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.956 1.702 . . . . 0.0 109.16 -175.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 1.7 m -100.11 160.23 14.48 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.989 0.916 . . . . 0.0 109.328 165.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -154.04 27.53 0.47 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.292 1.037 . . . . 0.0 109.688 175.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -73.26 153.07 40.76 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 123.813 0.845 . . . . 0.0 110.544 -176.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.0 mm -106.47 132.48 53.57 Favored 'Isoleucine or valine' 0 C--N 1.34 0.18 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -176.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 56.4 p -144.1 -165.19 2.06 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.443 1.497 . . . . 0.0 108.238 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -134.87 18.58 3.5 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.245 1.018 . . . . 0.0 110.609 172.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -156.5 178.61 10.12 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.365 1.466 . . . . 0.0 110.215 -173.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.0 t -111.21 148.2 33.33 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.843 1.257 . . . . 0.0 109.97 178.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -97.75 151.99 37.88 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.394 1.478 . . . . 0.0 108.79 172.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -64.59 163.67 26.47 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.222 2.615 . . . . 0.0 111.714 -176.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.2 p -57.33 139.14 53.77 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.038 0.935 . . . . 0.0 112.555 -175.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.462 0.136 0 C-N-CA 124.453 1.101 . . . . 0.0 112.085 -173.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 119.759 -0.162 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.3 p -149.21 173.15 13.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.679 0.752 . . . . 0.0 111.768 -175.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 t -170.23 152.41 4.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 126.323 1.849 . . . . 0.0 108.219 -174.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -105.14 -66.86 0.95 Allowed 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 -177.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -93.19 104.24 16.44 Favored 'General case' 0 C--N 1.344 0.337 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 21.4 p -119.93 64.32 9.26 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 126.916 2.086 . . . . 0.0 110.764 -174.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -67.3 156.65 65.32 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.517 2.144 . . . . 0.0 111.817 -177.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 63.4 m -130.33 159.32 37.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.471 1.108 . . . . 0.0 109.99 178.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 81.9 p -89.27 172.17 9.24 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.421 1.489 . . . . 0.0 110.245 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 33.0 ptt-85 -107.47 -1.59 21.26 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.132 1.373 . . . . 0.0 112.436 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.7 p -71.36 179.37 2.96 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.516 1.526 . . . . 0.0 111.315 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.0 mm -128.46 117.57 20.01 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 124.973 1.309 . . . . 0.0 108.548 -177.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -69.91 146.57 82.88 Favored 'Cis proline' 0 N--CA 1.456 -0.689 0 N-CA-C 109.525 -0.991 . . . . 0.0 109.525 -5.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -72.16 125.97 11.33 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.703 2.269 . . . . 0.0 109.024 178.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.33 151.36 24.26 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.233 1.013 . . . . 0.0 109.224 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.7 m -127.66 145.84 50.75 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.466 1.507 . . . . 0.0 109.809 -177.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -150.52 163.96 37.16 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.545 1.538 . . . . 0.0 108.287 -171.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 68.7 m -107.68 141.68 38.82 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.548 0.739 . . . . 0.0 110.097 171.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.0 t -107.53 -12.03 15.36 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.462 -172.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.67 146.91 51.03 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.812 0.845 . . . . 0.0 110.452 -176.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 85.0 t -110.35 126.04 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 174.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.75 -166.25 2.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.922 0.889 . . . . 0.0 111.515 -171.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -71.69 -136.94 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 165.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -63.03 157.17 22.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 120.633 -1.292 . . . . 0.0 112.347 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.1 m -75.45 166.55 23.42 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.147 175.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -88.3 171.18 10.36 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.704 0.802 . . . . 0.0 112.916 -173.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.6 t -63.52 -24.39 67.8 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.073 1.349 . . . . 0.0 113.102 -175.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -103.7 34.59 2.93 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.225 1.01 . . . . 0.0 110.781 178.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.8 t -119.59 126.59 51.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.563 1.145 . . . . 0.0 108.309 175.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -105.84 -38.93 6.2 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.753 1.221 . . . . 0.0 109.923 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.1 t -106.38 113.82 27.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 174.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.8 t -128.9 137.96 51.73 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 126.293 1.837 . . . . 0.0 107.249 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -143.02 152.16 41.61 Favored 'General case' 0 N--CA 1.46 0.069 0 C-N-CA 124.328 1.051 . . . . 0.0 108.634 -174.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.8 m -137.75 157.08 47.2 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.802 0.841 . . . . 0.0 110.459 -173.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.8 t -91.87 151.87 20.35 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 123.406 0.441 . . . . 0.0 109.886 178.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.4 ptt-85 -97.32 19.04 13.81 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.709 1.204 . . . . 0.0 111.557 177.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -69.05 178.33 2.3 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 124.275 1.03 . . . . 0.0 110.563 170.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -123.56 117.09 27.82 Favored Pre-proline 0 CA--C 1.533 0.313 0 C-N-CA 124.071 0.948 . . . . 0.0 109.222 175.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -71.78 151.12 95.28 Favored 'Cis proline' 0 CA--C 1.54 0.804 0 CA-C-N 119.587 0.888 . . . . 0.0 110.287 -5.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -83.29 127.11 4.43 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.95 3.1 . . . . 0.0 110.244 175.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -115.95 161.48 18.77 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.761 1.224 . . . . 0.0 108.93 174.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 99.5 m -112.56 169.52 8.83 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.46 1.104 . . . . 0.0 110.618 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.1 ttp85 -159.53 146.83 16.91 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.192 1.397 . . . . 0.0 108.54 -174.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 49.9 t -89.97 124.0 34.36 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.742 0.817 . . . . 0.0 109.25 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.67 10.37 29.0 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.903 1.681 . . . . 0.0 110.571 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -67.72 145.63 54.57 Favored 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.707 -0.62 . . . . 0.0 110.635 -175.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 49.0 mm -107.45 133.85 50.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 124.497 1.119 . . . . 0.0 108.97 -169.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.2 p -141.99 -178.14 5.55 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.722 1.209 . . . . 0.0 109.551 -177.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -107.86 -5.33 17.29 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.95 1.3 . . . . 0.0 110.985 169.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -133.42 -173.19 3.15 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.982 1.713 . . . . 0.0 110.364 -168.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.7 t -121.33 146.3 47.0 Favored 'General case' 0 CA--C 1.527 0.061 0 C-N-CA 125.628 1.571 . . . . 0.0 109.207 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -78.57 160.58 72.08 Favored Pre-proline 0 N--CA 1.452 -0.349 0 C-N-CA 124.476 1.11 . . . . 0.0 108.953 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -60.0 159.7 24.76 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.392 2.061 . . . . 0.0 110.651 174.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.3 p -62.44 138.18 58.41 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 122.796 0.438 . . . . 0.0 111.017 -177.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.131 0 C-N-CA 124.529 1.131 . . . . 0.0 109.592 177.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.386 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.7 p -140.26 -170.39 2.97 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.459 1.104 . . . . 0.0 109.219 -170.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.1 t -173.58 170.99 3.97 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.387 1.875 . . . . 0.0 106.434 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -108.22 -60.74 1.68 Allowed 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 166.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -119.2 109.74 16.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.265 1.026 . . . . 0.0 109.046 -177.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.86 89.21 47.96 Favored Pre-proline 0 N--CA 1.452 -0.366 0 C-N-CA 124.596 1.158 . . . . 0.0 111.979 176.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.31 171.57 14.81 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.122 1.881 . . . . 0.0 110.859 169.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.8 m -133.17 156.54 47.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.379 1.072 . . . . 0.0 109.692 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 36.8 p -88.08 162.94 16.5 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.742 1.217 . . . . 0.0 109.611 178.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -106.47 35.24 3.03 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.31 1.044 . . . . 0.0 110.045 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 p -90.21 179.27 5.95 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.592 1.557 . . . . 0.0 110.327 175.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.37 106.21 17.55 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.954 1.302 . . . . 0.0 108.33 -178.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.37 156.78 96.62 Favored 'Cis proline' 0 CA--C 1.535 0.531 0 CA-C-N 119.618 0.899 . . . . 0.0 109.835 -4.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.05 139.95 19.64 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.657 2.238 . . . . 0.0 110.072 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -107.78 132.9 52.9 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.817 1.247 . . . . 0.0 108.107 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 79.2 m -108.07 143.97 36.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.452 1.101 . . . . 0.0 109.423 172.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -157.01 170.22 23.04 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.006 0.922 . . . . 0.0 109.365 -173.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 89.3 m -104.27 143.96 32.26 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.694 0.798 . . . . 0.0 109.877 -177.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 11.3 t -115.32 -16.69 11.44 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.682 1.193 . . . . 0.0 111.212 177.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.08 155.45 31.33 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 121.289 0.566 . . . . 0.0 111.158 -178.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.7 t -122.64 143.03 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 125.994 1.717 . . . . 0.0 107.92 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.6 tpp180 -161.67 -145.2 0.11 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.958 1.303 . . . . 0.0 107.902 -174.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -91.79 -130.84 0.11 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 125.021 1.329 . . . . 0.0 108.301 167.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -65.63 171.85 3.85 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.594 1.158 . . . . 0.0 114.086 -165.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -71.18 151.1 44.7 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.01 1.324 . . . . 0.0 109.69 179.38 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.3 p80 -81.9 -178.84 7.16 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 121.495 0.664 . . . . 0.0 112.073 173.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 t -78.44 23.95 0.29 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.311 1.045 . . . . 0.0 113.167 -172.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -160.38 69.35 0.38 Allowed 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.599 0.636 . . . . 0.0 109.866 172.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 94.1 m -124.89 124.77 42.78 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.852 0.861 . . . . 0.0 110.044 -176.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 tmtp? -105.7 -30.68 9.3 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.882 1.673 . . . . 0.0 108.75 176.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.4 t -118.86 131.46 56.07 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.438 1.495 . . . . 0.0 108.279 169.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.3 t -154.99 143.52 20.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.078 1.351 . . . . 0.0 108.376 177.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.1 tp -152.47 170.21 20.69 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 122.986 0.515 . . . . 0.0 110.069 -172.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 65.4 m -134.37 163.76 28.95 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.128 0.971 . . . . 0.0 110.598 172.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.8 p -79.68 148.94 31.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.12 0.968 . . . . 0.0 110.186 178.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.3 ptt85 -98.32 52.44 1.03 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.234 1.414 . . . . 0.0 109.122 176.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.3 t -153.39 -163.93 1.79 Allowed 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.448 1.099 . . . . 0.0 109.476 177.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -129.63 129.49 23.15 Favored Pre-proline 0 CA--C 1.533 0.312 0 C-N-CA 125.416 1.486 . . . . 0.0 108.73 -178.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -70.87 147.8 87.82 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 CA-C-N 119.682 0.922 . . . . 0.0 110.592 -0.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -74.45 98.91 1.16 Allowed 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 123.502 2.801 . . . . 0.0 108.721 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -106.55 140.73 38.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.184 1.394 . . . . 0.0 108.49 -173.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 79.1 m -126.11 153.79 44.03 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.472 0.709 . . . . 0.0 111.024 -168.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.73 162.14 36.24 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.419 1.088 . . . . 0.0 110.544 -176.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.9 t -118.68 126.4 51.84 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 125.389 1.475 . . . . 0.0 107.491 172.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -119.78 37.92 4.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.41 1.084 . . . . 0.0 110.194 -168.282 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -62.59 152.12 35.94 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.735 1.214 . . . . 0.0 112.07 -174.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 46.4 mm -108.05 101.96 13.29 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 C-N-CA 124.414 1.086 . . . . 0.0 108.233 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.3 p -113.45 -175.93 2.78 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.893 1.277 . . . . 0.0 108.63 171.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -110.49 11.3 23.11 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.937 0.895 . . . . 0.0 110.631 173.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -148.56 170.1 18.82 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.882 1.673 . . . . 0.0 110.244 -174.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 19.8 t -118.75 138.72 52.47 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 126.003 1.721 . . . . 0.0 108.556 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -82.73 154.94 68.39 Favored Pre-proline 0 N--CA 1.45 -0.466 0 C-N-CA 125.576 1.55 . . . . 0.0 109.79 -177.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -67.13 163.91 32.28 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.622 2.214 . . . . 0.0 110.473 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.3 133.25 53.86 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.413 0.685 . . . . 0.0 112.129 -172.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.534 0.345 0 C-N-CA 124.714 1.206 . . . . 0.0 110.425 176.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 40.3 p . . . . . 0 N--CA 1.473 0.712 0 CA-C-O 119.565 -0.255 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -159.37 -58.16 0.06 Allowed 'General case' 0 C--N 1.342 0.244 0 C-N-CA 123.515 0.726 . . . . 0.0 109.894 176.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p -161.63 -174.45 4.23 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.571 1.148 . . . . 0.0 109.269 -178.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.4 t -154.94 -170.8 3.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.129 0.971 . . . . 0.0 109.981 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.6 p -80.86 79.02 7.59 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.395 1.478 . . . . 0.0 109.954 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 67.8 p -74.86 -177.93 3.5 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.046 1.338 . . . . 0.0 111.418 177.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.34 110.52 1.45 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.987 0.915 . . . . 0.0 109.866 175.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.8 p -122.49 -168.75 1.78 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.425 1.49 . . . . 0.0 109.832 -172.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.1 t -165.99 179.22 5.95 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 170.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -132.71 -74.94 0.5 Allowed 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 170.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -90.33 115.75 27.76 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 171.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 30.0 p -119.96 72.52 17.39 Favored Pre-proline 0 CA--C 1.532 0.285 0 C-N-CA 123.571 0.748 . . . . 0.0 112.277 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -75.55 161.3 37.35 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.638 2.225 . . . . 0.0 110.758 176.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.0 m -139.27 158.48 44.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.206 1.002 . . . . 0.0 110.694 -179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.7 p -77.88 157.06 29.99 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 169.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -106.89 36.47 2.65 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.76 0.824 . . . . 0.0 109.604 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.2 p -86.52 179.46 6.83 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.924 1.69 . . . . 0.0 110.328 175.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -126.16 104.74 25.58 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 125.28 1.432 . . . . 0.0 107.888 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.34 159.06 97.95 Favored 'Cis proline' 0 CA--C 1.536 0.593 0 CA-C-N 119.619 0.9 . . . . 0.0 110.297 -3.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -75.73 142.12 25.36 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.272 2.648 . . . . 0.0 109.885 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.87 126.98 55.69 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.57 1.148 . . . . 0.0 107.976 171.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.3 m -104.82 151.3 23.96 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.668 1.187 . . . . 0.0 109.339 175.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -141.86 -179.58 6.29 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 123.997 0.919 . . . . 0.0 109.866 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 93.3 m -110.83 141.61 43.96 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 167.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.7 p -117.64 34.28 5.22 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 166.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -81.66 149.77 28.38 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.526 0.679 . . . . 0.0 110.259 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 62.6 t -142.7 122.13 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 C-N-CA 126.004 1.722 . . . . 0.0 106.415 -177.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -162.91 -150.25 0.16 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -166.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -68.72 -142.96 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 162.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -67.48 158.37 32.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 120.876 -1.14 . . . . 0.0 111.827 -174.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.6 p -74.12 159.2 32.93 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.569 1.548 . . . . 0.0 111.643 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -80.62 177.37 9.06 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -169.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.5 t -78.48 21.59 0.37 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.5 -1.227 . . . . 0.0 113.054 -172.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -155.3 64.34 0.62 Allowed 'General case' 0 C--N 1.341 0.236 0 CA-C-N 118.741 0.7 . . . . 0.0 109.797 173.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 76.5 m -123.79 127.93 48.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.868 0.867 . . . . 0.0 109.327 179.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -102.86 -36.52 8.21 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.769 1.628 . . . . 0.0 107.806 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -106.03 114.87 29.28 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 162.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 24.9 t -134.17 132.64 40.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.622 1.569 . . . . 0.0 107.445 169.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.2 tp -157.34 157.3 33.87 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.6 m -122.22 166.17 15.03 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.827 0.851 . . . . 0.0 110.352 -174.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.7 t -89.73 150.25 22.38 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 168.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -82.88 0.93 41.91 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.149 1.38 . . . . 0.0 112.403 177.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 m -69.33 -178.09 1.28 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.036 1.334 . . . . 0.0 111.512 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -120.3 111.05 35.41 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.727 1.211 . . . . 0.0 108.163 175.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -74.36 149.86 94.62 Favored 'Cis proline' 0 N--CA 1.458 -0.611 0 CA-C-N 119.972 1.026 . . . . 0.0 110.611 0.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -75.94 108.58 2.71 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.754 2.303 . . . . 0.0 108.338 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -104.4 140.17 38.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -177.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 65.8 m -107.07 151.04 25.89 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 123.843 0.857 . . . . 0.0 109.701 -172.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.0 mtm105 -144.86 143.27 30.52 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.528 -1.215 . . . . 0.0 108.668 -156.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 46.5 t -112.05 131.92 55.13 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 124.072 0.949 . . . . 0.0 109.014 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -127.43 37.35 4.25 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.286 1.434 . . . . 0.0 109.942 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -56.33 154.99 7.41 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.242 1.017 . . . . 0.0 111.628 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.7 mm -115.25 111.72 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 171.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.3 p -130.5 163.53 26.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.933 1.293 . . . . 0.0 108.135 173.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -70.02 -21.27 63.22 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.895 -0.503 . . . . 0.0 111.54 174.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -130.55 -179.29 5.19 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.898 1.279 . . . . 0.0 111.911 -165.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.8 t -112.78 147.88 35.97 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.642 1.977 . . . . 0.0 109.992 177.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -97.58 159.37 31.23 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 125.914 1.686 . . . . 0.0 109.566 176.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.2 164.5 22.47 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.284 2.656 . . . . 0.0 112.266 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.22 141.61 58.7 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.469 1.107 . . . . 0.0 112.178 -174.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -93.04 -177.03 4.36 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.55 1.14 . . . . 0.0 111.81 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 C--O 1.251 1.142 0 C-N-CA 125.28 1.432 . . . . 0.0 107.863 166.099 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 45.8 p . . . . . 0 N--CA 1.474 0.728 0 N-CA-C 111.283 0.105 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -80.01 168.43 19.2 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.258 0.623 . . . . 0.0 109.667 169.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.8 t -66.62 111.48 3.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.397 0.679 . . . . 0.0 109.957 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.8 t -154.67 146.72 23.63 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.241 1.017 . . . . 0.0 108.934 176.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 11.1 t -155.06 44.68 0.49 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.596 0.759 . . . . 0.0 109.816 -179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 38.8 p -61.87 159.91 13.06 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.157 0.983 . . . . 0.0 110.904 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.37 95.89 0.33 Allowed 'General case' 0 C--N 1.341 0.225 0 C-N-CA 122.793 0.437 . . . . 0.0 111.371 -174.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.4 p -127.46 -175.77 3.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.436 1.494 . . . . 0.0 109.785 -176.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 46.4 t -172.0 160.55 5.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.642 1.977 . . . . 0.0 107.329 171.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -108.44 -77.01 0.6 Allowed 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 171.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -88.52 111.49 21.9 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.8 p -118.14 67.08 6.34 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 124.749 1.22 . . . . 0.0 111.377 -177.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.93 145.67 56.85 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.624 2.216 . . . . 0.0 110.453 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.1 m -132.46 159.06 40.43 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.049 0.94 . . . . 0.0 110.933 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.0 p -90.04 157.85 17.61 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.648 1.179 . . . . 0.0 108.932 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.5 mtm105 -108.47 35.92 3.01 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.914 0.886 . . . . 0.0 109.515 176.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 76.1 p -89.15 -176.67 5.2 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.902 1.281 . . . . 0.0 110.264 175.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.5 mm -129.71 113.08 17.72 Favored Pre-proline 0 CA--C 1.536 0.41 0 C-N-CA 124.75 1.22 . . . . 0.0 108.842 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.44 151.63 90.79 Favored 'Cis proline' 0 CA--C 1.538 0.679 0 N-CA-C 109.131 -1.142 . . . . 0.0 109.131 -9.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -75.25 132.54 15.21 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.209 2.606 . . . . 0.0 109.417 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.9 137.17 43.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 173.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 54.0 m -107.74 149.85 27.67 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.227 1.411 . . . . 0.0 108.744 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -135.71 172.19 13.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.134 1.374 . . . . 0.0 108.432 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 18.5 m -127.47 134.42 49.83 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 172.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 67.5 p -115.68 24.97 11.12 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.439 1.096 . . . . 0.0 109.953 174.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -70.82 150.38 45.89 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 123.514 0.726 . . . . 0.0 109.696 172.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 69.2 t -136.51 126.04 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 126.231 1.812 . . . . 0.0 106.244 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.06 -156.37 0.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 -165.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -78.67 -137.89 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.934 1.294 . . . . 0.0 108.438 175.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -63.38 161.82 13.47 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.12 0.873 . . . . 0.0 111.758 -176.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 m -76.11 152.26 36.81 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.368 1.467 . . . . 0.0 108.893 -175.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -76.83 165.82 24.18 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.6 t -49.41 -40.17 35.35 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 126.083 1.753 . . . . 0.0 111.851 -179.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.29 32.21 4.82 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 124.267 1.027 . . . . 0.0 111.742 -177.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 20.4 t -99.69 126.46 45.73 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.637 0.775 . . . . 0.0 109.196 176.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.9 tttm -106.55 -45.36 4.26 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.017 0.927 . . . . 0.0 110.75 -174.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 t -105.28 126.06 51.67 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 172.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.2 t -147.78 142.1 26.27 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.531 1.133 . . . . 0.0 108.172 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.3 tp -148.2 151.77 36.08 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.0 m -126.27 166.18 17.59 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.917 0.887 . . . . 0.0 110.837 -172.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.7 p -83.47 153.52 24.41 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.287 0.635 . . . . 0.0 109.59 171.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -87.55 15.14 7.05 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.675 0.79 . . . . 0.0 111.859 172.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 80.0 p -76.97 -176.45 3.96 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.337 1.055 . . . . 0.0 111.6 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -134.93 114.67 11.92 Favored Pre-proline 0 N--CA 1.451 -0.411 0 C-N-CA 125.007 1.323 . . . . 0.0 108.86 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.06 142.46 72.94 Favored 'Cis proline' 0 N--CA 1.457 -0.659 0 CA-C-N 119.655 0.912 . . . . 0.0 110.033 -1.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.26 125.56 11.48 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.925 2.417 . . . . 0.0 109.097 177.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 30.8 mm100 -106.28 129.85 54.23 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 62.4 m -106.21 149.38 26.9 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.827 0.851 . . . . 0.0 109.325 -175.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.2 mtm105 -142.56 120.79 12.25 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 -160.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 48.4 t -83.8 124.96 31.47 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -178.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -117.97 26.57 9.57 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.266 1.426 . . . . 0.0 111.386 -179.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -57.71 147.2 28.51 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.572 0.749 . . . . 0.0 110.164 -178.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.3 mm -102.32 130.91 51.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 106.198 -1.779 . . . . 0.0 106.198 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 35.5 p -139.81 -171.56 3.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.99 1.316 . . . . 0.0 108.15 -170.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -128.66 15.53 6.47 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.493 1.117 . . . . 0.0 109.922 172.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -159.02 176.91 11.71 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.031 1.333 . . . . 0.0 110.394 -165.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.0 t -123.42 144.81 49.25 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 125.269 1.427 . . . . 0.0 109.63 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -92.51 157.41 40.21 Favored Pre-proline 0 N--CA 1.451 -0.389 0 C-N-CA 125.444 1.498 . . . . 0.0 109.367 175.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.37 162.73 29.3 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.967 2.445 . . . . 0.0 110.789 174.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.08 138.64 58.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 123.825 0.85 . . . . 0.0 112.128 -172.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -81.41 174.97 10.96 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.624 0.77 . . . . 0.0 111.359 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 52.6 m . . . . . 0 C--O 1.25 1.104 0 C-N-CA 125.826 1.65 . . . . 0.0 109.327 173.465 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.6 tptm -75.6 85.8 2.67 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 168.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.7 m -151.6 173.69 14.35 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.326 1.05 . . . . 0.0 109.47 -172.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.2 t -59.6 135.92 57.82 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.1 0.56 . . . . 0.0 110.843 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.2 t -120.99 74.67 1.1 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.276 1.43 . . . . 0.0 108.823 -177.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 64.8 p -65.0 171.03 3.82 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.406 1.083 . . . . 0.0 111.488 178.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.68 101.66 0.09 Allowed 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 124.075 0.95 . . . . 0.0 110.724 174.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.1 p -119.89 -179.2 3.84 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 122.099 0.952 . . . . 0.0 111.023 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.5 t -176.4 175.29 1.81 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 128.17 2.588 . . . . 0.0 105.516 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -142.84 -62.99 0.42 Allowed 'General case' 0 CA--C 1.527 0.083 0 CA-C-N 119.446 1.021 . . . . 0.0 108.833 164.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -90.86 104.78 17.33 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.3 p -118.04 75.01 10.61 Favored Pre-proline 0 CA--C 1.532 0.271 0 C-N-CA 124.852 1.261 . . . . 0.0 111.694 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.42 156.58 65.56 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.707 2.272 . . . . 0.0 110.662 170.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.5 m -142.67 166.2 25.3 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.059 0.944 . . . . 0.0 111.164 -172.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.9 p -82.74 162.0 21.89 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.163 0.985 . . . . 0.0 109.243 166.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -108.24 36.86 2.65 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.884 0.874 . . . . 0.0 109.59 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.7 p -85.15 -177.15 6.45 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.416 1.086 . . . . 0.0 111.018 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.3 tp -123.57 96.65 43.21 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 125.828 1.651 . . . . 0.0 109.474 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.02 163.47 89.38 Favored 'Cis proline' 0 CA--C 1.535 0.558 0 CA-C-N 119.747 0.945 . . . . 0.0 110.549 -3.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -76.89 149.17 28.96 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 123.371 2.714 . . . . 0.0 110.165 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -125.14 133.77 52.69 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.283 1.433 . . . . 0.0 108.413 175.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 77.7 m -109.89 152.73 25.43 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.308 1.443 . . . . 0.0 110.278 176.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -139.42 152.61 47.21 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.136 0.975 . . . . 0.0 108.894 172.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 23.4 m -103.45 118.0 35.74 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 125.03 1.332 . . . . 0.0 107.664 -176.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 50.5 p -107.89 15.95 23.97 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.46 1.104 . . . . 0.0 111.829 -164.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -65.31 152.59 43.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.022 0.439 . . . . 0.0 109.919 167.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.5 t -132.73 119.09 36.63 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.114 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 -176.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.1 mmm-85 -158.79 -162.93 1.16 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.597 1.159 . . . . 0.0 108.857 -162.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.99 -144.92 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.041 0.936 . . . . 0.0 109.082 170.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -61.85 154.62 25.49 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 121.299 -0.876 . . . . 0.0 110.755 -174.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 96.4 m -78.22 168.8 19.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.982 0.913 . . . . 0.0 110.621 -174.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.0 p80 -86.27 171.75 11.0 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.679 0.752 . . . . 0.0 112.818 -175.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.6 t -57.55 -34.42 69.15 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.52 1.528 . . . . 0.0 112.697 -176.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -105.96 44.59 1.03 Allowed 'General case' 0 C--N 1.338 0.096 0 C-N-CA 124.068 0.947 . . . . 0.0 109.723 -175.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 15.9 t -147.57 114.89 6.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -104.6 -36.63 7.42 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.756 1.223 . . . . 0.0 110.549 -162.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.9 t -102.66 108.89 20.31 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 171.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 44.3 t -118.27 129.19 55.32 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.647 1.979 . . . . 0.0 106.833 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -135.02 147.97 49.81 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 125.074 1.349 . . . . 0.0 108.056 -171.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 m -135.44 157.53 46.66 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.371 0.668 . . . . 0.0 110.832 -173.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -84.74 154.37 22.46 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.173 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -90.31 10.74 23.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.693 1.197 . . . . 0.0 111.971 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -70.78 -179.35 2.17 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.681 1.192 . . . . 0.0 111.058 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -120.55 115.17 32.57 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.463 1.105 . . . . 0.0 108.22 171.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -71.97 151.64 96.02 Favored 'Cis proline' 0 N--CA 1.456 -0.681 0 CA-C-N 119.627 0.902 . . . . 0.0 110.04 -2.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -72.25 137.29 28.3 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.458 2.105 . . . . 0.0 107.923 167.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -149.83 145.43 26.57 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -171.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 72.5 m -111.46 162.76 14.75 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.627 0.771 . . . . 0.0 112.658 -161.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 ttp85 -152.44 154.7 36.06 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 127.199 2.2 . . . . 0.0 108.292 -167.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 8.8 m -89.05 125.73 35.13 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.026 0.93 . . . . 0.0 110.23 173.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -105.91 20.33 19.11 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.885 1.274 . . . . 0.0 109.439 169.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -84.25 149.81 25.86 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.702 1.201 . . . . 0.0 109.755 -177.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.9 mm -108.74 135.51 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 124.86 1.264 . . . . 0.0 108.488 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.9 p -139.37 151.21 46.15 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 165.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -64.37 -37.25 86.86 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.635 0.374 . . . . 0.0 110.737 170.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.0 p90 -102.43 -172.94 2.22 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.179 1.792 . . . . 0.0 111.142 -172.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 35.2 t -142.35 149.92 40.05 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.451 1.9 . . . . 0.0 108.763 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -91.65 155.9 43.4 Favored Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 124.914 1.285 . . . . 0.0 109.582 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -63.33 159.69 38.57 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.629 2.219 . . . . 0.0 110.578 175.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.1 m -62.31 143.77 56.52 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 121.252 0.549 . . . . 0.0 111.995 -171.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.7 t -88.04 169.65 11.77 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.956 1.303 . . . . 0.0 110.673 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.251 1.163 0 CA-C-O 117.4 -1.286 . . . . 0.0 108.014 168.592 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 65.7 p . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 120.73 0.3 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -159.9 152.29 20.95 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.761 1.224 . . . . 0.0 108.351 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 40.3 m -151.35 153.67 35.21 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.566 1.146 . . . . 0.0 108.822 173.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.1 t -162.74 165.29 25.72 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.346 1.058 . . . . 0.0 109.378 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 t -78.34 80.85 4.72 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.258 1.023 . . . . 0.0 109.433 173.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 46.3 p -58.79 151.35 21.51 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.736 1.214 . . . . 0.0 111.609 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.25 118.12 6.47 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.793 0.837 . . . . 0.0 110.284 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.0 p -135.49 162.99 31.1 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.264 1.026 . . . . 0.0 111.255 178.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.4 t -171.35 142.02 1.64 Allowed 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 125.939 1.696 . . . . 0.0 108.544 -174.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -103.61 -73.02 0.68 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.195 0.998 . . . . 0.0 108.567 -174.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -77.05 108.05 9.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.0 p -132.94 62.65 63.34 Favored Pre-proline 0 N--CA 1.452 -0.339 0 C-N-CA 124.488 1.115 . . . . 0.0 111.497 -173.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.72 159.38 52.98 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.708 2.272 . . . . 0.0 111.031 178.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 24.1 m -131.3 153.98 49.01 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.839 0.856 . . . . 0.0 110.004 177.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.1 p -82.15 164.12 21.49 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.139 1.375 . . . . 0.0 109.691 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -106.81 25.54 11.15 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.188 0.995 . . . . 0.0 110.744 -177.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.5 p -81.97 -179.68 7.49 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.715 1.206 . . . . 0.0 110.432 176.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -126.84 106.38 22.71 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 124.797 1.239 . . . . 0.0 108.188 179.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.26 159.31 96.06 Favored 'Cis proline' 0 N--CA 1.458 -0.602 0 CA-C-N 119.373 0.812 . . . . 0.0 110.094 -4.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.0 138.23 22.75 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.869 2.38 . . . . 0.0 109.368 173.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -106.52 135.19 48.47 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 173.002 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.8 m -107.1 143.54 35.09 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.283 1.033 . . . . 0.0 108.876 175.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -146.15 159.26 43.55 Favored 'General case' 0 N--CA 1.457 -0.095 0 C-N-CA 124.175 0.99 . . . . 0.0 108.964 -173.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.0 m -106.26 137.47 44.16 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.851 0.86 . . . . 0.0 109.614 -178.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.1 p -120.57 -12.91 8.84 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.429 1.092 . . . . 0.0 112.041 -174.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -65.36 150.38 48.39 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.481 0.582 . . . . 0.0 110.804 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.7 t -118.02 118.16 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 125.186 1.394 . . . . 0.0 107.907 -170.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -141.67 -166.76 2.28 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.781 1.633 . . . . 0.0 108.676 -171.461 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -77.26 -132.86 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 167.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -60.94 150.54 32.96 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.917 1.235 . . . . 0.0 111.31 -173.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.1 p -87.77 151.8 22.61 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 126.357 1.863 . . . . 0.0 109.831 -176.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.3 p80 -72.9 168.24 19.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -159.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.2 t -51.32 -38.09 51.16 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 126.232 1.813 . . . . 0.0 112.188 -178.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.54 31.3 4.77 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.295 1.038 . . . . 0.0 111.513 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 18.2 t -104.48 128.06 52.32 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.153 0.981 . . . . 0.0 108.806 175.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -107.73 -46.68 3.76 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.473 1.109 . . . . 0.0 110.704 -173.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 t -104.97 131.01 53.02 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 172.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 44.8 t -154.75 145.73 22.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.669 1.188 . . . . 0.0 108.434 -174.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 7.4 tt -148.77 150.22 32.71 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.7 m -127.75 159.17 35.61 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.4 1.08 . . . . 0.0 110.211 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 69.0 p -81.56 155.58 25.65 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.569 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.6 ptt85 -93.47 26.01 3.19 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.304 1.441 . . . . 0.0 110.09 170.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.4 m -87.74 178.81 6.63 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.243 1.417 . . . . 0.0 110.66 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -129.19 105.08 17.93 Favored Pre-proline 0 N--CA 1.441 -0.895 0 C-N-CA 126.751 2.021 . . . . 0.0 108.122 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -72.55 155.4 99.01 Favored 'Cis proline' 0 CA--C 1.537 0.653 0 CA-C-N 119.802 0.965 . . . . 0.0 111.054 -1.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -75.84 130.43 12.44 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.604 2.869 . . . . 0.0 109.459 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -121.66 136.64 54.94 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.019 1.328 . . . . 0.0 109.038 -176.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 66.6 m -108.79 156.46 19.6 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.42 1.088 . . . . 0.0 111.556 -172.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -152.85 143.64 22.86 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 124.327 1.051 . . . . 0.0 109.768 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 33.0 t -92.53 121.15 33.69 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 124.928 1.291 . . . . 0.0 109.363 -177.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.07 20.84 18.45 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.874 1.269 . . . . 0.0 111.14 -174.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -62.7 150.33 41.39 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.658 0.783 . . . . 0.0 110.964 -175.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.1 mm -105.77 126.41 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 70.4 p -136.34 -169.37 2.43 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.01 1.324 . . . . 0.0 108.714 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -128.83 9.03 5.8 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.392 1.477 . . . . 0.0 110.983 173.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -148.9 -176.11 5.21 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 126.008 1.723 . . . . 0.0 109.811 -169.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.4 t -132.11 144.4 50.69 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.714 1.206 . . . . 0.0 109.207 174.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -88.58 160.27 44.98 Favored Pre-proline 0 CA--C 1.534 0.348 0 C-N-CA 125.14 1.376 . . . . 0.0 109.089 174.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -61.23 162.52 19.74 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.185 1.924 . . . . 0.0 111.198 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.61 138.79 33.7 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.929 1.291 . . . . 0.0 112.076 -177.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.31 175.63 5.99 Favored 'General case' 0 C--O 1.23 0.071 0 C-N-CA 124.406 1.082 . . . . 0.0 110.347 178.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.7 t . . . . . 0 C--O 1.251 1.165 0 C-N-CA 125.247 1.419 . . . . 0.0 108.763 -178.328 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -77.5 -170.32 1.75 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.826 1.25 . . . . 0.0 109.875 172.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.2 m -55.46 155.64 5.19 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.718 1.207 . . . . 0.0 112.391 -177.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.2 t -65.8 163.5 16.62 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.916 0.886 . . . . 0.0 111.991 -174.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.6 t -77.32 85.09 3.75 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.265 1.026 . . . . 0.0 108.896 172.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.2 p -59.85 173.7 0.56 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.783 1.233 . . . . 0.0 110.935 172.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -48.39 109.15 0.21 Allowed 'General case' 0 C--N 1.339 0.149 0 C-N-CA 124.313 1.045 . . . . 0.0 110.987 178.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.6 p -129.73 -176.17 3.83 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 124.844 1.258 . . . . 0.0 109.329 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 49.6 t -171.98 158.22 4.65 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 126.16 1.784 . . . . 0.0 107.447 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -105.67 -60.91 1.56 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -114.8 115.31 26.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.799 1.239 . . . . 0.0 108.54 -177.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 11.0 p -131.81 78.88 69.29 Favored Pre-proline 0 N--CA 1.453 -0.322 0 C-N-CA 125.037 1.335 . . . . 0.0 112.063 -173.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -71.09 161.89 44.47 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.628 2.219 . . . . 0.0 110.919 173.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.0 m -133.03 156.99 46.34 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.382 1.073 . . . . 0.0 109.462 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.1 p -84.5 164.96 18.48 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.098 1.359 . . . . 0.0 110.31 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.7 ptt-85 -108.52 5.49 25.22 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.881 1.272 . . . . 0.0 112.463 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.3 p -73.19 175.99 6.29 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.047 1.339 . . . . 0.0 110.857 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 tp -124.74 115.38 26.65 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 125.001 1.32 . . . . 0.0 108.943 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -70.48 152.23 93.97 Favored 'Cis proline' 0 N--CA 1.458 -0.589 0 CA-C-N 119.798 0.964 . . . . 0.0 109.869 -6.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -79.48 136.77 12.64 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.018 2.478 . . . . 0.0 109.779 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -108.43 149.93 28.08 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.454 1.501 . . . . 0.0 109.715 170.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 96.6 m -112.47 148.69 33.88 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.515 1.526 . . . . 0.0 109.287 170.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -156.1 169.68 23.94 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.63 1.172 . . . . 0.0 108.981 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 92.3 m -106.87 141.64 37.78 Favored 'General case' 0 CA--C 1.521 -0.173 0 C-N-CA 123.135 0.574 . . . . 0.0 110.916 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.2 t -108.52 -26.17 10.56 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.97 1.308 . . . . 0.0 110.668 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -58.67 142.36 49.88 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-O 121.561 0.696 . . . . 0.0 111.198 -177.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.6 t -113.25 133.96 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 C-N-CA 125.8 1.64 . . . . 0.0 107.471 -172.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.7 tpp180 -160.84 -150.47 0.21 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -174.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -80.05 -150.48 0.06 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.668 0.787 . . . . 0.0 108.93 173.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -60.17 158.12 11.98 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.476 0.655 . . . . 0.0 110.912 -177.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 65.1 m -80.45 163.12 24.04 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.127 -170.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -80.04 172.67 13.47 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.513 0.673 . . . . 0.0 112.242 -174.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.2 t -55.12 -28.93 56.24 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.466 1.507 . . . . 0.0 113.003 -176.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.86 48.59 0.84 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.441 1.096 . . . . 0.0 110.161 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 84.5 m -128.92 133.69 47.97 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 164.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -103.96 -42.19 5.64 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.167 1.387 . . . . 0.0 108.925 -177.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.9 t -105.95 130.04 53.97 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 171.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.8 t -138.91 132.92 31.17 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 125.707 1.603 . . . . 0.0 107.023 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -138.23 148.36 44.69 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 124.205 1.002 . . . . 0.0 109.06 -170.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.0 m -136.41 158.86 43.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.716 0.806 . . . . 0.0 110.318 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.2 t -87.36 155.38 20.06 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 123.516 0.51 . . . . 0.0 110.118 175.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -90.15 8.89 30.61 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.879 1.271 . . . . 0.0 111.578 174.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.6 m -65.55 177.19 1.24 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.244 1.018 . . . . 0.0 110.934 174.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -122.93 113.4 30.02 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 174.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.55 147.37 89.01 Favored 'Cis proline' 0 CA--C 1.538 0.698 0 CA-C-N 119.788 0.96 . . . . 0.0 111.13 0.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.03 106.02 2.19 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.493 2.795 . . . . 0.0 108.772 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -107.9 147.98 30.24 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.051 0.94 . . . . 0.0 109.516 -173.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 91.8 m -116.62 159.68 21.81 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.322 1.049 . . . . 0.0 112.043 -166.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.7 ttp-105 -155.56 149.4 25.37 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 125.05 1.34 . . . . 0.0 109.722 -174.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 44.6 t -82.66 136.59 34.73 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.906 1.282 . . . . 0.0 109.882 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -122.36 18.0 10.59 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.171 1.389 . . . . 0.0 110.917 -178.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -79.25 149.1 31.96 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.036 0.934 . . . . 0.0 110.114 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 52.1 mm -108.73 133.73 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 C-N-CA 124.693 1.197 . . . . 0.0 108.763 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 67.4 p -138.9 -169.87 2.73 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.065 1.346 . . . . 0.0 108.233 175.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -117.66 5.71 12.37 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.05 1.34 . . . . 0.0 111.393 171.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -142.33 -178.0 5.53 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.233 1.413 . . . . 0.0 110.39 -171.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 41.5 t -140.54 145.5 36.87 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.546 1.138 . . . . 0.0 109.223 174.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -79.67 157.6 74.31 Favored Pre-proline 0 N--CA 1.451 -0.382 0 C-N-CA 125.097 1.359 . . . . 0.0 109.793 176.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -60.85 154.35 56.55 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.651 2.234 . . . . 0.0 110.823 177.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.2 138.04 57.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.594 0.758 . . . . 0.0 112.49 -168.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.26 -176.66 5.74 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.035 176.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.7 p . . . . . 0 C--O 1.251 1.15 0 CA-C-O 117.197 -1.382 . . . . 0.0 109.915 167.475 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 48.8 p . . . . . 0 N--CA 1.473 0.702 0 CA-C-O 119.48 -0.295 . . . . 0.0 110.701 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -138.98 144.94 39.17 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 124.252 1.021 . . . . 0.0 109.148 175.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.7 m -159.8 163.07 34.83 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.36 1.464 . . . . 0.0 108.909 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 66.2 p -72.27 169.18 16.75 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.927 0.891 . . . . 0.0 110.642 175.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.1 t -77.5 68.31 3.57 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.536 1.135 . . . . 0.0 110.902 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 69.9 p -65.64 166.16 11.2 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.469 1.108 . . . . 0.0 110.568 175.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.46 86.24 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.705 0.802 . . . . 0.0 110.423 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.7 p -120.17 -168.12 1.57 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 125.765 1.626 . . . . 0.0 109.875 -176.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.8 t -163.05 -178.87 6.31 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.442 1.497 . . . . 0.0 107.296 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -140.34 -56.61 0.53 Allowed 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 164.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 14.4 m-30 -93.43 112.66 24.63 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 176.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.1 m -113.2 68.38 1.2 Allowed Pre-proline 0 CA--C 1.537 0.443 0 C-N-CA 125.723 1.609 . . . . 0.0 111.303 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -79.85 165.15 22.4 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 121.631 1.554 . . . . 0.0 109.854 171.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.6 t -156.69 163.58 39.13 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.957 -178.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 70.6 p -72.96 175.98 6.13 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.981 171.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -106.48 4.93 28.81 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.317 1.047 . . . . 0.0 111.569 170.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 55.8 p -81.2 179.69 7.74 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.7 1.2 . . . . 0.0 112.043 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.5 tp -132.68 107.25 12.94 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 126.337 1.855 . . . . 0.0 108.194 -174.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -70.05 158.75 91.57 Favored 'Cis proline' 0 N--CA 1.457 -0.67 0 CA-C-N 119.808 0.967 . . . . 0.0 111.783 -1.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -78.74 135.95 13.16 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 124.067 3.178 . . . . 0.0 110.315 178.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -106.35 101.82 11.26 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 176.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 38.7 m -108.13 143.25 37.15 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.301 1.04 . . . . 0.0 108.783 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -139.46 177.24 8.07 Favored 'General case' 0 C--N 1.339 0.136 0 O-C-N 123.686 0.616 . . . . 0.0 111.294 -171.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 53.3 m -106.71 131.67 53.58 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 163.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 53.5 p -120.92 -1.71 9.86 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -67.01 137.77 56.73 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 118.507 0.594 . . . . 0.0 110.342 174.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.7 t -112.54 120.78 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 -170.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.1 mmm-85 -150.53 -161.11 1.27 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.225 1.41 . . . . 0.0 108.293 -164.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -68.38 -153.6 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 165.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -56.77 150.74 15.53 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -170.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.6 p -64.02 145.7 55.42 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 113.92 -1.491 . . . . 0.0 110.954 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.1 p80 -71.92 176.04 5.34 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -164.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.5 t -75.05 26.42 0.09 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.857 1.263 . . . . 0.0 113.18 -175.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -157.03 62.79 0.5 Allowed 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.622 0.769 . . . . 0.0 109.693 171.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.2 m -127.07 130.93 50.87 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.935 0.894 . . . . 0.0 109.82 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -105.48 -45.33 4.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.494 1.518 . . . . 0.0 107.572 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.2 t -107.88 139.64 42.17 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 166.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 18.8 t -156.28 147.54 22.4 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.536 1.534 . . . . 0.0 107.914 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.4 tp -156.53 157.05 34.71 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.4 m -126.41 160.69 29.77 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.029 0.932 . . . . 0.0 109.807 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 60.3 p -77.18 155.14 32.47 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.509 0.723 . . . . 0.0 110.596 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -91.25 10.65 26.34 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.918 0.887 . . . . 0.0 111.932 173.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 p -73.31 176.55 5.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.965 0.906 . . . . 0.0 111.071 176.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -128.16 112.23 19.94 Favored Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 124.645 1.178 . . . . 0.0 108.008 174.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.32 150.25 91.27 Favored 'Cis proline' 0 N--CA 1.456 -0.707 0 CA-C-N 119.517 0.863 . . . . 0.0 110.392 -1.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.06 154.6 47.44 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.31 2.673 . . . . 0.0 109.1 172.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -149.92 137.85 20.23 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.121 0.568 . . . . 0.0 109.487 -172.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.3 m -108.22 154.75 21.31 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 123.638 0.775 . . . . 0.0 112.542 -164.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -152.24 148.16 27.24 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.399 1.08 . . . . 0.0 109.526 -176.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 36.2 t -99.71 118.94 37.29 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 125.95 1.7 . . . . 0.0 109.157 -176.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -107.49 26.41 10.27 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.945 0.898 . . . . 0.0 111.704 -171.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -62.11 138.82 58.45 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.526 0.73 . . . . 0.0 110.4 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 19.3 mm -105.4 111.62 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.3 p -138.05 161.15 37.49 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.775 0.83 . . . . 0.0 109.767 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -74.73 -20.7 59.72 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.21 0.604 . . . . 0.0 111.774 173.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 36.0 p90 -115.3 -172.54 2.16 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 125.936 1.694 . . . . 0.0 109.982 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.5 t -145.74 155.45 42.96 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.37 1.068 . . . . 0.0 109.066 171.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -82.64 157.22 67.47 Favored Pre-proline 0 N--CA 1.451 -0.391 0 C-N-CA 124.252 1.021 . . . . 0.0 109.642 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.38 176.23 8.27 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.064 2.509 . . . . 0.0 111.442 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 p -63.3 141.72 58.66 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.948 0.899 . . . . 0.0 112.123 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -82.39 -170.21 2.82 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.539 1.136 . . . . 0.0 111.238 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.6 t . . . . . 0 C--O 1.255 1.39 0 C-N-CA 125.05 1.34 . . . . 0.0 108.621 166.858 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 35.9 p . . . . . 0 N--CA 1.475 0.81 0 CA-C-O 120.754 0.311 . . . . 0.0 111.451 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -164.29 -57.1 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.837 0.855 . . . . 0.0 109.405 176.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 26.5 m -61.26 135.89 57.88 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.031 0.932 . . . . 0.0 110.366 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.1 m -52.64 121.41 7.08 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.798 1.239 . . . . 0.0 111.391 -176.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 42.6 p 1.52 79.06 0.0 OUTLIER 'General case' 0 C--N 1.345 0.402 0 C-N-CA 129.544 3.138 . . . . 0.0 114.559 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 65.1 p -69.22 159.01 33.84 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.058 0.543 . . . . 0.0 110.771 -176.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -72.23 93.28 1.45 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 174.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.0 p -143.15 169.32 17.82 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 122.1 0.952 . . . . 0.0 111.505 178.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.8 t -158.32 153.13 24.96 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 126.234 1.814 . . . . 0.0 107.113 -168.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -107.26 -70.79 0.78 Allowed 'General case' 0 C--N 1.339 0.109 0 C-N-CA 123.406 0.682 . . . . 0.0 109.751 -170.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -89.89 111.68 22.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 173.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 4.8 t -126.68 69.1 70.47 Favored Pre-proline 0 CA--C 1.533 0.302 0 O-C-N 123.853 0.721 . . . . 0.0 112.461 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.1 158.99 55.69 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.8 2.333 . . . . 0.0 110.924 174.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.1 m -136.75 158.09 45.26 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.972 0.909 . . . . 0.0 110.926 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.3 p -79.2 163.83 24.69 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.618 0.767 . . . . 0.0 109.082 172.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 68.9 mtp85 -113.36 33.39 5.14 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.827 0.851 . . . . 0.0 109.862 172.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.3 p -78.71 176.91 9.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.507 1.123 . . . . 0.0 109.687 168.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.6 mm -127.76 111.72 20.56 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.577 1.151 . . . . 0.0 108.203 176.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.1 157.67 89.93 Favored 'Cis proline' 0 CA--C 1.537 0.668 0 CA-C-N 119.206 0.752 . . . . 0.0 110.218 -5.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -82.46 146.87 13.91 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.866 3.044 . . . . 0.0 110.734 175.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -120.64 130.14 54.02 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.673 1.589 . . . . 0.0 108.106 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 80.1 m -106.93 144.39 33.64 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.979 1.311 . . . . 0.0 109.164 174.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -140.74 160.34 40.26 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.103 1.361 . . . . 0.0 109.652 -176.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.6 m -107.29 125.96 51.82 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 124.271 1.028 . . . . 0.0 109.535 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.1 p -108.95 -17.8 13.83 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.475 1.11 . . . . 0.0 112.157 -172.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -62.34 142.84 57.59 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.127 0.571 . . . . 0.0 111.191 176.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.8 t -114.16 137.32 47.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 125.342 1.457 . . . . 0.0 107.838 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -160.07 -153.63 0.35 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 -174.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -76.72 -153.83 0.05 Allowed 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.834 0.854 . . . . 0.0 108.887 167.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 158.44 7.75 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.368 0.667 . . . . 0.0 112.017 -171.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.2 m -72.51 164.83 25.78 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.997 0.919 . . . . 0.0 111.424 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 22.7 p80 -78.07 168.76 19.37 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.79 0.805 . . . . 0.0 112.689 -171.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.7 t -58.62 -23.14 58.34 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 114.055 -1.43 . . . . 0.0 113.401 -172.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -119.74 29.57 7.5 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.373 1.069 . . . . 0.0 112.11 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.9 t -88.16 139.16 30.79 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 172.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -104.31 -51.9 3.02 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.649 1.18 . . . . 0.0 109.92 -175.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.3 t -107.22 119.67 40.03 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 48.8 t -126.81 138.92 53.42 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 125.441 1.497 . . . . 0.0 108.107 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.6 tp -144.29 153.31 41.89 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.7 m -130.41 156.28 45.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.053 0.941 . . . . 0.0 109.666 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -90.31 152.55 20.98 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 123.446 0.467 . . . . 0.0 110.002 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -88.54 15.3 8.21 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.222 1.009 . . . . 0.0 111.887 174.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 m -67.24 172.87 4.3 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.883 0.873 . . . . 0.0 110.545 173.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -125.93 113.14 24.44 Favored Pre-proline 0 CA--C 1.532 0.264 0 C-N-CA 124.018 0.927 . . . . 0.0 109.075 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.03 154.02 93.86 Favored 'Cis proline' 0 CA--C 1.54 0.783 0 CA-C-N 119.56 0.879 . . . . 0.0 110.92 -2.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -84.43 126.38 3.6 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.221 3.281 . . . . 0.0 109.987 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -113.83 158.44 21.02 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.555 1.142 . . . . 0.0 109.237 174.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 98.6 m -113.64 159.53 19.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.871 1.269 . . . . 0.0 110.52 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -156.19 144.8 20.12 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.699 1.2 . . . . 0.0 108.786 -174.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 53.1 t -91.64 122.36 34.14 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.655 -175.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -103.68 5.15 36.14 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.459 1.504 . . . . 0.0 111.286 -174.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -59.93 127.91 34.26 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.669 0.788 . . . . 0.0 109.787 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 35.8 mm -106.72 129.68 59.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 p -142.99 153.83 43.39 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 123.163 0.585 . . . . 0.0 109.648 178.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -62.83 -39.77 95.37 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.154 0.581 . . . . 0.0 110.67 172.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -88.89 -176.65 5.27 Favored 'General case' 0 N--CA 1.458 -0.071 0 C-N-CA 124.36 1.064 . . . . 0.0 110.045 173.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 10.6 t -151.78 153.16 33.73 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.464 0.706 . . . . 0.0 110.112 165.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -73.95 153.32 88.88 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 124.58 1.152 . . . . 0.0 109.464 175.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -72.75 179.9 4.82 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.097 2.531 . . . . 0.0 111.291 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.96 136.63 51.75 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.613 1.165 . . . . 0.0 112.132 -176.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -87.03 171.83 10.44 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.78 177.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 C--O 1.249 1.057 0 C-N-CA 129.996 3.319 . . . . 0.0 107.677 -174.44 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 47.6 p . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 110.807 -0.072 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -73.51 96.74 2.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.701 0.801 . . . . 0.0 110.325 -176.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 71.6 p -114.2 75.48 0.93 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.812 1.245 . . . . 0.0 109.736 -176.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.2 t -155.82 169.78 23.61 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.255 1.022 . . . . 0.0 109.437 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 76.9 p -1.14 84.64 0.0 OUTLIER 'General case' 0 C--N 1.347 0.468 0 C-N-CA 129.403 3.081 . . . . 0.0 113.72 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.2 p -78.99 148.76 32.45 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.527 0.731 . . . . 0.0 110.699 -173.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.08 135.99 56.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.453 0.701 . . . . 0.0 109.67 171.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.6 p -156.7 166.1 34.36 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.897 0.856 . . . . 0.0 111.932 170.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 t -168.08 156.48 8.9 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.496 1.918 . . . . 0.0 108.122 -176.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -104.22 -68.2 0.86 Allowed 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -84.63 99.23 10.65 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.7 t -117.14 77.49 9.38 Favored Pre-proline 0 CA--C 1.531 0.227 0 C-N-CA 124.233 1.013 . . . . 0.0 111.292 178.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -74.44 159.64 42.88 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.02 1.813 . . . . 0.0 110.242 170.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.5 m -134.39 156.85 47.79 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.669 1.188 . . . . 0.0 108.638 173.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.4 p -77.84 170.13 17.11 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.501 0.721 . . . . 0.0 109.984 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -108.28 10.09 27.8 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.813 1.245 . . . . 0.0 112.309 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.4 p -73.17 179.78 3.7 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.559 1.544 . . . . 0.0 111.868 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 tp -128.4 101.42 21.61 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 125.858 1.663 . . . . 0.0 108.966 -176.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -75.12 155.31 99.83 Favored 'Cis proline' 0 CA--C 1.536 0.61 0 CA-C-N 119.788 0.96 . . . . 0.0 110.492 -2.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -81.64 140.5 11.81 Favored 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 123.245 2.63 . . . . 0.0 109.712 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.46 141.13 40.79 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.27 1.428 . . . . 0.0 108.004 174.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 93.0 m -107.54 144.69 34.18 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.879 1.272 . . . . 0.0 109.333 176.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -144.27 -179.84 6.78 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.641 1.576 . . . . 0.0 108.576 -173.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 8.2 m -135.05 146.58 49.1 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 120.97 0.414 . . . . 0.0 111.352 175.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 80.7 p -121.64 17.51 11.18 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.271 1.428 . . . . 0.0 110.518 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -75.13 150.9 38.64 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.987 0.915 . . . . 0.0 108.98 174.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.8 t -141.46 112.35 3.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 C-N-CA 125.029 1.332 . . . . 0.0 108.536 -170.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.1 mtp-105 -144.07 -153.3 0.46 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.833 0.853 . . . . 0.0 108.8 -171.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -76.2 -131.03 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 169.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -63.7 162.82 12.53 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.46 1.027 . . . . 0.0 112.098 -174.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.7 m -88.11 151.01 23.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.374 1.469 . . . . 0.0 109.347 -172.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.0 p80 -84.03 174.72 10.06 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 121.934 0.873 . . . . 0.0 113.131 -172.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.7 t -59.11 -34.99 72.66 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.568 1.547 . . . . 0.0 112.873 -173.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.59 46.23 0.98 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.122 0.969 . . . . 0.0 110.164 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 11.2 t -144.13 103.3 3.99 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 175.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -102.77 -35.2 8.73 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 125.801 1.64 . . . . 0.0 109.255 -166.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t -102.81 125.33 49.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 170.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 11.0 t -154.87 144.29 21.27 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.57 1.148 . . . . 0.0 107.953 -172.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.5 tp -146.95 141.39 26.43 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -176.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.1 m -113.0 153.94 27.26 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.215 1.006 . . . . 0.0 110.488 -174.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.7 t -89.75 154.76 19.67 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.364 -175.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -90.13 16.33 8.65 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.76 1.224 . . . . 0.0 111.572 174.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 m -75.44 178.47 5.89 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.209 1.004 . . . . 0.0 110.547 174.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -126.88 115.65 22.26 Favored Pre-proline 0 CA--C 1.535 0.388 0 C-N-CA 124.441 1.096 . . . . 0.0 108.47 174.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.0 146.57 87.04 Favored 'Cis proline' 0 N--CA 1.456 -0.708 0 CA-C-N 119.772 0.954 . . . . 0.0 110.509 0.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -76.73 121.53 5.96 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 123.05 2.5 . . . . 0.0 109.485 176.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -120.78 156.89 30.91 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.265 1.426 . . . . 0.0 109.401 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.9 m -108.08 142.48 38.2 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.508 0.723 . . . . 0.0 110.608 -176.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.4 mtm-85 -126.71 131.63 51.32 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 126.782 2.033 . . . . 0.0 106.783 -167.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 5.8 m -76.36 136.1 39.52 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.171 0.441 . . . . 0.0 110.023 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -118.34 15.46 13.91 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.64 1.576 . . . . 0.0 109.866 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -82.01 152.25 26.76 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.529 1.132 . . . . 0.0 111.299 -169.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 45.6 mm -116.5 132.65 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 124.963 1.305 . . . . 0.0 108.202 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.9 p -134.95 177.89 7.45 Favored 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 159.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -78.64 -20.56 50.04 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.974 -0.454 . . . . 0.0 111.145 172.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -123.47 174.36 7.43 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 126.045 1.738 . . . . 0.0 111.721 -169.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 7.6 m -107.55 157.13 18.29 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.314 1.446 . . . . 0.0 110.33 176.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -100.27 156.9 34.73 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 126.67 1.988 . . . . 0.0 108.086 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -69.19 174.33 9.16 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.04 2.493 . . . . 0.0 112.073 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.7 p -63.11 145.14 56.11 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.92 0.888 . . . . 0.0 112.105 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -113.23 -179.05 3.53 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 125.115 1.366 . . . . 0.0 111.903 -173.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.251 1.178 0 C-N-CA 125.347 1.459 . . . . 0.0 110.302 179.166 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.474 0.753 0 CA-C-O 119.845 -0.121 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -167.27 117.59 0.86 Allowed 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.424 1.09 . . . . 0.0 108.123 177.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.5 m -149.77 124.82 10.01 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.9 t -164.19 179.85 6.6 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.319 1.048 . . . . 0.0 109.232 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.0 t -150.25 67.41 0.97 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.843 1.257 . . . . 0.0 108.539 177.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.1 p -71.43 -179.45 2.5 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.653 1.181 . . . . 0.0 111.526 -178.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -52.33 118.95 3.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.95 0.9 . . . . 0.0 110.488 172.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.9 p -146.25 -179.97 7.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.582 1.153 . . . . 0.0 109.705 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 44.5 t -170.68 156.97 5.48 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.176 1.79 . . . . 0.0 107.2 174.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -105.57 -64.63 1.12 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.379 0.671 . . . . 0.0 109.552 -176.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -101.46 112.1 24.53 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 172.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 9.1 t -130.29 75.75 78.75 Favored Pre-proline 0 CA--C 1.531 0.227 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.84 158.29 53.28 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 122.605 2.203 . . . . 0.0 111.149 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.6 m -136.97 156.95 47.79 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.27 1.028 . . . . 0.0 110.61 -178.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 74.7 p -82.54 159.45 22.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 168.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 -106.65 31.21 5.41 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.506 0.722 . . . . 0.0 109.929 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.8 p -75.21 176.96 6.85 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.034 1.334 . . . . 0.0 110.167 173.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 34.4 mm -125.4 106.41 27.42 Favored Pre-proline 0 CA--C 1.533 0.292 0 C-N-CA 124.525 1.13 . . . . 0.0 108.384 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -72.8 161.38 93.55 Favored 'Cis proline' 0 CA--C 1.539 0.742 0 N-CA-C 109.856 -0.863 . . . . 0.0 109.856 -5.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -74.93 151.6 40.11 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 123.393 2.729 . . . . 0.0 110.418 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -122.32 119.26 30.58 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.941 1.296 . . . . 0.0 108.171 176.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 75.5 m -106.93 141.52 38.02 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.055 1.342 . . . . 0.0 109.492 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.19 162.41 36.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.919 1.288 . . . . 0.0 110.579 -178.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.3 m -104.29 131.28 51.79 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.977 1.311 . . . . 0.0 109.385 -176.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 47.4 p -107.55 -26.36 10.94 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.293 1.037 . . . . 0.0 111.124 -178.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -61.67 144.01 55.22 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.076 0.465 . . . . 0.0 109.82 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.5 t -118.73 142.34 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -158.23 -150.84 0.27 Allowed 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -170.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -74.75 -149.57 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 162.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -64.14 160.19 18.85 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.951 0.881 . . . . 0.0 112.267 -170.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 7.4 p -67.22 162.12 23.32 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.193 1.797 . . . . 0.0 111.626 176.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -82.0 173.11 12.51 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.032 0.933 . . . . 0.0 113.123 -172.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.8 t -57.75 -33.09 68.11 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.551 1.541 . . . . 0.0 112.943 -173.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.57 42.8 1.27 Allowed 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 124.064 0.946 . . . . 0.0 110.574 -177.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.6 t -117.59 128.95 55.45 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.03 0.932 . . . . 0.0 108.936 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.0 tttp -104.78 -47.31 4.08 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 124.064 0.945 . . . . 0.0 110.113 -171.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.0 p -103.61 125.85 50.38 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 125.639 1.576 . . . . 0.0 106.993 172.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 38.5 t -148.95 140.22 23.19 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.474 1.11 . . . . 0.0 108.244 -166.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.88 156.82 46.03 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 124.178 0.991 . . . . 0.0 109.673 -167.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 34.1 m -138.59 161.69 36.45 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.069 0.948 . . . . 0.0 109.815 174.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 44.9 p -87.28 150.78 23.65 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.046 0.938 . . . . 0.0 110.082 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -85.55 10.36 13.34 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.784 0.833 . . . . 0.0 112.411 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.0 p -71.28 176.41 4.59 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.859 1.264 . . . . 0.0 111.145 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -129.68 114.72 18.0 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.625 171.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.09 145.43 82.28 Favored 'Cis proline' 0 CA--C 1.54 0.806 0 CA-C-N 119.596 0.891 . . . . 0.0 110.743 -0.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.33 125.18 8.94 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.372 2.714 . . . . 0.0 109.43 177.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -109.36 143.0 39.49 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.635 1.174 . . . . 0.0 109.269 -178.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 64.1 m -113.5 160.81 18.09 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.043 0.937 . . . . 0.0 111.754 -169.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -159.5 163.68 35.05 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.75 1.22 . . . . 0.0 110.142 -170.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 52.8 t -99.28 142.6 30.56 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.746 1.218 . . . . 0.0 109.441 175.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -111.91 -12.17 13.8 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.441 1.097 . . . . 0.0 111.635 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.31 142.72 54.34 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.335 1.054 . . . . 0.0 112.708 -174.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.0 mm -105.96 133.27 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 125.748 1.619 . . . . 0.0 107.597 -172.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.8 p -131.88 158.23 41.9 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.088 0.47 . . . . 0.0 111.137 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -74.42 -44.08 53.46 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.023 1.329 . . . . 0.0 110.627 172.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -93.06 -167.95 1.83 Allowed 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 124.96 1.304 . . . . 0.0 108.294 170.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 7.8 t -147.61 154.96 41.31 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 157.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -72.27 153.4 92.28 Favored Pre-proline 0 N--CA 1.451 -0.424 0 C-N-CA 124.693 1.197 . . . . 0.0 109.817 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -72.7 174.83 11.14 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.277 2.652 . . . . 0.0 111.472 -176.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.38 132.06 43.38 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.491 1.116 . . . . 0.0 111.88 -176.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.6 t -86.35 169.09 13.26 Favored 'General case' 0 N--CA 1.457 -0.092 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.02 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.25 1.093 0 CA-C-O 117.349 -1.31 . . . . 0.0 108.38 168.043 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 43.6 p . . . . . 0 N--CA 1.475 0.776 0 CA-C-O 119.644 -0.217 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -163.54 127.03 2.71 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.292 1.037 . . . . 0.0 108.51 178.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 69.4 p -83.09 69.71 9.91 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.933 0.893 . . . . 0.0 110.703 -176.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 19.8 p -136.22 147.27 47.52 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 125.741 1.617 . . . . 0.0 108.249 177.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 12.3 t -155.31 -154.12 0.48 Allowed 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -177.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.3 p -75.47 -176.18 3.09 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.359 1.864 . . . . 0.0 110.737 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -44.88 121.37 2.73 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.671 1.189 . . . . 0.0 110.246 167.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.1 p -141.29 -179.59 6.21 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.08 0.952 . . . . 0.0 110.197 -175.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 29.5 t -173.68 150.63 1.75 Allowed 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.459 1.904 . . . . 0.0 106.582 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -106.0 -70.9 0.77 Allowed 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -174.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -85.04 109.33 18.13 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 174.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.4 t -126.2 73.16 72.05 Favored Pre-proline 0 CA--C 1.528 0.134 0 C-N-CA 122.721 0.408 . . . . 0.0 111.453 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -69.27 162.11 43.15 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.284 1.989 . . . . 0.0 110.504 172.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 21.3 m -136.12 158.68 43.83 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.944 0.898 . . . . 0.0 109.803 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.9 p -80.86 163.51 23.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.71 0.804 . . . . 0.0 109.324 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 85.4 mtm180 -108.73 32.26 5.01 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.782 0.833 . . . . 0.0 110.665 175.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 29.9 p -87.6 -177.54 5.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.576 1.151 . . . . 0.0 110.92 179.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.2 tp -127.1 100.6 26.8 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 125.519 1.528 . . . . 0.0 109.568 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.62 159.14 97.93 Favored 'Cis proline' 0 N--CA 1.458 -0.575 0 CA-C-N 119.684 0.923 . . . . 0.0 110.357 -3.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -80.12 147.85 18.86 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.162 2.575 . . . . 0.0 109.775 171.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.64 137.68 52.48 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.342 1.457 . . . . 0.0 107.985 172.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.6 m -108.23 144.77 35.24 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.992 1.317 . . . . 0.0 108.724 173.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -150.63 155.91 40.31 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.989 1.316 . . . . 0.0 108.47 -171.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.8 m -104.63 128.44 52.66 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.344 0.657 . . . . 0.0 109.671 -174.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 46.3 p -108.78 1.86 21.31 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.934 0.894 . . . . 0.0 111.802 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -71.17 154.03 42.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.39 0.614 . . . . 0.0 109.949 170.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.8 t -142.42 131.8 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 125.276 1.43 . . . . 0.0 107.409 -175.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.4 ttp85 -156.43 -145.76 0.16 Allowed 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 -173.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -69.05 -92.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.098 1.759 . . . . 0.0 109.96 -176.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -105.05 168.69 8.89 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.334 1.453 . . . . 0.0 109.136 168.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.2 p -82.51 169.61 16.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.654 1.582 . . . . 0.0 110.804 170.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -84.51 175.17 9.47 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.91 0.884 . . . . 0.0 111.687 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.8 t -61.71 -30.85 71.03 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.684 1.194 . . . . 0.0 112.832 -176.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.79 45.78 0.96 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.048 0.939 . . . . 0.0 110.196 -174.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -130.69 124.31 31.28 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.134 1.374 . . . . 0.0 108.844 170.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -106.27 -32.06 8.35 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 125.943 1.697 . . . . 0.0 110.133 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.1 p -99.55 57.61 1.03 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.283 1.433 . . . . 0.0 107.843 -175.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.3 t -106.97 131.49 53.98 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.1 -1.864 . . . . 0.0 108.717 -172.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.3 tp -155.48 141.92 18.64 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -172.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 m -120.08 151.57 38.84 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.251 1.02 . . . . 0.0 110.472 -173.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -85.19 154.18 22.16 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 -176.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.7 mtm105 -91.59 11.83 22.97 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.449 1.1 . . . . 0.0 111.498 176.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -72.5 178.94 3.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.586 1.154 . . . . 0.0 109.919 175.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -123.99 118.71 26.8 Favored Pre-proline 0 CA--C 1.532 0.27 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -75.03 143.58 78.24 Favored 'Cis proline' 0 CA--C 1.539 0.739 0 CA-C-N 119.664 0.916 . . . . 0.0 110.932 2.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -77.09 106.45 2.25 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.453 2.768 . . . . 0.0 109.122 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -110.74 150.42 29.1 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.926 1.29 . . . . 0.0 109.758 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -108.83 147.76 31.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.92 167.32 17.57 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.334 1.854 . . . . 0.0 109.13 -178.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 44.7 t -135.84 135.37 39.75 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.506 1.122 . . . . 0.0 110.449 174.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -112.97 42.25 1.92 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.621 1.568 . . . . 0.0 110.624 -173.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -62.75 158.24 19.14 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -174.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 30.3 mm -133.65 104.05 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 176.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.5 p -138.23 152.13 48.3 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.082 0.553 . . . . 0.0 109.879 175.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -66.65 -41.11 88.73 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.934 0.494 . . . . 0.0 110.242 172.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -88.8 -173.46 4.12 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.532 1.133 . . . . 0.0 109.447 172.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 6.6 t -156.58 159.65 38.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.768 0.827 . . . . 0.0 109.468 165.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -74.85 148.81 85.16 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 123.61 0.764 . . . . 0.0 109.527 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.28 171.32 16.29 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.133 2.556 . . . . 0.0 111.229 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.26 131.86 46.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.467 1.107 . . . . 0.0 111.737 -177.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -81.01 177.91 8.76 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.108 174.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.1 p . . . . . 0 C--O 1.252 1.191 0 CA-C-O 117.278 -1.344 . . . . 0.0 108.704 168.307 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 70.1 p . . . . . 0 N--CA 1.475 0.822 0 CA-C-O 119.655 -0.212 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -73.1 96.32 2.18 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 175.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.6 t -158.27 143.87 16.83 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.067 0.947 . . . . 0.0 109.306 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.0 t -165.3 143.09 6.01 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.516 1.126 . . . . 0.0 109.327 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 11.6 t -165.96 43.36 0.07 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.712 1.205 . . . . 0.0 109.326 176.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.3 p -70.05 148.86 48.29 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.753 0.821 . . . . 0.0 111.146 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.52 97.78 3.13 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 124.272 1.029 . . . . 0.0 110.175 178.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.2 p -135.12 -176.21 4.18 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.09 0.956 . . . . 0.0 110.542 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 39.1 t -166.33 167.07 16.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.37 1.868 . . . . 0.0 107.313 175.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -113.98 -66.24 1.11 Allowed 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 168.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -80.33 110.42 15.76 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.292 1.037 . . . . 0.0 109.959 178.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.1 m -117.35 69.74 5.79 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 124.869 1.267 . . . . 0.0 111.055 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -76.81 162.4 32.5 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.083 1.856 . . . . 0.0 110.634 171.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 43.8 t -154.28 157.58 38.89 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.113 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.4 p -90.37 157.0 17.84 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.221 1.009 . . . . 0.0 109.066 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.9 mtm105 -106.88 42.59 1.27 Allowed 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.913 0.885 . . . . 0.0 109.823 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 p -96.6 179.77 4.88 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 126.066 1.746 . . . . 0.0 110.153 177.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -131.58 101.68 15.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 124.927 1.291 . . . . 0.0 107.989 -178.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -71.82 156.96 97.34 Favored 'Cis proline' 0 CA--C 1.537 0.642 0 CA-C-N 119.407 0.824 . . . . 0.0 110.615 -1.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -74.66 141.92 28.35 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 123.476 2.784 . . . . 0.0 110.542 174.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -104.77 109.6 21.61 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 171.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 68.4 m -107.21 148.1 29.33 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 125.009 1.324 . . . . 0.0 109.297 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -153.55 163.0 40.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.484 -167.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.1 t -107.77 128.46 54.6 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.651 1.18 . . . . 0.0 108.537 174.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 77.2 p -122.56 6.96 9.48 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.426 0.691 . . . . 0.0 112.385 -172.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -67.05 143.31 56.8 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 119.029 0.831 . . . . 0.0 111.345 179.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.9 t -108.69 126.35 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 125.947 1.699 . . . . 0.0 106.733 -178.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -165.8 -160.52 0.45 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -166.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -72.53 -153.07 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.594 0.758 . . . . 0.0 109.017 168.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -58.85 151.2 22.07 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.514 0.674 . . . . 0.0 112.051 -169.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 p -71.92 148.91 45.59 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.228 1.411 . . . . 0.0 111.037 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.2 p80 -75.02 170.75 15.39 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.459 -0.791 . . . . 0.0 113.097 -169.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.5 t -60.45 -31.83 70.81 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.774 1.23 . . . . 0.0 112.355 -174.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.39 36.59 2.55 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.993 0.917 . . . . 0.0 111.118 -177.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 48.7 t -114.56 136.2 53.29 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 125.409 1.483 . . . . 0.0 107.832 174.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -105.84 -54.91 2.4 Favored 'General case' 0 CA--C 1.522 -0.097 0 C-N-CA 124.116 0.966 . . . . 0.0 109.684 -168.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.3 t -105.35 137.1 43.69 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 107.381 -1.341 . . . . 0.0 107.381 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.6 t -154.42 143.71 21.29 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.167 0.987 . . . . 0.0 109.164 -168.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 64.6 tp -152.41 151.75 31.18 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 124.458 1.103 . . . . 0.0 108.874 -175.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.2 m -130.28 163.95 25.65 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.874 0.87 . . . . 0.0 110.866 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.8 p -84.25 156.99 21.73 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.84 0.856 . . . . 0.0 110.39 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.5 ptt180 -93.46 12.82 23.69 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.342 1.057 . . . . 0.0 111.753 174.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.3 p -77.35 -179.96 6.05 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 124.467 1.107 . . . . 0.0 111.687 -177.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -130.24 106.71 16.21 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.784 1.234 . . . . 0.0 108.391 174.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.66 152.84 96.76 Favored 'Cis proline' 0 N--CA 1.456 -0.7 0 CA-C-N 119.513 0.862 . . . . 0.0 110.862 1.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.16 153.83 46.45 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.184 2.589 . . . . 0.0 108.713 170.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -148.58 135.81 20.24 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -174.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 74.8 m -107.3 157.45 17.92 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.067 0.947 . . . . 0.0 111.32 -168.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 19.8 ttp-105 -154.23 153.13 31.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.916 1.286 . . . . 0.0 108.879 -171.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.7 m -89.43 152.41 21.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.584 1.154 . . . . 0.0 110.754 173.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -130.41 21.93 5.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.109 1.764 . . . . 0.0 109.384 170.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -67.48 124.75 24.06 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.022 1.329 . . . . 0.0 109.796 -177.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 32.3 mm -107.84 122.05 61.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.9 p -139.41 179.46 6.53 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.264 1.426 . . . . 0.0 108.662 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -78.57 -9.64 59.43 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.967 -0.458 . . . . 0.0 111.431 172.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -138.02 -170.22 2.74 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.94 1.696 . . . . 0.0 110.34 -170.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 35.4 t -154.51 153.11 30.94 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.353 1.461 . . . . 0.0 108.506 171.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -78.9 151.59 76.5 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.975 0.91 . . . . 0.0 110.44 -176.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -70.13 173.47 11.25 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.053 2.502 . . . . 0.0 112.062 -173.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.1 p -59.28 133.59 56.24 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.115 0.966 . . . . 0.0 112.413 -174.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.84 176.29 8.18 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.341 -1.299 . . . . 0.0 110.903 178.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 59.2 p . . . . . 0 C--O 1.251 1.141 0 CA-C-O 117.15 -1.405 . . . . 0.0 108.961 168.641 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 76.1 p . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 119.944 -0.074 . . . . 0.0 110.806 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -67.77 169.83 8.96 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 171.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 72.7 p -59.5 -175.67 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.706 1.202 . . . . 0.0 111.176 164.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.8 p -76.73 -149.93 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.227 1.011 . . . . 0.0 109.994 177.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.0 t -78.85 55.68 1.77 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.582 1.153 . . . . 0.0 111.258 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 65.5 p -71.6 175.58 5.49 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.002 1.321 . . . . 0.0 110.393 174.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.91 115.4 2.37 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.773 0.829 . . . . 0.0 110.109 174.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.0 p -149.65 -171.34 3.87 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 123.779 0.831 . . . . 0.0 110.07 -170.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 t -169.96 -177.34 2.57 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.101 1.76 . . . . 0.0 106.906 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -108.42 -52.65 2.74 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 171.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -147.89 146.64 29.13 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.302 1.041 . . . . 0.0 108.601 162.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -136.03 96.34 12.98 Favored Pre-proline 0 N--CA 1.448 -0.541 0 C-N-CA 124.916 1.286 . . . . 0.0 111.139 -175.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.01 166.68 28.68 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.578 2.185 . . . . 0.0 110.819 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.4 m -128.71 153.44 47.33 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.213 1.005 . . . . 0.0 110.215 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.4 p -84.31 158.78 21.08 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.834 1.653 . . . . 0.0 108.998 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 42.1 mtm105 -106.13 36.71 2.48 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.083 0.953 . . . . 0.0 109.825 -177.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -90.83 178.04 6.15 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.786 1.634 . . . . 0.0 110.124 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.9 tp -131.18 98.68 18.46 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 125.481 1.513 . . . . 0.0 108.849 -175.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -73.95 154.96 99.87 Favored 'Cis proline' 0 CA--C 1.536 0.622 0 CA-C-N 119.693 0.926 . . . . 0.0 111.126 0.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -78.82 140.25 16.17 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 123.54 2.826 . . . . 0.0 109.924 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -107.24 159.15 16.56 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.696 1.198 . . . . 0.0 108.833 173.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 72.8 m -132.12 142.53 49.53 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.9 1.28 . . . . 0.0 109.132 179.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -143.8 174.25 10.98 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.211 1.004 . . . . 0.0 108.605 -173.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.1 m -102.68 150.89 22.99 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 174.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.6 t -104.68 -9.52 18.14 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.366 163.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -55.92 149.7 14.64 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.986 1.314 . . . . 0.0 112.313 173.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.6 t -144.23 147.15 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 127.763 2.425 . . . . 0.0 105.914 174.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -155.19 -152.41 0.4 Allowed 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 -173.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -78.9 -116.3 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 155.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -68.53 158.27 34.22 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.894 1.225 . . . . 0.0 111.855 -178.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 4.1 p -82.59 163.3 21.55 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.49 1.916 . . . . 0.0 110.754 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.406 ' HD1' ' H ' ' A' ' 34' ' ' ALA . 33.5 p80 -71.22 168.05 18.1 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -167.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.4 t -52.02 -37.85 54.87 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.871 1.668 . . . . 0.0 112.634 -173.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.406 ' H ' ' HD1' ' A' ' 32' ' ' HIS . . . -107.35 24.77 12.34 Favored 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 124.367 1.067 . . . . 0.0 112.513 -175.357 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.9 t -91.21 127.46 36.65 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 175.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 tttp -104.85 -45.25 4.62 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.573 0.749 . . . . 0.0 110.452 -172.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.5 t -104.67 129.55 52.82 Favored 'General case' 0 CA--C 1.523 -0.085 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 172.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.6 t -150.38 140.66 22.26 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.006 0.922 . . . . 0.0 108.634 -168.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 22.4 tp -153.38 158.97 42.27 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.875 0.87 . . . . 0.0 109.436 -169.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 24.6 m -123.74 165.98 16.35 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.344 0.657 . . . . 0.0 111.102 -175.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -93.18 150.67 20.33 Favored 'General case' 0 C--N 1.341 0.221 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 169.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -91.69 15.24 13.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.54 1.136 . . . . 0.0 111.922 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -67.2 172.36 4.79 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 123.86 0.864 . . . . 0.0 110.593 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -121.07 110.32 34.75 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 172.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -74.21 152.7 98.56 Favored 'Cis proline' 0 CA--C 1.54 0.816 0 CA-C-N 119.592 0.89 . . . . 0.0 110.775 -0.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -82.01 131.76 7.07 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 124.148 3.232 . . . . 0.0 109.942 173.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -113.4 152.01 30.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.611 1.565 . . . . 0.0 108.063 174.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 92.1 m -113.53 154.4 27.17 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.606 0.762 . . . . 0.0 110.931 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.4 mtm105 -147.79 147.26 29.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.305 1.042 . . . . 0.0 109.448 -155.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 43.2 t -84.67 136.72 33.62 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 172.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -106.62 -23.59 12.4 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.109 1.364 . . . . 0.0 110.585 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -47.66 143.69 3.69 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 126.045 1.738 . . . . 0.0 113.26 -172.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.0 mm -106.37 127.92 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 C-N-CA 125.122 1.369 . . . . 0.0 107.327 -176.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.1 p -126.99 173.1 9.91 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.538 0.735 . . . . 0.0 109.476 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -88.99 -9.6 50.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.633 0.773 . . . . 0.0 111.328 174.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -133.75 173.28 11.7 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 125.43 1.492 . . . . 0.0 110.95 -174.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.1 t -110.12 137.06 48.38 Favored 'General case' 0 N--CA 1.458 -0.07 0 C-N-CA 125.853 1.661 . . . . 0.0 108.86 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -75.29 157.97 84.31 Favored Pre-proline 0 N--CA 1.449 -0.49 0 C-N-CA 126.635 1.974 . . . . 0.0 109.881 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -67.59 158.11 58.67 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 122.071 1.847 . . . . 0.0 109.817 170.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.0 p -67.41 149.27 50.49 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 120.937 0.399 . . . . 0.0 111.21 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.33 -170.12 2.03 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.548 1.139 . . . . 0.0 110.6 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.9 m . . . . . 0 C--O 1.25 1.111 0 CA-C-O 116.72 -1.61 . . . . 0.0 109.833 165.725 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.0 t . . . . . 0 N--CA 1.474 0.755 0 CA-C-O 121.196 0.522 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -162.13 160.74 27.64 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.457 1.103 . . . . 0.0 109.148 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 80.6 p -122.31 172.01 8.62 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.002 1.321 . . . . 0.0 109.81 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.3 t -150.2 137.91 19.96 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.665 0.786 . . . . 0.0 109.342 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.3 t -163.74 46.89 0.12 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.607 1.563 . . . . 0.0 107.929 177.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 82.8 p -82.34 174.21 11.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.106 0.962 . . . . 0.0 111.591 -168.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.95 119.48 5.09 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.898 0.879 . . . . 0.0 109.323 168.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.7 p -143.63 164.86 29.21 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.439 0.638 . . . . 0.0 112.001 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 53.3 t -174.32 143.53 0.87 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.869 -166.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -104.8 -65.99 1.0 Allowed 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.743 0.817 . . . . 0.0 108.915 -174.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -85.81 107.79 17.81 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 26.5 p -124.26 61.11 25.83 Favored Pre-proline 0 CA--C 1.535 0.396 0 C-N-CA 124.914 1.286 . . . . 0.0 111.292 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -71.56 159.73 50.39 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.561 2.174 . . . . 0.0 111.042 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 24.9 m -129.19 157.4 41.92 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.035 0.934 . . . . 0.0 110.263 178.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.6 p -73.82 173.03 10.46 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.488 0.715 . . . . 0.0 110.289 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -106.05 10.67 32.09 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.663 1.185 . . . . 0.0 111.61 176.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 p -73.58 172.72 10.84 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 124.264 1.026 . . . . 0.0 111.681 179.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.8 tp -128.79 100.09 21.87 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 126.012 1.725 . . . . 0.0 108.727 -177.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.92 158.48 96.35 Favored 'Cis proline' 0 CA--C 1.534 0.51 0 CA-C-N 119.68 0.921 . . . . 0.0 111.616 0.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.79 145.99 14.6 Favored 'Trans proline' 0 N--CA 1.451 -0.978 0 C-N-CA 123.305 2.67 . . . . 0.0 110.236 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -113.71 131.54 56.14 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.029 1.731 . . . . 0.0 106.739 175.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 88.7 m -105.5 144.2 32.6 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 123.724 0.81 . . . . 0.0 108.866 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -143.58 159.71 41.95 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.137 0.975 . . . . 0.0 108.763 -171.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 18.2 m -107.35 121.24 44.17 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.671 0.788 . . . . 0.0 109.317 178.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 70.8 p -107.9 22.85 15.36 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.419 1.087 . . . . 0.0 109.948 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -76.13 148.61 37.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 170.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.2 t -143.1 127.4 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 125.102 1.361 . . . . 0.0 107.787 -173.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -165.25 -156.06 0.27 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.227 0.611 . . . . 0.0 109.48 -173.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -57.69 -81.01 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.109 0.964 . . . . 0.0 110.664 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -116.12 169.86 8.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.297 1.439 . . . . 0.0 111.712 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 p -96.54 159.31 15.0 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.838 2.055 . . . . 0.0 111.424 177.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -88.47 172.29 9.46 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.021 0.928 . . . . 0.0 113.47 -170.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.4 t -51.93 -39.51 59.29 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.975 1.71 . . . . 0.0 112.797 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.81 42.79 1.34 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.176 0.991 . . . . 0.0 110.871 -174.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 51.1 t -123.26 119.8 31.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 173.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -102.51 -40.76 6.53 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.837 1.255 . . . . 0.0 110.188 -165.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.9 t -104.11 118.72 37.33 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 170.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.3 t -144.98 133.06 21.42 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.903 1.681 . . . . 0.0 107.322 -175.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.2 tt -153.68 140.44 19.05 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -172.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.4 m -118.87 159.67 23.33 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.437 1.095 . . . . 0.0 111.311 -169.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.6 t -78.83 148.15 32.97 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 29.6 ptt-85 -93.81 41.06 1.08 Allowed 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.881 1.272 . . . . 0.0 110.447 -175.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 t -163.23 -160.8 0.63 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.334 0.654 . . . . 0.0 110.056 -174.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -107.79 131.62 21.6 Favored Pre-proline 0 N--CA 1.442 -0.867 0 C-N-CA 127.124 2.169 . . . . 0.0 108.648 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -73.53 145.96 85.55 Favored 'Cis proline' 0 N--CA 1.456 -0.71 0 N-CA-C 109.283 -1.084 . . . . 0.0 109.283 -4.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -77.71 84.36 1.99 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.115 2.543 . . . . 0.0 108.953 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -107.2 145.99 31.94 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.485 1.514 . . . . 0.0 108.547 -177.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -116.13 148.19 40.57 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.422 0.629 . . . . 0.0 112.486 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 27.8 mtm-85 -119.67 156.64 30.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.956 1.702 . . . . 0.0 109.16 -175.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 1.7 m -100.11 160.23 14.48 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.989 0.916 . . . . 0.0 109.328 165.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -154.04 27.53 0.47 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.292 1.037 . . . . 0.0 109.688 175.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -73.26 153.07 40.76 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 123.813 0.845 . . . . 0.0 110.544 -176.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.0 mm -106.47 132.48 53.57 Favored 'Isoleucine or valine' 0 C--N 1.34 0.18 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -176.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 56.4 p -144.1 -165.19 2.06 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.443 1.497 . . . . 0.0 108.238 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -134.87 18.58 3.5 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.245 1.018 . . . . 0.0 110.609 172.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -156.5 178.61 10.12 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.365 1.466 . . . . 0.0 110.215 -173.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.0 t -111.21 148.2 33.33 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.843 1.257 . . . . 0.0 109.97 178.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -97.75 151.99 37.88 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.394 1.478 . . . . 0.0 108.79 172.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -64.59 163.67 26.47 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.222 2.615 . . . . 0.0 111.714 -176.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.2 p -57.33 139.14 53.77 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.038 0.935 . . . . 0.0 112.555 -175.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.96 -177.63 3.69 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 124.453 1.101 . . . . 0.0 112.085 -173.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 71.1 p . . . . . 0 C--O 1.25 1.086 0 CA-C-O 116.962 -1.494 . . . . 0.0 110.91 176.204 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 39.3 p . . . . . 0 N--CA 1.473 0.719 0 CA-C-O 120.247 0.07 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.6 tpmt? -80.51 63.67 5.04 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.443 1.097 . . . . 0.0 108.162 174.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.9 m -133.35 61.96 1.67 Allowed 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.457 1.103 . . . . 0.0 109.219 -174.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.9 t -156.18 159.2 38.76 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.305 1.042 . . . . 0.0 108.987 177.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.0 t 1.41 77.46 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 129.149 2.979 . . . . 0.0 114.39 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 48.0 p -70.66 156.77 39.04 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.965 0.906 . . . . 0.0 110.205 -178.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.52 121.84 13.73 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.922 0.489 . . . . 0.0 110.721 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.3 p -149.21 173.15 13.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.679 0.752 . . . . 0.0 111.768 -175.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 t -170.23 152.41 4.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 126.323 1.849 . . . . 0.0 108.219 -174.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -105.14 -66.86 0.95 Allowed 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 -177.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -93.19 104.24 16.44 Favored 'General case' 0 C--N 1.344 0.337 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 21.4 p -119.93 64.32 9.26 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 126.916 2.086 . . . . 0.0 110.764 -174.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -67.3 156.65 65.32 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.517 2.144 . . . . 0.0 111.817 -177.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 63.4 m -130.33 159.32 37.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.471 1.108 . . . . 0.0 109.99 178.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 81.9 p -89.27 172.17 9.24 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.421 1.489 . . . . 0.0 110.245 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 33.0 ptt-85 -107.47 -1.59 21.26 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.132 1.373 . . . . 0.0 112.436 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.7 p -71.36 179.37 2.96 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.516 1.526 . . . . 0.0 111.315 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.0 mm -128.46 117.57 20.01 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 124.973 1.309 . . . . 0.0 108.548 -177.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -69.91 146.57 82.88 Favored 'Cis proline' 0 N--CA 1.456 -0.689 0 N-CA-C 109.525 -0.991 . . . . 0.0 109.525 -5.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -72.16 125.97 11.33 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.703 2.269 . . . . 0.0 109.024 178.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.33 151.36 24.26 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.233 1.013 . . . . 0.0 109.224 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.7 m -127.66 145.84 50.75 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.466 1.507 . . . . 0.0 109.809 -177.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -150.52 163.96 37.16 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.545 1.538 . . . . 0.0 108.287 -171.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 68.7 m -107.68 141.68 38.82 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.548 0.739 . . . . 0.0 110.097 171.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.0 t -107.53 -12.03 15.36 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.462 -172.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.67 146.91 51.03 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.812 0.845 . . . . 0.0 110.452 -176.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 85.0 t -110.35 126.04 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 174.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.75 -166.25 2.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.922 0.889 . . . . 0.0 111.515 -171.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -71.69 -136.94 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 165.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -63.03 157.17 22.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 120.633 -1.292 . . . . 0.0 112.347 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.1 m -75.45 166.55 23.42 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.147 175.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -88.3 171.18 10.36 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.704 0.802 . . . . 0.0 112.916 -173.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.6 t -63.52 -24.39 67.8 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.073 1.349 . . . . 0.0 113.102 -175.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -103.7 34.59 2.93 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.225 1.01 . . . . 0.0 110.781 178.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.8 t -119.59 126.59 51.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.563 1.145 . . . . 0.0 108.309 175.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -105.84 -38.93 6.2 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.753 1.221 . . . . 0.0 109.923 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.1 t -106.38 113.82 27.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 174.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.8 t -128.9 137.96 51.73 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 126.293 1.837 . . . . 0.0 107.249 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -143.02 152.16 41.61 Favored 'General case' 0 N--CA 1.46 0.069 0 C-N-CA 124.328 1.051 . . . . 0.0 108.634 -174.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.8 m -137.75 157.08 47.2 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.802 0.841 . . . . 0.0 110.459 -173.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.8 t -91.87 151.87 20.35 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 123.406 0.441 . . . . 0.0 109.886 178.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.4 ptt-85 -97.32 19.04 13.81 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.709 1.204 . . . . 0.0 111.557 177.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -69.05 178.33 2.3 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 124.275 1.03 . . . . 0.0 110.563 170.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -123.56 117.09 27.82 Favored Pre-proline 0 CA--C 1.533 0.313 0 C-N-CA 124.071 0.948 . . . . 0.0 109.222 175.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -71.78 151.12 95.28 Favored 'Cis proline' 0 CA--C 1.54 0.804 0 CA-C-N 119.587 0.888 . . . . 0.0 110.287 -5.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -83.29 127.11 4.43 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.95 3.1 . . . . 0.0 110.244 175.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -115.95 161.48 18.77 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.761 1.224 . . . . 0.0 108.93 174.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 99.5 m -112.56 169.52 8.83 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.46 1.104 . . . . 0.0 110.618 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.1 ttp85 -159.53 146.83 16.91 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.192 1.397 . . . . 0.0 108.54 -174.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 49.9 t -89.97 124.0 34.36 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.742 0.817 . . . . 0.0 109.25 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.67 10.37 29.0 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.903 1.681 . . . . 0.0 110.571 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -67.72 145.63 54.57 Favored 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.707 -0.62 . . . . 0.0 110.635 -175.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 49.0 mm -107.45 133.85 50.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 124.497 1.119 . . . . 0.0 108.97 -169.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.2 p -141.99 -178.14 5.55 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.722 1.209 . . . . 0.0 109.551 -177.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -107.86 -5.33 17.29 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.95 1.3 . . . . 0.0 110.985 169.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -133.42 -173.19 3.15 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.982 1.713 . . . . 0.0 110.364 -168.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.7 t -121.33 146.3 47.0 Favored 'General case' 0 CA--C 1.527 0.061 0 C-N-CA 125.628 1.571 . . . . 0.0 109.207 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -78.57 160.58 72.08 Favored Pre-proline 0 N--CA 1.452 -0.349 0 C-N-CA 124.476 1.11 . . . . 0.0 108.953 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -60.0 159.7 24.76 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.392 2.061 . . . . 0.0 110.651 174.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.3 p -62.44 138.18 58.41 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 122.796 0.438 . . . . 0.0 111.017 -177.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.11 -172.82 2.35 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 124.529 1.131 . . . . 0.0 109.592 177.709 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.449 -1.262 . . . . 0.0 110.093 177.004 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 72.7 p . . . . . 0 N--CA 1.474 0.772 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -61.04 107.06 0.67 Allowed 'General case' 0 C--N 1.343 0.294 0 C-N-CA 123.483 0.713 . . . . 0.0 109.858 -178.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 80.9 p -86.57 -175.87 5.61 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.825 1.25 . . . . 0.0 110.832 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.1 t -66.31 171.06 5.15 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.627 161.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.3 t 3.49 83.51 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 128.662 2.785 . . . . 0.0 114.189 -170.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 76.7 p -69.43 178.06 2.61 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.959 1.304 . . . . 0.0 110.961 -177.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.27 114.39 2.88 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.827 178.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.7 p -140.26 -170.39 2.97 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.459 1.104 . . . . 0.0 109.219 -170.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.1 t -173.58 170.99 3.97 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.387 1.875 . . . . 0.0 106.434 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -108.22 -60.74 1.68 Allowed 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 166.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -119.2 109.74 16.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.265 1.026 . . . . 0.0 109.046 -177.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.86 89.21 47.96 Favored Pre-proline 0 N--CA 1.452 -0.366 0 C-N-CA 124.596 1.158 . . . . 0.0 111.979 176.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.31 171.57 14.81 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.122 1.881 . . . . 0.0 110.859 169.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.8 m -133.17 156.54 47.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.379 1.072 . . . . 0.0 109.692 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 36.8 p -88.08 162.94 16.5 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.742 1.217 . . . . 0.0 109.611 178.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -106.47 35.24 3.03 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.31 1.044 . . . . 0.0 110.045 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 p -90.21 179.27 5.95 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.592 1.557 . . . . 0.0 110.327 175.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.37 106.21 17.55 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.954 1.302 . . . . 0.0 108.33 -178.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.37 156.78 96.62 Favored 'Cis proline' 0 CA--C 1.535 0.531 0 CA-C-N 119.618 0.899 . . . . 0.0 109.835 -4.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.05 139.95 19.64 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.657 2.238 . . . . 0.0 110.072 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -107.78 132.9 52.9 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.817 1.247 . . . . 0.0 108.107 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 79.2 m -108.07 143.97 36.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.452 1.101 . . . . 0.0 109.423 172.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -157.01 170.22 23.04 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.006 0.922 . . . . 0.0 109.365 -173.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 89.3 m -104.27 143.96 32.26 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.694 0.798 . . . . 0.0 109.877 -177.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 11.3 t -115.32 -16.69 11.44 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.682 1.193 . . . . 0.0 111.212 177.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.08 155.45 31.33 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 121.289 0.566 . . . . 0.0 111.158 -178.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.7 t -122.64 143.03 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 125.994 1.717 . . . . 0.0 107.92 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.6 tpp180 -161.67 -145.2 0.11 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.958 1.303 . . . . 0.0 107.902 -174.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -91.79 -130.84 0.11 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 125.021 1.329 . . . . 0.0 108.301 167.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -65.63 171.85 3.85 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.594 1.158 . . . . 0.0 114.086 -165.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -71.18 151.1 44.7 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.01 1.324 . . . . 0.0 109.69 179.38 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.3 p80 -81.9 -178.84 7.16 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 121.495 0.664 . . . . 0.0 112.073 173.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 t -78.44 23.95 0.29 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.311 1.045 . . . . 0.0 113.167 -172.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -160.38 69.35 0.38 Allowed 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.599 0.636 . . . . 0.0 109.866 172.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 94.1 m -124.89 124.77 42.78 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.852 0.861 . . . . 0.0 110.044 -176.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 tmtp? -105.7 -30.68 9.3 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.882 1.673 . . . . 0.0 108.75 176.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.4 t -118.86 131.46 56.07 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.438 1.495 . . . . 0.0 108.279 169.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.3 t -154.99 143.52 20.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.078 1.351 . . . . 0.0 108.376 177.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.1 tp -152.47 170.21 20.69 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 122.986 0.515 . . . . 0.0 110.069 -172.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 65.4 m -134.37 163.76 28.95 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.128 0.971 . . . . 0.0 110.598 172.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.8 p -79.68 148.94 31.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.12 0.968 . . . . 0.0 110.186 178.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.3 ptt85 -98.32 52.44 1.03 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.234 1.414 . . . . 0.0 109.122 176.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.3 t -153.39 -163.93 1.79 Allowed 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.448 1.099 . . . . 0.0 109.476 177.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -129.63 129.49 23.15 Favored Pre-proline 0 CA--C 1.533 0.312 0 C-N-CA 125.416 1.486 . . . . 0.0 108.73 -178.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -70.87 147.8 87.82 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 CA-C-N 119.682 0.922 . . . . 0.0 110.592 -0.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -74.45 98.91 1.16 Allowed 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 123.502 2.801 . . . . 0.0 108.721 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -106.55 140.73 38.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.184 1.394 . . . . 0.0 108.49 -173.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 79.1 m -126.11 153.79 44.03 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.472 0.709 . . . . 0.0 111.024 -168.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.73 162.14 36.24 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.419 1.088 . . . . 0.0 110.544 -176.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.9 t -118.68 126.4 51.84 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 125.389 1.475 . . . . 0.0 107.491 172.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -119.78 37.92 4.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.41 1.084 . . . . 0.0 110.194 -168.282 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -62.59 152.12 35.94 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.735 1.214 . . . . 0.0 112.07 -174.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 46.4 mm -108.05 101.96 13.29 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 C-N-CA 124.414 1.086 . . . . 0.0 108.233 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.3 p -113.45 -175.93 2.78 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.893 1.277 . . . . 0.0 108.63 171.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -110.49 11.3 23.11 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.937 0.895 . . . . 0.0 110.631 173.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -148.56 170.1 18.82 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.882 1.673 . . . . 0.0 110.244 -174.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 19.8 t -118.75 138.72 52.47 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 126.003 1.721 . . . . 0.0 108.556 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -82.73 154.94 68.39 Favored Pre-proline 0 N--CA 1.45 -0.466 0 C-N-CA 125.576 1.55 . . . . 0.0 109.79 -177.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -67.13 163.91 32.28 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.622 2.214 . . . . 0.0 110.473 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.3 133.25 53.86 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.413 0.685 . . . . 0.0 112.129 -172.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -79.05 -174.89 4.29 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.714 1.206 . . . . 0.0 110.425 176.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.4 t . . . . . 0 C--O 1.251 1.171 0 CA-C-O 117.105 -1.426 . . . . 0.0 108.598 168.01 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.8 p -122.49 -168.75 1.78 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.425 1.49 . . . . 0.0 109.832 -172.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.1 t -165.99 179.22 5.95 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 170.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -132.71 -74.94 0.5 Allowed 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 170.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -90.33 115.75 27.76 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 171.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 30.0 p -119.96 72.52 17.39 Favored Pre-proline 0 CA--C 1.532 0.285 0 C-N-CA 123.571 0.748 . . . . 0.0 112.277 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -75.55 161.3 37.35 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.638 2.225 . . . . 0.0 110.758 176.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.0 m -139.27 158.48 44.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.206 1.002 . . . . 0.0 110.694 -179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.7 p -77.88 157.06 29.99 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 169.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -106.89 36.47 2.65 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.76 0.824 . . . . 0.0 109.604 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.2 p -86.52 179.46 6.83 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.924 1.69 . . . . 0.0 110.328 175.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -126.16 104.74 25.58 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 125.28 1.432 . . . . 0.0 107.888 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.34 159.06 97.95 Favored 'Cis proline' 0 CA--C 1.536 0.593 0 CA-C-N 119.619 0.9 . . . . 0.0 110.297 -3.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -75.73 142.12 25.36 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.272 2.648 . . . . 0.0 109.885 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.87 126.98 55.69 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.57 1.148 . . . . 0.0 107.976 171.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.3 m -104.82 151.3 23.96 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.668 1.187 . . . . 0.0 109.339 175.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -141.86 -179.58 6.29 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 123.997 0.919 . . . . 0.0 109.866 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 93.3 m -110.83 141.61 43.96 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 167.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.7 p -117.64 34.28 5.22 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 166.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -81.66 149.77 28.38 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.526 0.679 . . . . 0.0 110.259 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.442 HG13 ' HG2' ' A' ' 49' ' ' ARG . 62.6 t -142.7 122.13 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 C-N-CA 126.004 1.722 . . . . 0.0 106.415 -177.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -162.91 -150.25 0.16 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -166.188 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -68.72 -142.96 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 162.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -67.48 158.37 32.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 120.876 -1.14 . . . . 0.0 111.827 -174.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.6 p -74.12 159.2 32.93 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.569 1.548 . . . . 0.0 111.643 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -80.62 177.37 9.06 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -169.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.5 t -78.48 21.59 0.37 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.5 -1.227 . . . . 0.0 113.054 -172.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -155.3 64.34 0.62 Allowed 'General case' 0 C--N 1.341 0.236 0 CA-C-N 118.741 0.7 . . . . 0.0 109.797 173.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 76.5 m -123.79 127.93 48.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.868 0.867 . . . . 0.0 109.327 179.009 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -102.86 -36.52 8.21 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.769 1.628 . . . . 0.0 107.806 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -106.03 114.87 29.28 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 162.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 24.9 t -134.17 132.64 40.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.622 1.569 . . . . 0.0 107.445 169.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.2 tp -157.34 157.3 33.87 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.6 m -122.22 166.17 15.03 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.827 0.851 . . . . 0.0 110.352 -174.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.7 t -89.73 150.25 22.38 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 168.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -82.88 0.93 41.91 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.149 1.38 . . . . 0.0 112.403 177.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 m -69.33 -178.09 1.28 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.036 1.334 . . . . 0.0 111.512 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -120.3 111.05 35.41 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.727 1.211 . . . . 0.0 108.163 175.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -74.36 149.86 94.62 Favored 'Cis proline' 0 N--CA 1.458 -0.611 0 CA-C-N 119.972 1.026 . . . . 0.0 110.611 0.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -75.94 108.58 2.71 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.754 2.303 . . . . 0.0 108.338 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -104.4 140.17 38.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -177.451 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 65.8 m -107.07 151.04 25.89 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 123.843 0.857 . . . . 0.0 109.701 -172.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.442 ' HG2' HG13 ' A' ' 27' ' ' VAL . 10.0 mtm105 -144.86 143.27 30.52 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.528 -1.215 . . . . 0.0 108.668 -156.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 46.5 t -112.05 131.92 55.13 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 124.072 0.949 . . . . 0.0 109.014 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -127.43 37.35 4.25 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.286 1.434 . . . . 0.0 109.942 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -56.33 154.99 7.41 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.242 1.017 . . . . 0.0 111.628 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.7 mm -115.25 111.72 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 171.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.3 p -130.5 163.53 26.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.933 1.293 . . . . 0.0 108.135 173.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -70.02 -21.27 63.22 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.895 -0.503 . . . . 0.0 111.54 174.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -130.55 -179.29 5.19 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.898 1.279 . . . . 0.0 111.911 -165.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.8 t -112.78 147.88 35.97 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.642 1.977 . . . . 0.0 109.992 177.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -97.58 159.37 31.23 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 125.914 1.686 . . . . 0.0 109.566 176.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.2 164.5 22.47 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.284 2.656 . . . . 0.0 112.266 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.22 141.61 58.7 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.469 1.107 . . . . 0.0 112.178 -174.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.135 0 C-N-CA 124.55 1.14 . . . . 0.0 111.81 -178.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.986 0.422 . . . . 0.0 111.371 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.4 p -127.46 -175.77 3.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.436 1.494 . . . . 0.0 109.785 -176.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 46.4 t -172.0 160.55 5.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.642 1.977 . . . . 0.0 107.329 171.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -108.44 -77.01 0.6 Allowed 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 171.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -88.52 111.49 21.9 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.8 p -118.14 67.08 6.34 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 124.749 1.22 . . . . 0.0 111.377 -177.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.93 145.67 56.85 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.624 2.216 . . . . 0.0 110.453 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.1 m -132.46 159.06 40.43 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.049 0.94 . . . . 0.0 110.933 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.0 p -90.04 157.85 17.61 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.648 1.179 . . . . 0.0 108.932 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.5 mtm105 -108.47 35.92 3.01 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.914 0.886 . . . . 0.0 109.515 176.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 76.1 p -89.15 -176.67 5.2 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.902 1.281 . . . . 0.0 110.264 175.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.5 mm -129.71 113.08 17.72 Favored Pre-proline 0 CA--C 1.536 0.41 0 C-N-CA 124.75 1.22 . . . . 0.0 108.842 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.44 151.63 90.79 Favored 'Cis proline' 0 CA--C 1.538 0.679 0 N-CA-C 109.131 -1.142 . . . . 0.0 109.131 -9.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -75.25 132.54 15.21 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.209 2.606 . . . . 0.0 109.417 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.9 137.17 43.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 173.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 54.0 m -107.74 149.85 27.67 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.227 1.411 . . . . 0.0 108.744 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -135.71 172.19 13.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.134 1.374 . . . . 0.0 108.432 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 18.5 m -127.47 134.42 49.83 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 172.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 67.5 p -115.68 24.97 11.12 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.439 1.096 . . . . 0.0 109.953 174.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -70.82 150.38 45.89 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 123.514 0.726 . . . . 0.0 109.696 172.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 69.2 t -136.51 126.04 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 126.231 1.812 . . . . 0.0 106.244 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.06 -156.37 0.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 -165.564 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -78.67 -137.89 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.934 1.294 . . . . 0.0 108.438 175.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -63.38 161.82 13.47 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.12 0.873 . . . . 0.0 111.758 -176.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 m -76.11 152.26 36.81 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.368 1.467 . . . . 0.0 108.893 -175.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -76.83 165.82 24.18 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.6 t -49.41 -40.17 35.35 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 126.083 1.753 . . . . 0.0 111.851 -179.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.29 32.21 4.82 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 124.267 1.027 . . . . 0.0 111.742 -177.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 20.4 t -99.69 126.46 45.73 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.637 0.775 . . . . 0.0 109.196 176.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.9 tttm -106.55 -45.36 4.26 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.017 0.927 . . . . 0.0 110.75 -174.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 t -105.28 126.06 51.67 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 172.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.2 t -147.78 142.1 26.27 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.531 1.133 . . . . 0.0 108.172 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.3 tp -148.2 151.77 36.08 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.0 m -126.27 166.18 17.59 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.917 0.887 . . . . 0.0 110.837 -172.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.7 p -83.47 153.52 24.41 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.287 0.635 . . . . 0.0 109.59 171.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -87.55 15.14 7.05 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.675 0.79 . . . . 0.0 111.859 172.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 80.0 p -76.97 -176.45 3.96 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.337 1.055 . . . . 0.0 111.6 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -134.93 114.67 11.92 Favored Pre-proline 0 N--CA 1.451 -0.411 0 C-N-CA 125.007 1.323 . . . . 0.0 108.86 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.06 142.46 72.94 Favored 'Cis proline' 0 N--CA 1.457 -0.659 0 CA-C-N 119.655 0.912 . . . . 0.0 110.033 -1.343 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.26 125.56 11.48 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.925 2.417 . . . . 0.0 109.097 177.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 30.8 mm100 -106.28 129.85 54.23 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 62.4 m -106.21 149.38 26.9 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.827 0.851 . . . . 0.0 109.325 -175.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.2 mtm105 -142.56 120.79 12.25 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 -160.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 48.4 t -83.8 124.96 31.47 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -178.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -117.97 26.57 9.57 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.266 1.426 . . . . 0.0 111.386 -179.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -57.71 147.2 28.51 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.572 0.749 . . . . 0.0 110.164 -178.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.3 mm -102.32 130.91 51.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 106.198 -1.779 . . . . 0.0 106.198 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 35.5 p -139.81 -171.56 3.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.99 1.316 . . . . 0.0 108.15 -170.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -128.66 15.53 6.47 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.493 1.117 . . . . 0.0 109.922 172.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -159.02 176.91 11.71 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.031 1.333 . . . . 0.0 110.394 -165.162 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.0 t -123.42 144.81 49.25 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 125.269 1.427 . . . . 0.0 109.63 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -92.51 157.41 40.21 Favored Pre-proline 0 N--CA 1.451 -0.389 0 C-N-CA 125.444 1.498 . . . . 0.0 109.367 175.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.37 162.73 29.3 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.967 2.445 . . . . 0.0 110.789 174.292 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.08 138.64 58.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 123.825 0.85 . . . . 0.0 112.128 -172.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.529 0.146 0 C-N-CA 123.624 0.77 . . . . 0.0 111.359 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.147 0 N-CA-C 110.724 -0.102 . . . . 0.0 110.724 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.1 p -119.89 -179.2 3.84 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 122.099 0.952 . . . . 0.0 111.023 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.5 t -176.4 175.29 1.81 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 128.17 2.588 . . . . 0.0 105.516 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -142.84 -62.99 0.42 Allowed 'General case' 0 CA--C 1.527 0.083 0 CA-C-N 119.446 1.021 . . . . 0.0 108.833 164.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -90.86 104.78 17.33 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.373 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.3 p -118.04 75.01 10.61 Favored Pre-proline 0 CA--C 1.532 0.271 0 C-N-CA 124.852 1.261 . . . . 0.0 111.694 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.42 156.58 65.56 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.707 2.272 . . . . 0.0 110.662 170.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.5 m -142.67 166.2 25.3 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.059 0.944 . . . . 0.0 111.164 -172.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.9 p -82.74 162.0 21.89 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.163 0.985 . . . . 0.0 109.243 166.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -108.24 36.86 2.65 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.884 0.874 . . . . 0.0 109.59 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.7 p -85.15 -177.15 6.45 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.416 1.086 . . . . 0.0 111.018 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.3 tp -123.57 96.65 43.21 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 125.828 1.651 . . . . 0.0 109.474 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.02 163.47 89.38 Favored 'Cis proline' 0 CA--C 1.535 0.558 0 CA-C-N 119.747 0.945 . . . . 0.0 110.549 -3.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -76.89 149.17 28.96 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 123.371 2.714 . . . . 0.0 110.165 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -125.14 133.77 52.69 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.283 1.433 . . . . 0.0 108.413 175.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 77.7 m -109.89 152.73 25.43 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.308 1.443 . . . . 0.0 110.278 176.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -139.42 152.61 47.21 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.136 0.975 . . . . 0.0 108.894 172.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 23.4 m -103.45 118.0 35.74 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 125.03 1.332 . . . . 0.0 107.664 -176.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 50.5 p -107.89 15.95 23.97 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.46 1.104 . . . . 0.0 111.829 -164.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -65.31 152.59 43.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.022 0.439 . . . . 0.0 109.919 167.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.5 t -132.73 119.09 36.63 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.114 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 -176.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.1 mmm-85 -158.79 -162.93 1.16 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.597 1.159 . . . . 0.0 108.857 -162.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.99 -144.92 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.041 0.936 . . . . 0.0 109.082 170.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -61.85 154.62 25.49 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 121.299 -0.876 . . . . 0.0 110.755 -174.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 96.4 m -78.22 168.8 19.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.982 0.913 . . . . 0.0 110.621 -174.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.0 p80 -86.27 171.75 11.0 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.679 0.752 . . . . 0.0 112.818 -175.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.6 t -57.55 -34.42 69.15 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.52 1.528 . . . . 0.0 112.697 -176.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -105.96 44.59 1.03 Allowed 'General case' 0 C--N 1.338 0.096 0 C-N-CA 124.068 0.947 . . . . 0.0 109.723 -175.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 15.9 t -147.57 114.89 6.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -104.6 -36.63 7.42 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.756 1.223 . . . . 0.0 110.549 -162.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.9 t -102.66 108.89 20.31 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 171.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 44.3 t -118.27 129.19 55.32 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.647 1.979 . . . . 0.0 106.833 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -135.02 147.97 49.81 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 125.074 1.349 . . . . 0.0 108.056 -171.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 m -135.44 157.53 46.66 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.371 0.668 . . . . 0.0 110.832 -173.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -84.74 154.37 22.46 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.173 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -90.31 10.74 23.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.693 1.197 . . . . 0.0 111.971 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -70.78 -179.35 2.17 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.681 1.192 . . . . 0.0 111.058 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -120.55 115.17 32.57 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.463 1.105 . . . . 0.0 108.22 171.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -71.97 151.64 96.02 Favored 'Cis proline' 0 N--CA 1.456 -0.681 0 CA-C-N 119.627 0.902 . . . . 0.0 110.04 -2.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -72.25 137.29 28.3 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.458 2.105 . . . . 0.0 107.923 167.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -149.83 145.43 26.57 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -171.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 72.5 m -111.46 162.76 14.75 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.627 0.771 . . . . 0.0 112.658 -161.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 ttp85 -152.44 154.7 36.06 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 127.199 2.2 . . . . 0.0 108.292 -167.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 8.8 m -89.05 125.73 35.13 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.026 0.93 . . . . 0.0 110.23 173.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -105.91 20.33 19.11 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.885 1.274 . . . . 0.0 109.439 169.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -84.25 149.81 25.86 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.702 1.201 . . . . 0.0 109.755 -177.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.9 mm -108.74 135.51 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 124.86 1.264 . . . . 0.0 108.488 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.9 p -139.37 151.21 46.15 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 165.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -64.37 -37.25 86.86 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.635 0.374 . . . . 0.0 110.737 170.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.0 p90 -102.43 -172.94 2.22 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.179 1.792 . . . . 0.0 111.142 -172.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 35.2 t -142.35 149.92 40.05 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.451 1.9 . . . . 0.0 108.763 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -91.65 155.9 43.4 Favored Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 124.914 1.285 . . . . 0.0 109.582 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -63.33 159.69 38.57 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.629 2.219 . . . . 0.0 110.578 175.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.1 m -62.31 143.77 56.52 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 121.252 0.549 . . . . 0.0 111.995 -171.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.454 -0.241 0 C-N-CA 124.956 1.303 . . . . 0.0 110.673 -179.17 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.205 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.0 p -135.49 162.99 31.1 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.264 1.026 . . . . 0.0 111.255 178.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.4 t -171.35 142.02 1.64 Allowed 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 125.939 1.696 . . . . 0.0 108.544 -174.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -103.61 -73.02 0.68 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.195 0.998 . . . . 0.0 108.567 -174.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -77.05 108.05 9.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.0 p -132.94 62.65 63.34 Favored Pre-proline 0 N--CA 1.452 -0.339 0 C-N-CA 124.488 1.115 . . . . 0.0 111.497 -173.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.72 159.38 52.98 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.708 2.272 . . . . 0.0 111.031 178.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 24.1 m -131.3 153.98 49.01 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.839 0.856 . . . . 0.0 110.004 177.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.1 p -82.15 164.12 21.49 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.139 1.375 . . . . 0.0 109.691 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -106.81 25.54 11.15 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.188 0.995 . . . . 0.0 110.744 -177.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.5 p -81.97 -179.68 7.49 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.715 1.206 . . . . 0.0 110.432 176.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -126.84 106.38 22.71 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 124.797 1.239 . . . . 0.0 108.188 179.264 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.26 159.31 96.06 Favored 'Cis proline' 0 N--CA 1.458 -0.602 0 CA-C-N 119.373 0.812 . . . . 0.0 110.094 -4.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.0 138.23 22.75 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.869 2.38 . . . . 0.0 109.368 173.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -106.52 135.19 48.47 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 173.002 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.8 m -107.1 143.54 35.09 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.283 1.033 . . . . 0.0 108.876 175.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -146.15 159.26 43.55 Favored 'General case' 0 N--CA 1.457 -0.095 0 C-N-CA 124.175 0.99 . . . . 0.0 108.964 -173.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.0 m -106.26 137.47 44.16 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.851 0.86 . . . . 0.0 109.614 -178.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.1 p -120.57 -12.91 8.84 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.429 1.092 . . . . 0.0 112.041 -174.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -65.36 150.38 48.39 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.481 0.582 . . . . 0.0 110.804 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.7 t -118.02 118.16 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 125.186 1.394 . . . . 0.0 107.907 -170.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -141.67 -166.76 2.28 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.781 1.633 . . . . 0.0 108.676 -171.461 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -77.26 -132.86 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 167.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -60.94 150.54 32.96 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.917 1.235 . . . . 0.0 111.31 -173.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.1 p -87.77 151.8 22.61 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 126.357 1.863 . . . . 0.0 109.831 -176.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.3 p80 -72.9 168.24 19.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -159.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.2 t -51.32 -38.09 51.16 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 126.232 1.813 . . . . 0.0 112.188 -178.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.54 31.3 4.77 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.295 1.038 . . . . 0.0 111.513 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 18.2 t -104.48 128.06 52.32 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.153 0.981 . . . . 0.0 108.806 175.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -107.73 -46.68 3.76 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.473 1.109 . . . . 0.0 110.704 -173.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 t -104.97 131.01 53.02 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 172.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 44.8 t -154.75 145.73 22.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.669 1.188 . . . . 0.0 108.434 -174.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 7.4 tt -148.77 150.22 32.71 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.7 m -127.75 159.17 35.61 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.4 1.08 . . . . 0.0 110.211 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 69.0 p -81.56 155.58 25.65 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.569 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.6 ptt85 -93.47 26.01 3.19 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.304 1.441 . . . . 0.0 110.09 170.373 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.4 m -87.74 178.81 6.63 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.243 1.417 . . . . 0.0 110.66 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -129.19 105.08 17.93 Favored Pre-proline 0 N--CA 1.441 -0.895 0 C-N-CA 126.751 2.021 . . . . 0.0 108.122 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -72.55 155.4 99.01 Favored 'Cis proline' 0 CA--C 1.537 0.653 0 CA-C-N 119.802 0.965 . . . . 0.0 111.054 -1.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -75.84 130.43 12.44 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.604 2.869 . . . . 0.0 109.459 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -121.66 136.64 54.94 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.019 1.328 . . . . 0.0 109.038 -176.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 66.6 m -108.79 156.46 19.6 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.42 1.088 . . . . 0.0 111.556 -172.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -152.85 143.64 22.86 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 124.327 1.051 . . . . 0.0 109.768 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 33.0 t -92.53 121.15 33.69 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 124.928 1.291 . . . . 0.0 109.363 -177.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.07 20.84 18.45 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.874 1.269 . . . . 0.0 111.14 -174.01 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -62.7 150.33 41.39 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.658 0.783 . . . . 0.0 110.964 -175.117 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.1 mm -105.77 126.41 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 70.4 p -136.34 -169.37 2.43 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.01 1.324 . . . . 0.0 108.714 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -128.83 9.03 5.8 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.392 1.477 . . . . 0.0 110.983 173.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -148.9 -176.11 5.21 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 126.008 1.723 . . . . 0.0 109.811 -169.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.4 t -132.11 144.4 50.69 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.714 1.206 . . . . 0.0 109.207 174.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -88.58 160.27 44.98 Favored Pre-proline 0 CA--C 1.534 0.348 0 C-N-CA 125.14 1.376 . . . . 0.0 109.089 174.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -61.23 162.52 19.74 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.185 1.924 . . . . 0.0 111.198 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.61 138.79 33.7 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.929 1.291 . . . . 0.0 112.076 -177.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.071 0 C-N-CA 124.406 1.082 . . . . 0.0 110.347 178.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.107 0 CA-C-O 120.373 0.13 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.6 p -129.73 -176.17 3.83 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 124.844 1.258 . . . . 0.0 109.329 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 49.6 t -171.98 158.22 4.65 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 126.16 1.784 . . . . 0.0 107.447 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -105.67 -60.91 1.56 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -114.8 115.31 26.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.799 1.239 . . . . 0.0 108.54 -177.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 11.0 p -131.81 78.88 69.29 Favored Pre-proline 0 N--CA 1.453 -0.322 0 C-N-CA 125.037 1.335 . . . . 0.0 112.063 -173.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -71.09 161.89 44.47 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.628 2.219 . . . . 0.0 110.919 173.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.0 m -133.03 156.99 46.34 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.382 1.073 . . . . 0.0 109.462 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.1 p -84.5 164.96 18.48 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.098 1.359 . . . . 0.0 110.31 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.7 ptt-85 -108.52 5.49 25.22 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.881 1.272 . . . . 0.0 112.463 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.3 p -73.19 175.99 6.29 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.047 1.339 . . . . 0.0 110.857 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 tp -124.74 115.38 26.65 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 125.001 1.32 . . . . 0.0 108.943 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -70.48 152.23 93.97 Favored 'Cis proline' 0 N--CA 1.458 -0.589 0 CA-C-N 119.798 0.964 . . . . 0.0 109.869 -6.293 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -79.48 136.77 12.64 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.018 2.478 . . . . 0.0 109.779 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.43 149.93 28.08 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.454 1.501 . . . . 0.0 109.715 170.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 96.6 m -112.47 148.69 33.88 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.515 1.526 . . . . 0.0 109.287 170.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -156.1 169.68 23.94 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.63 1.172 . . . . 0.0 108.981 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 92.3 m -106.87 141.64 37.78 Favored 'General case' 0 CA--C 1.521 -0.173 0 C-N-CA 123.135 0.574 . . . . 0.0 110.916 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.2 t -108.52 -26.17 10.56 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.97 1.308 . . . . 0.0 110.668 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -58.67 142.36 49.88 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-O 121.561 0.696 . . . . 0.0 111.198 -177.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.6 t -113.25 133.96 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 C-N-CA 125.8 1.64 . . . . 0.0 107.471 -172.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.7 tpp180 -160.84 -150.47 0.21 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -174.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -80.05 -150.48 0.06 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.668 0.787 . . . . 0.0 108.93 173.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -60.17 158.12 11.98 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.476 0.655 . . . . 0.0 110.912 -177.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 65.1 m -80.45 163.12 24.04 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.127 -170.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -80.04 172.67 13.47 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.513 0.673 . . . . 0.0 112.242 -174.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.2 t -55.12 -28.93 56.24 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.466 1.507 . . . . 0.0 113.003 -176.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.86 48.59 0.84 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.441 1.096 . . . . 0.0 110.161 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 84.5 m -128.92 133.69 47.97 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 164.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -103.96 -42.19 5.64 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.167 1.387 . . . . 0.0 108.925 -177.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.9 t -105.95 130.04 53.97 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 171.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.8 t -138.91 132.92 31.17 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 125.707 1.603 . . . . 0.0 107.023 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -138.23 148.36 44.69 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 124.205 1.002 . . . . 0.0 109.06 -170.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.0 m -136.41 158.86 43.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.716 0.806 . . . . 0.0 110.318 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.2 t -87.36 155.38 20.06 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 123.516 0.51 . . . . 0.0 110.118 175.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -90.15 8.89 30.61 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.879 1.271 . . . . 0.0 111.578 174.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.6 m -65.55 177.19 1.24 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.244 1.018 . . . . 0.0 110.934 174.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -122.93 113.4 30.02 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 174.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.55 147.37 89.01 Favored 'Cis proline' 0 CA--C 1.538 0.698 0 CA-C-N 119.788 0.96 . . . . 0.0 111.13 0.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.03 106.02 2.19 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.493 2.795 . . . . 0.0 108.772 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -107.9 147.98 30.24 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.051 0.94 . . . . 0.0 109.516 -173.136 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 91.8 m -116.62 159.68 21.81 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.322 1.049 . . . . 0.0 112.043 -166.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.7 ttp-105 -155.56 149.4 25.37 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 125.05 1.34 . . . . 0.0 109.722 -174.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 44.6 t -82.66 136.59 34.73 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.906 1.282 . . . . 0.0 109.882 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -122.36 18.0 10.59 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.171 1.389 . . . . 0.0 110.917 -178.269 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -79.25 149.1 31.96 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.036 0.934 . . . . 0.0 110.114 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 52.1 mm -108.73 133.73 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 C-N-CA 124.693 1.197 . . . . 0.0 108.763 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 67.4 p -138.9 -169.87 2.73 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.065 1.346 . . . . 0.0 108.233 175.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -117.66 5.71 12.37 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.05 1.34 . . . . 0.0 111.393 171.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -142.33 -178.0 5.53 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.233 1.413 . . . . 0.0 110.39 -171.129 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 41.5 t -140.54 145.5 36.87 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.546 1.138 . . . . 0.0 109.223 174.226 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -79.67 157.6 74.31 Favored Pre-proline 0 N--CA 1.451 -0.382 0 C-N-CA 125.097 1.359 . . . . 0.0 109.793 176.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -60.85 154.35 56.55 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.651 2.234 . . . . 0.0 110.823 177.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.2 138.04 57.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.594 0.758 . . . . 0.0 112.49 -168.149 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.531 0.246 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.035 176.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.273 0 CA-C-O 121.009 0.433 . . . . 0.0 110.423 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.7 p -120.17 -168.12 1.57 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 125.765 1.626 . . . . 0.0 109.875 -176.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.8 t -163.05 -178.87 6.31 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.442 1.497 . . . . 0.0 107.296 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -140.34 -56.61 0.53 Allowed 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 164.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 14.4 m-30 -93.43 112.66 24.63 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 176.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.1 m -113.2 68.38 1.2 Allowed Pre-proline 0 CA--C 1.537 0.443 0 C-N-CA 125.723 1.609 . . . . 0.0 111.303 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -79.85 165.15 22.4 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 121.631 1.554 . . . . 0.0 109.854 171.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.6 t -156.69 163.58 39.13 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.957 -178.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 70.6 p -72.96 175.98 6.13 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.981 171.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -106.48 4.93 28.81 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.317 1.047 . . . . 0.0 111.569 170.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 55.8 p -81.2 179.69 7.74 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.7 1.2 . . . . 0.0 112.043 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.5 tp -132.68 107.25 12.94 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 126.337 1.855 . . . . 0.0 108.194 -174.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -70.05 158.75 91.57 Favored 'Cis proline' 0 N--CA 1.457 -0.67 0 CA-C-N 119.808 0.967 . . . . 0.0 111.783 -1.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -78.74 135.95 13.16 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 124.067 3.178 . . . . 0.0 110.315 178.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -106.35 101.82 11.26 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 176.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 38.7 m -108.13 143.25 37.15 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.301 1.04 . . . . 0.0 108.783 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -139.46 177.24 8.07 Favored 'General case' 0 C--N 1.339 0.136 0 O-C-N 123.686 0.616 . . . . 0.0 111.294 -171.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 53.3 m -106.71 131.67 53.58 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 163.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 53.5 p -120.92 -1.71 9.86 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -67.01 137.77 56.73 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 118.507 0.594 . . . . 0.0 110.342 174.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.7 t -112.54 120.78 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 -170.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.1 mmm-85 -150.53 -161.11 1.27 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.225 1.41 . . . . 0.0 108.293 -164.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -68.38 -153.6 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 165.184 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -56.77 150.74 15.53 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -170.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.6 p -64.02 145.7 55.42 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 113.92 -1.491 . . . . 0.0 110.954 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.1 p80 -71.92 176.04 5.34 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -164.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.5 t -75.05 26.42 0.09 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.857 1.263 . . . . 0.0 113.18 -175.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -157.03 62.79 0.5 Allowed 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.622 0.769 . . . . 0.0 109.693 171.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.2 m -127.07 130.93 50.87 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.935 0.894 . . . . 0.0 109.82 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -105.48 -45.33 4.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.494 1.518 . . . . 0.0 107.572 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.2 t -107.88 139.64 42.17 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 166.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 18.8 t -156.28 147.54 22.4 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.536 1.534 . . . . 0.0 107.914 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.4 tp -156.53 157.05 34.71 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.4 m -126.41 160.69 29.77 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.029 0.932 . . . . 0.0 109.807 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 60.3 p -77.18 155.14 32.47 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.509 0.723 . . . . 0.0 110.596 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -91.25 10.65 26.34 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.918 0.887 . . . . 0.0 111.932 173.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 p -73.31 176.55 5.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.965 0.906 . . . . 0.0 111.071 176.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -128.16 112.23 19.94 Favored Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 124.645 1.178 . . . . 0.0 108.008 174.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.32 150.25 91.27 Favored 'Cis proline' 0 N--CA 1.456 -0.707 0 CA-C-N 119.517 0.863 . . . . 0.0 110.392 -1.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.06 154.6 47.44 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.31 2.673 . . . . 0.0 109.1 172.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -149.92 137.85 20.23 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.121 0.568 . . . . 0.0 109.487 -172.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.3 m -108.22 154.75 21.31 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 123.638 0.775 . . . . 0.0 112.542 -164.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -152.24 148.16 27.24 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.399 1.08 . . . . 0.0 109.526 -176.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 36.2 t -99.71 118.94 37.29 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 125.95 1.7 . . . . 0.0 109.157 -176.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -107.49 26.41 10.27 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.945 0.898 . . . . 0.0 111.704 -171.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -62.11 138.82 58.45 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.526 0.73 . . . . 0.0 110.4 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 19.3 mm -105.4 111.62 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.3 p -138.05 161.15 37.49 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.775 0.83 . . . . 0.0 109.767 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -74.73 -20.7 59.72 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.21 0.604 . . . . 0.0 111.774 173.056 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 36.0 p90 -115.3 -172.54 2.16 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 125.936 1.694 . . . . 0.0 109.982 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.5 t -145.74 155.45 42.96 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.37 1.068 . . . . 0.0 109.066 171.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -82.64 157.22 67.47 Favored Pre-proline 0 N--CA 1.451 -0.391 0 C-N-CA 124.252 1.021 . . . . 0.0 109.642 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.38 176.23 8.27 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.064 2.509 . . . . 0.0 111.442 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 p -63.3 141.72 58.66 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.948 0.899 . . . . 0.0 112.123 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.532 0.276 0 C-N-CA 124.539 1.136 . . . . 0.0 111.238 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.465 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.0 p -143.15 169.32 17.82 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 122.1 0.952 . . . . 0.0 111.505 178.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.8 t -158.32 153.13 24.96 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 126.234 1.814 . . . . 0.0 107.113 -168.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -107.26 -70.79 0.78 Allowed 'General case' 0 C--N 1.339 0.109 0 C-N-CA 123.406 0.682 . . . . 0.0 109.751 -170.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -89.89 111.68 22.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 173.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 4.8 t -126.68 69.1 70.47 Favored Pre-proline 0 CA--C 1.533 0.302 0 O-C-N 123.853 0.721 . . . . 0.0 112.461 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.1 158.99 55.69 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.8 2.333 . . . . 0.0 110.924 174.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.1 m -136.75 158.09 45.26 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.972 0.909 . . . . 0.0 110.926 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.3 p -79.2 163.83 24.69 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.618 0.767 . . . . 0.0 109.082 172.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 68.9 mtp85 -113.36 33.39 5.14 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.827 0.851 . . . . 0.0 109.862 172.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.3 p -78.71 176.91 9.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.507 1.123 . . . . 0.0 109.687 168.071 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.6 mm -127.76 111.72 20.56 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.577 1.151 . . . . 0.0 108.203 176.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.1 157.67 89.93 Favored 'Cis proline' 0 CA--C 1.537 0.668 0 CA-C-N 119.206 0.752 . . . . 0.0 110.218 -5.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -82.46 146.87 13.91 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.866 3.044 . . . . 0.0 110.734 175.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -120.64 130.14 54.02 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.673 1.589 . . . . 0.0 108.106 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 80.1 m -106.93 144.39 33.64 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.979 1.311 . . . . 0.0 109.164 174.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -140.74 160.34 40.26 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.103 1.361 . . . . 0.0 109.652 -176.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.6 m -107.29 125.96 51.82 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 124.271 1.028 . . . . 0.0 109.535 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.1 p -108.95 -17.8 13.83 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.475 1.11 . . . . 0.0 112.157 -172.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -62.34 142.84 57.59 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.127 0.571 . . . . 0.0 111.191 176.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.8 t -114.16 137.32 47.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 125.342 1.457 . . . . 0.0 107.838 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -160.07 -153.63 0.35 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 -174.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -76.72 -153.83 0.05 Allowed 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.834 0.854 . . . . 0.0 108.887 167.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 158.44 7.75 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.368 0.667 . . . . 0.0 112.017 -171.174 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.2 m -72.51 164.83 25.78 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.997 0.919 . . . . 0.0 111.424 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 22.7 p80 -78.07 168.76 19.37 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.79 0.805 . . . . 0.0 112.689 -171.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.7 t -58.62 -23.14 58.34 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 114.055 -1.43 . . . . 0.0 113.401 -172.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -119.74 29.57 7.5 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.373 1.069 . . . . 0.0 112.11 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.9 t -88.16 139.16 30.79 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 172.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -104.31 -51.9 3.02 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.649 1.18 . . . . 0.0 109.92 -175.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.3 t -107.22 119.67 40.03 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 48.8 t -126.81 138.92 53.42 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 125.441 1.497 . . . . 0.0 108.107 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.6 tp -144.29 153.31 41.89 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.7 m -130.41 156.28 45.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.053 0.941 . . . . 0.0 109.666 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -90.31 152.55 20.98 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 123.446 0.467 . . . . 0.0 110.002 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -88.54 15.3 8.21 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.222 1.009 . . . . 0.0 111.887 174.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 m -67.24 172.87 4.3 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.883 0.873 . . . . 0.0 110.545 173.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -125.93 113.14 24.44 Favored Pre-proline 0 CA--C 1.532 0.264 0 C-N-CA 124.018 0.927 . . . . 0.0 109.075 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.03 154.02 93.86 Favored 'Cis proline' 0 CA--C 1.54 0.783 0 CA-C-N 119.56 0.879 . . . . 0.0 110.92 -2.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -84.43 126.38 3.6 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.221 3.281 . . . . 0.0 109.987 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -113.83 158.44 21.02 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.555 1.142 . . . . 0.0 109.237 174.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 98.6 m -113.64 159.53 19.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.871 1.269 . . . . 0.0 110.52 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -156.19 144.8 20.12 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.699 1.2 . . . . 0.0 108.786 -174.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 53.1 t -91.64 122.36 34.14 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.655 -175.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -103.68 5.15 36.14 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.459 1.504 . . . . 0.0 111.286 -174.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -59.93 127.91 34.26 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.669 0.788 . . . . 0.0 109.787 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 35.8 mm -106.72 129.68 59.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 p -142.99 153.83 43.39 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 123.163 0.585 . . . . 0.0 109.648 178.288 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -62.83 -39.77 95.37 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.154 0.581 . . . . 0.0 110.67 172.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -88.89 -176.65 5.27 Favored 'General case' 0 N--CA 1.458 -0.071 0 C-N-CA 124.36 1.064 . . . . 0.0 110.045 173.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 10.6 t -151.78 153.16 33.73 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.464 0.706 . . . . 0.0 110.112 165.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -73.95 153.32 88.88 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 124.58 1.152 . . . . 0.0 109.464 175.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -72.75 179.9 4.82 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.097 2.531 . . . . 0.0 111.291 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.96 136.63 51.75 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.613 1.165 . . . . 0.0 112.132 -176.044 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.097 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.78 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.6 p -156.7 166.1 34.36 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.897 0.856 . . . . 0.0 111.932 170.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 t -168.08 156.48 8.9 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.496 1.918 . . . . 0.0 108.122 -176.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -104.22 -68.2 0.86 Allowed 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -84.63 99.23 10.65 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.7 t -117.14 77.49 9.38 Favored Pre-proline 0 CA--C 1.531 0.227 0 C-N-CA 124.233 1.013 . . . . 0.0 111.292 178.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -74.44 159.64 42.88 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.02 1.813 . . . . 0.0 110.242 170.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.5 m -134.39 156.85 47.79 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.669 1.188 . . . . 0.0 108.638 173.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.4 p -77.84 170.13 17.11 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.501 0.721 . . . . 0.0 109.984 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -108.28 10.09 27.8 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.813 1.245 . . . . 0.0 112.309 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.4 p -73.17 179.78 3.7 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.559 1.544 . . . . 0.0 111.868 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 tp -128.4 101.42 21.61 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 125.858 1.663 . . . . 0.0 108.966 -176.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -75.12 155.31 99.83 Favored 'Cis proline' 0 CA--C 1.536 0.61 0 CA-C-N 119.788 0.96 . . . . 0.0 110.492 -2.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -81.64 140.5 11.81 Favored 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 123.245 2.63 . . . . 0.0 109.712 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.46 141.13 40.79 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.27 1.428 . . . . 0.0 108.004 174.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 93.0 m -107.54 144.69 34.18 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.879 1.272 . . . . 0.0 109.333 176.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -144.27 -179.84 6.78 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.641 1.576 . . . . 0.0 108.576 -173.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 8.2 m -135.05 146.58 49.1 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 120.97 0.414 . . . . 0.0 111.352 175.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 80.7 p -121.64 17.51 11.18 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.271 1.428 . . . . 0.0 110.518 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -75.13 150.9 38.64 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.987 0.915 . . . . 0.0 108.98 174.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.406 HG13 ' HG2' ' A' ' 49' ' ' ARG . 59.8 t -141.46 112.35 3.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 C-N-CA 125.029 1.332 . . . . 0.0 108.536 -170.478 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.1 mtp-105 -144.07 -153.3 0.46 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.833 0.853 . . . . 0.0 108.8 -171.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -76.2 -131.03 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 169.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -63.7 162.82 12.53 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.46 1.027 . . . . 0.0 112.098 -174.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.7 m -88.11 151.01 23.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.374 1.469 . . . . 0.0 109.347 -172.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.0 p80 -84.03 174.72 10.06 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 121.934 0.873 . . . . 0.0 113.131 -172.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.7 t -59.11 -34.99 72.66 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.568 1.547 . . . . 0.0 112.873 -173.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.59 46.23 0.98 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.122 0.969 . . . . 0.0 110.164 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 11.2 t -144.13 103.3 3.99 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 175.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -102.77 -35.2 8.73 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 125.801 1.64 . . . . 0.0 109.255 -166.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t -102.81 125.33 49.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 170.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 11.0 t -154.87 144.29 21.27 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.57 1.148 . . . . 0.0 107.953 -172.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.5 tp -146.95 141.39 26.43 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -176.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.1 m -113.0 153.94 27.26 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.215 1.006 . . . . 0.0 110.488 -174.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.7 t -89.75 154.76 19.67 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.364 -175.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -90.13 16.33 8.65 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.76 1.224 . . . . 0.0 111.572 174.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 m -75.44 178.47 5.89 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.209 1.004 . . . . 0.0 110.547 174.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -126.88 115.65 22.26 Favored Pre-proline 0 CA--C 1.535 0.388 0 C-N-CA 124.441 1.096 . . . . 0.0 108.47 174.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.0 146.57 87.04 Favored 'Cis proline' 0 N--CA 1.456 -0.708 0 CA-C-N 119.772 0.954 . . . . 0.0 110.509 0.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -76.73 121.53 5.96 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 123.05 2.5 . . . . 0.0 109.485 176.136 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -120.78 156.89 30.91 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.265 1.426 . . . . 0.0 109.401 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.9 m -108.08 142.48 38.2 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.508 0.723 . . . . 0.0 110.608 -176.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.406 ' HG2' HG13 ' A' ' 27' ' ' VAL . 16.4 mtm-85 -126.71 131.63 51.32 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 126.782 2.033 . . . . 0.0 106.783 -167.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 5.8 m -76.36 136.1 39.52 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.171 0.441 . . . . 0.0 110.023 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -118.34 15.46 13.91 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.64 1.576 . . . . 0.0 109.866 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -82.01 152.25 26.76 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.529 1.132 . . . . 0.0 111.299 -169.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 45.6 mm -116.5 132.65 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 124.963 1.305 . . . . 0.0 108.202 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.9 p -134.95 177.89 7.45 Favored 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 159.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -78.64 -20.56 50.04 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.974 -0.454 . . . . 0.0 111.145 172.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -123.47 174.36 7.43 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 126.045 1.738 . . . . 0.0 111.721 -169.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 7.6 m -107.55 157.13 18.29 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.314 1.446 . . . . 0.0 110.33 176.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -100.27 156.9 34.73 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 126.67 1.988 . . . . 0.0 108.086 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -69.19 174.33 9.16 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.04 2.493 . . . . 0.0 112.073 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.7 p -63.11 145.14 56.11 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.92 0.888 . . . . 0.0 112.105 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.177 0 C-N-CA 125.115 1.366 . . . . 0.0 111.903 -173.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.258 0 CA-C-O 120.572 0.225 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.9 p -146.25 -179.97 7.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.582 1.153 . . . . 0.0 109.705 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 44.5 t -170.68 156.97 5.48 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.176 1.79 . . . . 0.0 107.2 174.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -105.57 -64.63 1.12 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.379 0.671 . . . . 0.0 109.552 -176.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -101.46 112.1 24.53 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 172.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 9.1 t -130.29 75.75 78.75 Favored Pre-proline 0 CA--C 1.531 0.227 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.84 158.29 53.28 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 122.605 2.203 . . . . 0.0 111.149 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.6 m -136.97 156.95 47.79 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.27 1.028 . . . . 0.0 110.61 -178.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 74.7 p -82.54 159.45 22.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 168.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 -106.65 31.21 5.41 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.506 0.722 . . . . 0.0 109.929 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.8 p -75.21 176.96 6.85 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.034 1.334 . . . . 0.0 110.167 173.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 34.4 mm -125.4 106.41 27.42 Favored Pre-proline 0 CA--C 1.533 0.292 0 C-N-CA 124.525 1.13 . . . . 0.0 108.384 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -72.8 161.38 93.55 Favored 'Cis proline' 0 CA--C 1.539 0.742 0 N-CA-C 109.856 -0.863 . . . . 0.0 109.856 -5.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -74.93 151.6 40.11 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 123.393 2.729 . . . . 0.0 110.418 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -122.32 119.26 30.58 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.941 1.296 . . . . 0.0 108.171 176.456 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 75.5 m -106.93 141.52 38.02 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.055 1.342 . . . . 0.0 109.492 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.19 162.41 36.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.919 1.288 . . . . 0.0 110.579 -178.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.3 m -104.29 131.28 51.79 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.977 1.311 . . . . 0.0 109.385 -176.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 47.4 p -107.55 -26.36 10.94 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.293 1.037 . . . . 0.0 111.124 -178.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -61.67 144.01 55.22 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.076 0.465 . . . . 0.0 109.82 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.5 t -118.73 142.34 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -158.23 -150.84 0.27 Allowed 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -170.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -74.75 -149.57 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 162.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -64.14 160.19 18.85 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.951 0.881 . . . . 0.0 112.267 -170.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 7.4 p -67.22 162.12 23.32 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.193 1.797 . . . . 0.0 111.626 176.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -82.0 173.11 12.51 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.032 0.933 . . . . 0.0 113.123 -172.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.8 t -57.75 -33.09 68.11 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.551 1.541 . . . . 0.0 112.943 -173.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.57 42.8 1.27 Allowed 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 124.064 0.946 . . . . 0.0 110.574 -177.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.6 t -117.59 128.95 55.45 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.03 0.932 . . . . 0.0 108.936 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.0 tttp -104.78 -47.31 4.08 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 124.064 0.945 . . . . 0.0 110.113 -171.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.0 p -103.61 125.85 50.38 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 125.639 1.576 . . . . 0.0 106.993 172.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 38.5 t -148.95 140.22 23.19 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.474 1.11 . . . . 0.0 108.244 -166.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.88 156.82 46.03 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 124.178 0.991 . . . . 0.0 109.673 -167.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 34.1 m -138.59 161.69 36.45 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.069 0.948 . . . . 0.0 109.815 174.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 44.9 p -87.28 150.78 23.65 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.046 0.938 . . . . 0.0 110.082 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -85.55 10.36 13.34 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.784 0.833 . . . . 0.0 112.411 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.0 p -71.28 176.41 4.59 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.859 1.264 . . . . 0.0 111.145 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -129.68 114.72 18.0 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.625 171.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.09 145.43 82.28 Favored 'Cis proline' 0 CA--C 1.54 0.806 0 CA-C-N 119.596 0.891 . . . . 0.0 110.743 -0.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.33 125.18 8.94 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.372 2.714 . . . . 0.0 109.43 177.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -109.36 143.0 39.49 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.635 1.174 . . . . 0.0 109.269 -178.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 64.1 m -113.5 160.81 18.09 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.043 0.937 . . . . 0.0 111.754 -169.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -159.5 163.68 35.05 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.75 1.22 . . . . 0.0 110.142 -170.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 52.8 t -99.28 142.6 30.56 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.746 1.218 . . . . 0.0 109.441 175.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -111.91 -12.17 13.8 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.441 1.097 . . . . 0.0 111.635 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.31 142.72 54.34 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.335 1.054 . . . . 0.0 112.708 -174.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.0 mm -105.96 133.27 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 125.748 1.619 . . . . 0.0 107.597 -172.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.8 p -131.88 158.23 41.9 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.088 0.47 . . . . 0.0 111.137 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -74.42 -44.08 53.46 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.023 1.329 . . . . 0.0 110.627 172.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -93.06 -167.95 1.83 Allowed 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 124.96 1.304 . . . . 0.0 108.294 170.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 7.8 t -147.61 154.96 41.31 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 157.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -72.27 153.4 92.28 Favored Pre-proline 0 N--CA 1.451 -0.424 0 C-N-CA 124.693 1.197 . . . . 0.0 109.817 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -72.7 174.83 11.14 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.277 2.652 . . . . 0.0 111.472 -176.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.38 132.06 43.38 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.491 1.116 . . . . 0.0 111.88 -176.459 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.6 t . . . . . 0 N--CA 1.457 -0.092 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.02 177.12 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.198 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.1 p -141.29 -179.59 6.21 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.08 0.952 . . . . 0.0 110.197 -175.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 29.5 t -173.68 150.63 1.75 Allowed 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.459 1.904 . . . . 0.0 106.582 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -106.0 -70.9 0.77 Allowed 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -174.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -85.04 109.33 18.13 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 174.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.4 t -126.2 73.16 72.05 Favored Pre-proline 0 CA--C 1.528 0.134 0 C-N-CA 122.721 0.408 . . . . 0.0 111.453 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -69.27 162.11 43.15 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.284 1.989 . . . . 0.0 110.504 172.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 21.3 m -136.12 158.68 43.83 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.944 0.898 . . . . 0.0 109.803 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.9 p -80.86 163.51 23.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.71 0.804 . . . . 0.0 109.324 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 85.4 mtm180 -108.73 32.26 5.01 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.782 0.833 . . . . 0.0 110.665 175.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 29.9 p -87.6 -177.54 5.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.576 1.151 . . . . 0.0 110.92 179.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.2 tp -127.1 100.6 26.8 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 125.519 1.528 . . . . 0.0 109.568 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.62 159.14 97.93 Favored 'Cis proline' 0 N--CA 1.458 -0.575 0 CA-C-N 119.684 0.923 . . . . 0.0 110.357 -3.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -80.12 147.85 18.86 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.162 2.575 . . . . 0.0 109.775 171.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.64 137.68 52.48 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.342 1.457 . . . . 0.0 107.985 172.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.6 m -108.23 144.77 35.24 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.992 1.317 . . . . 0.0 108.724 173.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -150.63 155.91 40.31 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.989 1.316 . . . . 0.0 108.47 -171.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.8 m -104.63 128.44 52.66 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.344 0.657 . . . . 0.0 109.671 -174.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 46.3 p -108.78 1.86 21.31 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.934 0.894 . . . . 0.0 111.802 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -71.17 154.03 42.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.39 0.614 . . . . 0.0 109.949 170.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.422 HG13 ' HG3' ' A' ' 49' ' ' ARG . 95.8 t -142.42 131.8 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 125.276 1.43 . . . . 0.0 107.409 -175.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.4 ttp85 -156.43 -145.76 0.16 Allowed 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 -173.395 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -69.05 -92.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.098 1.759 . . . . 0.0 109.96 -176.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -105.05 168.69 8.89 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.334 1.453 . . . . 0.0 109.136 168.14 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.2 p -82.51 169.61 16.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.654 1.582 . . . . 0.0 110.804 170.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -84.51 175.17 9.47 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.91 0.884 . . . . 0.0 111.687 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.8 t -61.71 -30.85 71.03 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.684 1.194 . . . . 0.0 112.832 -176.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.79 45.78 0.96 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.048 0.939 . . . . 0.0 110.196 -174.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -130.69 124.31 31.28 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.134 1.374 . . . . 0.0 108.844 170.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -106.27 -32.06 8.35 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 125.943 1.697 . . . . 0.0 110.133 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.1 p -99.55 57.61 1.03 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.283 1.433 . . . . 0.0 107.843 -175.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.3 t -106.97 131.49 53.98 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.1 -1.864 . . . . 0.0 108.717 -172.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.3 tp -155.48 141.92 18.64 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -172.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 m -120.08 151.57 38.84 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.251 1.02 . . . . 0.0 110.472 -173.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -85.19 154.18 22.16 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 -176.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.7 mtm105 -91.59 11.83 22.97 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.449 1.1 . . . . 0.0 111.498 176.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -72.5 178.94 3.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.586 1.154 . . . . 0.0 109.919 175.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -123.99 118.71 26.8 Favored Pre-proline 0 CA--C 1.532 0.27 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -75.03 143.58 78.24 Favored 'Cis proline' 0 CA--C 1.539 0.739 0 CA-C-N 119.664 0.916 . . . . 0.0 110.932 2.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -77.09 106.45 2.25 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.453 2.768 . . . . 0.0 109.122 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -110.74 150.42 29.1 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.926 1.29 . . . . 0.0 109.758 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -108.83 147.76 31.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.372 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.422 ' HG3' HG13 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -128.92 167.32 17.57 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.334 1.854 . . . . 0.0 109.13 -178.667 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 44.7 t -135.84 135.37 39.75 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.506 1.122 . . . . 0.0 110.449 174.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -112.97 42.25 1.92 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.621 1.568 . . . . 0.0 110.624 -173.129 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -62.75 158.24 19.14 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -174.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 30.3 mm -133.65 104.05 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 176.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.5 p -138.23 152.13 48.3 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.082 0.553 . . . . 0.0 109.879 175.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -66.65 -41.11 88.73 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.934 0.494 . . . . 0.0 110.242 172.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -88.8 -173.46 4.12 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.532 1.133 . . . . 0.0 109.447 172.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 6.6 t -156.58 159.65 38.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.768 0.827 . . . . 0.0 109.468 165.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -74.85 148.81 85.16 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 123.61 0.764 . . . . 0.0 109.527 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.28 171.32 16.29 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.133 2.556 . . . . 0.0 111.229 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.26 131.86 46.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.467 1.107 . . . . 0.0 111.737 -177.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.53 0.21 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.108 174.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.147 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.2 p -135.12 -176.21 4.18 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.09 0.956 . . . . 0.0 110.542 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 39.1 t -166.33 167.07 16.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.37 1.868 . . . . 0.0 107.313 175.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -113.98 -66.24 1.11 Allowed 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 168.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -80.33 110.42 15.76 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.292 1.037 . . . . 0.0 109.959 178.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.1 m -117.35 69.74 5.79 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 124.869 1.267 . . . . 0.0 111.055 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -76.81 162.4 32.5 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.083 1.856 . . . . 0.0 110.634 171.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 43.8 t -154.28 157.58 38.89 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.113 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.4 p -90.37 157.0 17.84 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.221 1.009 . . . . 0.0 109.066 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.9 mtm105 -106.88 42.59 1.27 Allowed 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.913 0.885 . . . . 0.0 109.823 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 p -96.6 179.77 4.88 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 126.066 1.746 . . . . 0.0 110.153 177.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -131.58 101.68 15.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 124.927 1.291 . . . . 0.0 107.989 -178.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -71.82 156.96 97.34 Favored 'Cis proline' 0 CA--C 1.537 0.642 0 CA-C-N 119.407 0.824 . . . . 0.0 110.615 -1.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -74.66 141.92 28.35 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 123.476 2.784 . . . . 0.0 110.542 174.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -104.77 109.6 21.61 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 171.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 68.4 m -107.21 148.1 29.33 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 125.009 1.324 . . . . 0.0 109.297 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -153.55 163.0 40.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.484 -167.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.1 t -107.77 128.46 54.6 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.651 1.18 . . . . 0.0 108.537 174.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 77.2 p -122.56 6.96 9.48 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.426 0.691 . . . . 0.0 112.385 -172.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -67.05 143.31 56.8 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 119.029 0.831 . . . . 0.0 111.345 179.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.9 t -108.69 126.35 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 125.947 1.699 . . . . 0.0 106.733 -178.459 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -165.8 -160.52 0.45 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -166.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -72.53 -153.07 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.594 0.758 . . . . 0.0 109.017 168.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -58.85 151.2 22.07 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.514 0.674 . . . . 0.0 112.051 -169.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 p -71.92 148.91 45.59 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.228 1.411 . . . . 0.0 111.037 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.2 p80 -75.02 170.75 15.39 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.459 -0.791 . . . . 0.0 113.097 -169.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.5 t -60.45 -31.83 70.81 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.774 1.23 . . . . 0.0 112.355 -174.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.39 36.59 2.55 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.993 0.917 . . . . 0.0 111.118 -177.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 48.7 t -114.56 136.2 53.29 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 125.409 1.483 . . . . 0.0 107.832 174.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -105.84 -54.91 2.4 Favored 'General case' 0 CA--C 1.522 -0.097 0 C-N-CA 124.116 0.966 . . . . 0.0 109.684 -168.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.3 t -105.35 137.1 43.69 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 107.381 -1.341 . . . . 0.0 107.381 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.6 t -154.42 143.71 21.29 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.167 0.987 . . . . 0.0 109.164 -168.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 64.6 tp -152.41 151.75 31.18 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 124.458 1.103 . . . . 0.0 108.874 -175.042 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.2 m -130.28 163.95 25.65 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.874 0.87 . . . . 0.0 110.866 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.8 p -84.25 156.99 21.73 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.84 0.856 . . . . 0.0 110.39 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.5 ptt180 -93.46 12.82 23.69 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.342 1.057 . . . . 0.0 111.753 174.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.3 p -77.35 -179.96 6.05 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 124.467 1.107 . . . . 0.0 111.687 -177.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -130.24 106.71 16.21 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.784 1.234 . . . . 0.0 108.391 174.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.66 152.84 96.76 Favored 'Cis proline' 0 N--CA 1.456 -0.7 0 CA-C-N 119.513 0.862 . . . . 0.0 110.862 1.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.16 153.83 46.45 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.184 2.589 . . . . 0.0 108.713 170.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -148.58 135.81 20.24 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -174.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 74.8 m -107.3 157.45 17.92 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.067 0.947 . . . . 0.0 111.32 -168.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 19.8 ttp-105 -154.23 153.13 31.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.916 1.286 . . . . 0.0 108.879 -171.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.7 m -89.43 152.41 21.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.584 1.154 . . . . 0.0 110.754 173.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -130.41 21.93 5.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.109 1.764 . . . . 0.0 109.384 170.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -67.48 124.75 24.06 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.022 1.329 . . . . 0.0 109.796 -177.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 32.3 mm -107.84 122.05 61.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.9 p -139.41 179.46 6.53 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.264 1.426 . . . . 0.0 108.662 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -78.57 -9.64 59.43 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.967 -0.458 . . . . 0.0 111.431 172.226 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -138.02 -170.22 2.74 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.94 1.696 . . . . 0.0 110.34 -170.365 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 35.4 t -154.51 153.11 30.94 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.353 1.461 . . . . 0.0 108.506 171.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -78.9 151.59 76.5 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.975 0.91 . . . . 0.0 110.44 -176.344 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -70.13 173.47 11.25 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.053 2.502 . . . . 0.0 112.062 -173.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.1 p -59.28 133.59 56.24 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.115 0.966 . . . . 0.0 112.413 -174.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.239 0 CA-C-N 114.341 -1.299 . . . . 0.0 110.903 178.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.162 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.0 p -149.65 -171.34 3.87 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 123.779 0.831 . . . . 0.0 110.07 -170.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 t -169.96 -177.34 2.57 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.101 1.76 . . . . 0.0 106.906 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.422 ' H ' ' HB2' ' A' ' 26' ' ' ASP . 9.3 t70 -108.42 -52.65 2.74 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 171.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -147.89 146.64 29.13 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.302 1.041 . . . . 0.0 108.601 162.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -136.03 96.34 12.98 Favored Pre-proline 0 N--CA 1.448 -0.541 0 C-N-CA 124.916 1.286 . . . . 0.0 111.139 -175.753 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.01 166.68 28.68 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.578 2.185 . . . . 0.0 110.819 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.4 m -128.71 153.44 47.33 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.213 1.005 . . . . 0.0 110.215 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.4 p -84.31 158.78 21.08 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.834 1.653 . . . . 0.0 108.998 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 42.1 mtm105 -106.13 36.71 2.48 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.083 0.953 . . . . 0.0 109.825 -177.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -90.83 178.04 6.15 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.786 1.634 . . . . 0.0 110.124 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.9 tp -131.18 98.68 18.46 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 125.481 1.513 . . . . 0.0 108.849 -175.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -73.95 154.96 99.87 Favored 'Cis proline' 0 CA--C 1.536 0.622 0 CA-C-N 119.693 0.926 . . . . 0.0 111.126 0.566 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -78.82 140.25 16.17 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 123.54 2.826 . . . . 0.0 109.924 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -107.24 159.15 16.56 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.696 1.198 . . . . 0.0 108.833 173.401 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 72.8 m -132.12 142.53 49.53 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.9 1.28 . . . . 0.0 109.132 179.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -143.8 174.25 10.98 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.211 1.004 . . . . 0.0 108.605 -173.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.1 m -102.68 150.89 22.99 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 174.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.6 t -104.68 -9.52 18.14 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.366 163.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.422 ' HB2' ' H ' ' A' ' 10' ' ' ASP . 21.9 t0 -55.92 149.7 14.64 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.986 1.314 . . . . 0.0 112.313 173.427 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.535 HG13 ' HG2' ' A' ' 49' ' ' ARG . 53.6 t -144.23 147.15 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 127.763 2.425 . . . . 0.0 105.914 174.427 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -155.19 -152.41 0.4 Allowed 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 -173.637 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -78.9 -116.3 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 155.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -68.53 158.27 34.22 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.894 1.225 . . . . 0.0 111.855 -178.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 4.1 p -82.59 163.3 21.55 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.49 1.916 . . . . 0.0 110.754 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 33.5 p80 -71.22 168.05 18.1 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -167.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.4 t -52.02 -37.85 54.87 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.871 1.668 . . . . 0.0 112.634 -173.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.35 24.77 12.34 Favored 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 124.367 1.067 . . . . 0.0 112.513 -175.357 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.9 t -91.21 127.46 36.65 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 175.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 tttp -104.85 -45.25 4.62 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.573 0.749 . . . . 0.0 110.452 -172.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.5 t -104.67 129.55 52.82 Favored 'General case' 0 CA--C 1.523 -0.085 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 172.156 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.6 t -150.38 140.66 22.26 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.006 0.922 . . . . 0.0 108.634 -168.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 22.4 tp -153.38 158.97 42.27 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.875 0.87 . . . . 0.0 109.436 -169.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 24.6 m -123.74 165.98 16.35 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.344 0.657 . . . . 0.0 111.102 -175.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -93.18 150.67 20.33 Favored 'General case' 0 C--N 1.341 0.221 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 169.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -91.69 15.24 13.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.54 1.136 . . . . 0.0 111.922 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -67.2 172.36 4.79 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 123.86 0.864 . . . . 0.0 110.593 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -121.07 110.32 34.75 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 172.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -74.21 152.7 98.56 Favored 'Cis proline' 0 CA--C 1.54 0.816 0 CA-C-N 119.592 0.89 . . . . 0.0 110.775 -0.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -82.01 131.76 7.07 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 124.148 3.232 . . . . 0.0 109.942 173.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -113.4 152.01 30.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.611 1.565 . . . . 0.0 108.063 174.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 92.1 m -113.53 154.4 27.17 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.606 0.762 . . . . 0.0 110.931 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.535 ' HG2' HG13 ' A' ' 27' ' ' VAL . 14.4 mtm105 -147.79 147.26 29.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.305 1.042 . . . . 0.0 109.448 -155.323 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 43.2 t -84.67 136.72 33.62 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 172.121 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -106.62 -23.59 12.4 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.109 1.364 . . . . 0.0 110.585 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -47.66 143.69 3.69 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 126.045 1.738 . . . . 0.0 113.26 -172.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.0 mm -106.37 127.92 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 C-N-CA 125.122 1.369 . . . . 0.0 107.327 -176.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.1 p -126.99 173.1 9.91 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.538 0.735 . . . . 0.0 109.476 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -88.99 -9.6 50.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.633 0.773 . . . . 0.0 111.328 174.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -133.75 173.28 11.7 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 125.43 1.492 . . . . 0.0 110.95 -174.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.1 t -110.12 137.06 48.38 Favored 'General case' 0 N--CA 1.458 -0.07 0 C-N-CA 125.853 1.661 . . . . 0.0 108.86 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -75.29 157.97 84.31 Favored Pre-proline 0 N--CA 1.449 -0.49 0 C-N-CA 126.635 1.974 . . . . 0.0 109.881 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -67.59 158.11 58.67 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 122.071 1.847 . . . . 0.0 109.817 170.281 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.0 p -67.41 149.27 50.49 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 120.937 0.399 . . . . 0.0 111.21 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.266 0 C-N-CA 124.548 1.139 . . . . 0.0 110.6 -178.009 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.275 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.7 p -143.63 164.86 29.21 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.439 0.638 . . . . 0.0 112.001 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 53.3 t -174.32 143.53 0.87 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.869 -166.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -104.8 -65.99 1.0 Allowed 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.743 0.817 . . . . 0.0 108.915 -174.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -85.81 107.79 17.81 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 26.5 p -124.26 61.11 25.83 Favored Pre-proline 0 CA--C 1.535 0.396 0 C-N-CA 124.914 1.286 . . . . 0.0 111.292 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -71.56 159.73 50.39 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.561 2.174 . . . . 0.0 111.042 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 24.9 m -129.19 157.4 41.92 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.035 0.934 . . . . 0.0 110.263 178.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.6 p -73.82 173.03 10.46 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.488 0.715 . . . . 0.0 110.289 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -106.05 10.67 32.09 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.663 1.185 . . . . 0.0 111.61 176.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 p -73.58 172.72 10.84 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 124.264 1.026 . . . . 0.0 111.681 179.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.8 tp -128.79 100.09 21.87 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 126.012 1.725 . . . . 0.0 108.727 -177.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.92 158.48 96.35 Favored 'Cis proline' 0 CA--C 1.534 0.51 0 CA-C-N 119.68 0.921 . . . . 0.0 111.616 0.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.79 145.99 14.6 Favored 'Trans proline' 0 N--CA 1.451 -0.978 0 C-N-CA 123.305 2.67 . . . . 0.0 110.236 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -113.71 131.54 56.14 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.029 1.731 . . . . 0.0 106.739 175.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 88.7 m -105.5 144.2 32.6 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 123.724 0.81 . . . . 0.0 108.866 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -143.58 159.71 41.95 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.137 0.975 . . . . 0.0 108.763 -171.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 18.2 m -107.35 121.24 44.17 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.671 0.788 . . . . 0.0 109.317 178.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 70.8 p -107.9 22.85 15.36 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.419 1.087 . . . . 0.0 109.948 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -76.13 148.61 37.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 170.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.2 t -143.1 127.4 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 125.102 1.361 . . . . 0.0 107.787 -173.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -165.25 -156.06 0.27 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.227 0.611 . . . . 0.0 109.48 -173.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -57.69 -81.01 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.109 0.964 . . . . 0.0 110.664 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -116.12 169.86 8.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.297 1.439 . . . . 0.0 111.712 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 p -96.54 159.31 15.0 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.838 2.055 . . . . 0.0 111.424 177.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -88.47 172.29 9.46 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.021 0.928 . . . . 0.0 113.47 -170.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.4 t -51.93 -39.51 59.29 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.975 1.71 . . . . 0.0 112.797 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.81 42.79 1.34 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.176 0.991 . . . . 0.0 110.871 -174.077 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 51.1 t -123.26 119.8 31.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 173.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -102.51 -40.76 6.53 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.837 1.255 . . . . 0.0 110.188 -165.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.9 t -104.11 118.72 37.33 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 170.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.3 t -144.98 133.06 21.42 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.903 1.681 . . . . 0.0 107.322 -175.533 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.2 tt -153.68 140.44 19.05 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -172.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.4 m -118.87 159.67 23.33 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.437 1.095 . . . . 0.0 111.311 -169.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.6 t -78.83 148.15 32.97 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 29.6 ptt-85 -93.81 41.06 1.08 Allowed 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.881 1.272 . . . . 0.0 110.447 -175.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 t -163.23 -160.8 0.63 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.334 0.654 . . . . 0.0 110.056 -174.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -107.79 131.62 21.6 Favored Pre-proline 0 N--CA 1.442 -0.867 0 C-N-CA 127.124 2.169 . . . . 0.0 108.648 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -73.53 145.96 85.55 Favored 'Cis proline' 0 N--CA 1.456 -0.71 0 N-CA-C 109.283 -1.084 . . . . 0.0 109.283 -4.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -77.71 84.36 1.99 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.115 2.543 . . . . 0.0 108.953 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -107.2 145.99 31.94 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.485 1.514 . . . . 0.0 108.547 -177.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -116.13 148.19 40.57 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.422 0.629 . . . . 0.0 112.486 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 27.8 mtm-85 -119.67 156.64 30.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.956 1.702 . . . . 0.0 109.16 -175.102 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 1.7 m -100.11 160.23 14.48 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.989 0.916 . . . . 0.0 109.328 165.215 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -154.04 27.53 0.47 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.292 1.037 . . . . 0.0 109.688 175.429 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -73.26 153.07 40.76 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 123.813 0.845 . . . . 0.0 110.544 -176.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.0 mm -106.47 132.48 53.57 Favored 'Isoleucine or valine' 0 C--N 1.34 0.18 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -176.075 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 56.4 p -144.1 -165.19 2.06 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.443 1.497 . . . . 0.0 108.238 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -134.87 18.58 3.5 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.245 1.018 . . . . 0.0 110.609 172.061 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -156.5 178.61 10.12 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.365 1.466 . . . . 0.0 110.215 -173.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.0 t -111.21 148.2 33.33 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.843 1.257 . . . . 0.0 109.97 178.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -97.75 151.99 37.88 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.394 1.478 . . . . 0.0 108.79 172.049 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -64.59 163.67 26.47 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.222 2.615 . . . . 0.0 111.714 -176.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.2 p -57.33 139.14 53.77 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.038 0.935 . . . . 0.0 112.555 -175.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.462 0.136 0 C-N-CA 124.453 1.101 . . . . 0.0 112.085 -173.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 119.759 -0.162 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.3 p -149.21 173.15 13.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.679 0.752 . . . . 0.0 111.768 -175.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 t -170.23 152.41 4.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 126.323 1.849 . . . . 0.0 108.219 -174.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -105.14 -66.86 0.95 Allowed 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 -177.367 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -93.19 104.24 16.44 Favored 'General case' 0 C--N 1.344 0.337 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 21.4 p -119.93 64.32 9.26 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 126.916 2.086 . . . . 0.0 110.764 -174.157 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -67.3 156.65 65.32 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.517 2.144 . . . . 0.0 111.817 -177.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 63.4 m -130.33 159.32 37.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.471 1.108 . . . . 0.0 109.99 178.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 81.9 p -89.27 172.17 9.24 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.421 1.489 . . . . 0.0 110.245 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 33.0 ptt-85 -107.47 -1.59 21.26 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.132 1.373 . . . . 0.0 112.436 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.7 p -71.36 179.37 2.96 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.516 1.526 . . . . 0.0 111.315 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.0 mm -128.46 117.57 20.01 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 124.973 1.309 . . . . 0.0 108.548 -177.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -69.91 146.57 82.88 Favored 'Cis proline' 0 N--CA 1.456 -0.689 0 N-CA-C 109.525 -0.991 . . . . 0.0 109.525 -5.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -72.16 125.97 11.33 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.703 2.269 . . . . 0.0 109.024 178.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.7 pm0 -105.33 151.36 24.26 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.233 1.013 . . . . 0.0 109.224 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.7 m -127.66 145.84 50.75 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.466 1.507 . . . . 0.0 109.809 -177.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -150.52 163.96 37.16 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.545 1.538 . . . . 0.0 108.287 -171.268 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 68.7 m -107.68 141.68 38.82 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.548 0.739 . . . . 0.0 110.097 171.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.0 t -107.53 -12.03 15.36 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.462 -172.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.67 146.91 51.03 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.812 0.845 . . . . 0.0 110.452 -176.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 85.0 t -110.35 126.04 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 174.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.75 -166.25 2.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.922 0.889 . . . . 0.0 111.515 -171.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -71.69 -136.94 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 165.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -63.03 157.17 22.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 120.633 -1.292 . . . . 0.0 112.347 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.1 m -75.45 166.55 23.42 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.147 175.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -88.3 171.18 10.36 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.704 0.802 . . . . 0.0 112.916 -173.264 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.6 t -63.52 -24.39 67.8 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.073 1.349 . . . . 0.0 113.102 -175.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -103.7 34.59 2.93 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.225 1.01 . . . . 0.0 110.781 178.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.8 t -119.59 126.59 51.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.563 1.145 . . . . 0.0 108.309 175.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -105.84 -38.93 6.2 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.753 1.221 . . . . 0.0 109.923 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.1 t -106.38 113.82 27.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 174.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.8 t -128.9 137.96 51.73 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 126.293 1.837 . . . . 0.0 107.249 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.403 HD23 ' H ' ' A' ' 40' ' ' CYS . 0.5 OUTLIER -143.02 152.16 41.61 Favored 'General case' 0 N--CA 1.46 0.069 0 C-N-CA 124.328 1.051 . . . . 0.0 108.634 -174.624 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.403 ' H ' HD23 ' A' ' 39' ' ' LEU . 6.8 m -137.75 157.08 47.2 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.802 0.841 . . . . 0.0 110.459 -173.595 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.8 t -91.87 151.87 20.35 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 123.406 0.441 . . . . 0.0 109.886 178.077 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.4 ptt-85 -97.32 19.04 13.81 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.709 1.204 . . . . 0.0 111.557 177.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -69.05 178.33 2.3 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 124.275 1.03 . . . . 0.0 110.563 170.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -123.56 117.09 27.82 Favored Pre-proline 0 CA--C 1.533 0.313 0 C-N-CA 124.071 0.948 . . . . 0.0 109.222 175.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -71.78 151.12 95.28 Favored 'Cis proline' 0 CA--C 1.54 0.804 0 CA-C-N 119.587 0.888 . . . . 0.0 110.287 -5.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -83.29 127.11 4.43 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.95 3.1 . . . . 0.0 110.244 175.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -115.95 161.48 18.77 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.761 1.224 . . . . 0.0 108.93 174.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 99.5 m -112.56 169.52 8.83 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.46 1.104 . . . . 0.0 110.618 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.1 ttp85 -159.53 146.83 16.91 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.192 1.397 . . . . 0.0 108.54 -174.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 49.9 t -89.97 124.0 34.36 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.742 0.817 . . . . 0.0 109.25 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.67 10.37 29.0 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.903 1.681 . . . . 0.0 110.571 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -67.72 145.63 54.57 Favored 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.707 -0.62 . . . . 0.0 110.635 -175.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 49.0 mm -107.45 133.85 50.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 124.497 1.119 . . . . 0.0 108.97 -169.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.2 p -141.99 -178.14 5.55 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.722 1.209 . . . . 0.0 109.551 -177.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -107.86 -5.33 17.29 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.95 1.3 . . . . 0.0 110.985 169.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -133.42 -173.19 3.15 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.982 1.713 . . . . 0.0 110.364 -168.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.7 t -121.33 146.3 47.0 Favored 'General case' 0 CA--C 1.527 0.061 0 C-N-CA 125.628 1.571 . . . . 0.0 109.207 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -78.57 160.58 72.08 Favored Pre-proline 0 N--CA 1.452 -0.349 0 C-N-CA 124.476 1.11 . . . . 0.0 108.953 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -60.0 159.7 24.76 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.392 2.061 . . . . 0.0 110.651 174.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.3 p -62.44 138.18 58.41 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 122.796 0.438 . . . . 0.0 111.017 -177.406 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.131 0 C-N-CA 124.529 1.131 . . . . 0.0 109.592 177.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.386 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.7 p -140.26 -170.39 2.97 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.459 1.104 . . . . 0.0 109.219 -170.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.1 t -173.58 170.99 3.97 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.387 1.875 . . . . 0.0 106.434 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -108.22 -60.74 1.68 Allowed 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 166.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -119.2 109.74 16.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.265 1.026 . . . . 0.0 109.046 -177.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.86 89.21 47.96 Favored Pre-proline 0 N--CA 1.452 -0.366 0 C-N-CA 124.596 1.158 . . . . 0.0 111.979 176.483 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.31 171.57 14.81 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.122 1.881 . . . . 0.0 110.859 169.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.8 m -133.17 156.54 47.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.379 1.072 . . . . 0.0 109.692 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 36.8 p -88.08 162.94 16.5 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.742 1.217 . . . . 0.0 109.611 178.043 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -106.47 35.24 3.03 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.31 1.044 . . . . 0.0 110.045 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 p -90.21 179.27 5.95 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.592 1.557 . . . . 0.0 110.327 175.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.37 106.21 17.55 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.954 1.302 . . . . 0.0 108.33 -178.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.37 156.78 96.62 Favored 'Cis proline' 0 CA--C 1.535 0.531 0 CA-C-N 119.618 0.899 . . . . 0.0 109.835 -4.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.05 139.95 19.64 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.657 2.238 . . . . 0.0 110.072 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -107.78 132.9 52.9 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.817 1.247 . . . . 0.0 108.107 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 79.2 m -108.07 143.97 36.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.452 1.101 . . . . 0.0 109.423 172.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -157.01 170.22 23.04 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.006 0.922 . . . . 0.0 109.365 -173.515 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 89.3 m -104.27 143.96 32.26 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.694 0.798 . . . . 0.0 109.877 -177.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 11.3 t -115.32 -16.69 11.44 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.682 1.193 . . . . 0.0 111.212 177.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.08 155.45 31.33 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 121.289 0.566 . . . . 0.0 111.158 -178.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.7 t -122.64 143.03 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 125.994 1.717 . . . . 0.0 107.92 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.6 tpp180 -161.67 -145.2 0.11 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.958 1.303 . . . . 0.0 107.902 -174.117 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -91.79 -130.84 0.11 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 125.021 1.329 . . . . 0.0 108.301 167.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -65.63 171.85 3.85 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.594 1.158 . . . . 0.0 114.086 -165.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -71.18 151.1 44.7 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.01 1.324 . . . . 0.0 109.69 179.38 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.3 p80 -81.9 -178.84 7.16 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 121.495 0.664 . . . . 0.0 112.073 173.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 t -78.44 23.95 0.29 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.311 1.045 . . . . 0.0 113.167 -172.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -160.38 69.35 0.38 Allowed 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.599 0.636 . . . . 0.0 109.866 172.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 94.1 m -124.89 124.77 42.78 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.852 0.861 . . . . 0.0 110.044 -176.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 tmtp? -105.7 -30.68 9.3 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.882 1.673 . . . . 0.0 108.75 176.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.4 t -118.86 131.46 56.07 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.438 1.495 . . . . 0.0 108.279 169.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.3 t -154.99 143.52 20.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.078 1.351 . . . . 0.0 108.376 177.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.1 tp -152.47 170.21 20.69 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 122.986 0.515 . . . . 0.0 110.069 -172.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 65.4 m -134.37 163.76 28.95 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.128 0.971 . . . . 0.0 110.598 172.112 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.8 p -79.68 148.94 31.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.12 0.968 . . . . 0.0 110.186 178.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.3 ptt85 -98.32 52.44 1.03 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.234 1.414 . . . . 0.0 109.122 176.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.3 t -153.39 -163.93 1.79 Allowed 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.448 1.099 . . . . 0.0 109.476 177.016 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -129.63 129.49 23.15 Favored Pre-proline 0 CA--C 1.533 0.312 0 C-N-CA 125.416 1.486 . . . . 0.0 108.73 -178.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -70.87 147.8 87.82 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 CA-C-N 119.682 0.922 . . . . 0.0 110.592 -0.393 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -74.45 98.91 1.16 Allowed 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 123.502 2.801 . . . . 0.0 108.721 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -106.55 140.73 38.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.184 1.394 . . . . 0.0 108.49 -173.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 79.1 m -126.11 153.79 44.03 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.472 0.709 . . . . 0.0 111.024 -168.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.73 162.14 36.24 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.419 1.088 . . . . 0.0 110.544 -176.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.9 t -118.68 126.4 51.84 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 125.389 1.475 . . . . 0.0 107.491 172.397 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -119.78 37.92 4.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.41 1.084 . . . . 0.0 110.194 -168.282 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -62.59 152.12 35.94 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.735 1.214 . . . . 0.0 112.07 -174.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 46.4 mm -108.05 101.96 13.29 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 C-N-CA 124.414 1.086 . . . . 0.0 108.233 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.3 p -113.45 -175.93 2.78 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.893 1.277 . . . . 0.0 108.63 171.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -110.49 11.3 23.11 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.937 0.895 . . . . 0.0 110.631 173.041 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -148.56 170.1 18.82 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.882 1.673 . . . . 0.0 110.244 -174.078 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 19.8 t -118.75 138.72 52.47 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 126.003 1.721 . . . . 0.0 108.556 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -82.73 154.94 68.39 Favored Pre-proline 0 N--CA 1.45 -0.466 0 C-N-CA 125.576 1.55 . . . . 0.0 109.79 -177.151 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -67.13 163.91 32.28 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.622 2.214 . . . . 0.0 110.473 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.3 133.25 53.86 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.413 0.685 . . . . 0.0 112.129 -172.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.534 0.345 0 C-N-CA 124.714 1.206 . . . . 0.0 110.425 176.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 40.3 p . . . . . 0 N--CA 1.473 0.712 0 CA-C-O 119.565 -0.255 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -159.37 -58.16 0.06 Allowed 'General case' 0 C--N 1.342 0.244 0 C-N-CA 123.515 0.726 . . . . 0.0 109.894 176.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p -161.63 -174.45 4.23 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.571 1.148 . . . . 0.0 109.269 -178.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.4 t -154.94 -170.8 3.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.129 0.971 . . . . 0.0 109.981 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.6 p -80.86 79.02 7.59 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.395 1.478 . . . . 0.0 109.954 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 67.8 p -74.86 -177.93 3.5 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.046 1.338 . . . . 0.0 111.418 177.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.34 110.52 1.45 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.987 0.915 . . . . 0.0 109.866 175.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.8 p -122.49 -168.75 1.78 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.425 1.49 . . . . 0.0 109.832 -172.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.1 t -165.99 179.22 5.95 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 170.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -132.71 -74.94 0.5 Allowed 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 170.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -90.33 115.75 27.76 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 171.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 30.0 p -119.96 72.52 17.39 Favored Pre-proline 0 CA--C 1.532 0.285 0 C-N-CA 123.571 0.748 . . . . 0.0 112.277 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -75.55 161.3 37.35 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.638 2.225 . . . . 0.0 110.758 176.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.0 m -139.27 158.48 44.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.206 1.002 . . . . 0.0 110.694 -179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.7 p -77.88 157.06 29.99 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 169.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -106.89 36.47 2.65 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.76 0.824 . . . . 0.0 109.604 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.2 p -86.52 179.46 6.83 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.924 1.69 . . . . 0.0 110.328 175.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -126.16 104.74 25.58 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 125.28 1.432 . . . . 0.0 107.888 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.34 159.06 97.95 Favored 'Cis proline' 0 CA--C 1.536 0.593 0 CA-C-N 119.619 0.9 . . . . 0.0 110.297 -3.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -75.73 142.12 25.36 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.272 2.648 . . . . 0.0 109.885 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.87 126.98 55.69 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.57 1.148 . . . . 0.0 107.976 171.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.3 m -104.82 151.3 23.96 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.668 1.187 . . . . 0.0 109.339 175.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -141.86 -179.58 6.29 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 123.997 0.919 . . . . 0.0 109.866 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 93.3 m -110.83 141.61 43.96 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 167.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.7 p -117.64 34.28 5.22 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 166.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -81.66 149.77 28.38 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.526 0.679 . . . . 0.0 110.259 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.442 HG13 ' HG2' ' A' ' 49' ' ' ARG . 62.6 t -142.7 122.13 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 C-N-CA 126.004 1.722 . . . . 0.0 106.415 -177.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -162.91 -150.25 0.16 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -166.188 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -68.72 -142.96 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 162.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -67.48 158.37 32.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 120.876 -1.14 . . . . 0.0 111.827 -174.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.6 p -74.12 159.2 32.93 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.569 1.548 . . . . 0.0 111.643 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -80.62 177.37 9.06 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -169.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.5 t -78.48 21.59 0.37 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.5 -1.227 . . . . 0.0 113.054 -172.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -155.3 64.34 0.62 Allowed 'General case' 0 C--N 1.341 0.236 0 CA-C-N 118.741 0.7 . . . . 0.0 109.797 173.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 76.5 m -123.79 127.93 48.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.868 0.867 . . . . 0.0 109.327 179.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -102.86 -36.52 8.21 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.769 1.628 . . . . 0.0 107.806 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -106.03 114.87 29.28 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 162.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 24.9 t -134.17 132.64 40.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.622 1.569 . . . . 0.0 107.445 169.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.2 tp -157.34 157.3 33.87 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.6 m -122.22 166.17 15.03 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.827 0.851 . . . . 0.0 110.352 -174.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.7 t -89.73 150.25 22.38 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 168.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -82.88 0.93 41.91 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.149 1.38 . . . . 0.0 112.403 177.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 m -69.33 -178.09 1.28 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.036 1.334 . . . . 0.0 111.512 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -120.3 111.05 35.41 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.727 1.211 . . . . 0.0 108.163 175.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -74.36 149.86 94.62 Favored 'Cis proline' 0 N--CA 1.458 -0.611 0 CA-C-N 119.972 1.026 . . . . 0.0 110.611 0.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -75.94 108.58 2.71 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.754 2.303 . . . . 0.0 108.338 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -104.4 140.17 38.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -177.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 65.8 m -107.07 151.04 25.89 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 123.843 0.857 . . . . 0.0 109.701 -172.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.442 ' HG2' HG13 ' A' ' 27' ' ' VAL . 10.0 mtm105 -144.86 143.27 30.52 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.528 -1.215 . . . . 0.0 108.668 -156.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 46.5 t -112.05 131.92 55.13 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 124.072 0.949 . . . . 0.0 109.014 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -127.43 37.35 4.25 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.286 1.434 . . . . 0.0 109.942 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -56.33 154.99 7.41 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.242 1.017 . . . . 0.0 111.628 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.7 mm -115.25 111.72 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 171.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.3 p -130.5 163.53 26.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.933 1.293 . . . . 0.0 108.135 173.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -70.02 -21.27 63.22 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.895 -0.503 . . . . 0.0 111.54 174.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -130.55 -179.29 5.19 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.898 1.279 . . . . 0.0 111.911 -165.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.8 t -112.78 147.88 35.97 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.642 1.977 . . . . 0.0 109.992 177.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -97.58 159.37 31.23 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 125.914 1.686 . . . . 0.0 109.566 176.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.2 164.5 22.47 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.284 2.656 . . . . 0.0 112.266 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.22 141.61 58.7 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.469 1.107 . . . . 0.0 112.178 -174.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -93.04 -177.03 4.36 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.55 1.14 . . . . 0.0 111.81 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 C--O 1.251 1.142 0 C-N-CA 125.28 1.432 . . . . 0.0 107.863 166.099 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 45.8 p . . . . . 0 N--CA 1.474 0.728 0 N-CA-C 111.283 0.105 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -80.01 168.43 19.2 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.258 0.623 . . . . 0.0 109.667 169.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.8 t -66.62 111.48 3.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.397 0.679 . . . . 0.0 109.957 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.8 t -154.67 146.72 23.63 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.241 1.017 . . . . 0.0 108.934 176.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 11.1 t -155.06 44.68 0.49 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.596 0.759 . . . . 0.0 109.816 -179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 38.8 p -61.87 159.91 13.06 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.157 0.983 . . . . 0.0 110.904 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.37 95.89 0.33 Allowed 'General case' 0 C--N 1.341 0.225 0 C-N-CA 122.793 0.437 . . . . 0.0 111.371 -174.004 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.4 p -127.46 -175.77 3.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.436 1.494 . . . . 0.0 109.785 -176.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 46.4 t -172.0 160.55 5.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.642 1.977 . . . . 0.0 107.329 171.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -108.44 -77.01 0.6 Allowed 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 171.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -88.52 111.49 21.9 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.8 p -118.14 67.08 6.34 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 124.749 1.22 . . . . 0.0 111.377 -177.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.93 145.67 56.85 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.624 2.216 . . . . 0.0 110.453 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.1 m -132.46 159.06 40.43 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.049 0.94 . . . . 0.0 110.933 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.0 p -90.04 157.85 17.61 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.648 1.179 . . . . 0.0 108.932 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.5 mtm105 -108.47 35.92 3.01 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.914 0.886 . . . . 0.0 109.515 176.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 76.1 p -89.15 -176.67 5.2 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.902 1.281 . . . . 0.0 110.264 175.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.5 mm -129.71 113.08 17.72 Favored Pre-proline 0 CA--C 1.536 0.41 0 C-N-CA 124.75 1.22 . . . . 0.0 108.842 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.44 151.63 90.79 Favored 'Cis proline' 0 CA--C 1.538 0.679 0 N-CA-C 109.131 -1.142 . . . . 0.0 109.131 -9.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -75.25 132.54 15.21 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.209 2.606 . . . . 0.0 109.417 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.9 137.17 43.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 173.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 54.0 m -107.74 149.85 27.67 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.227 1.411 . . . . 0.0 108.744 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -135.71 172.19 13.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.134 1.374 . . . . 0.0 108.432 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 18.5 m -127.47 134.42 49.83 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 172.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 67.5 p -115.68 24.97 11.12 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.439 1.096 . . . . 0.0 109.953 174.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -70.82 150.38 45.89 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 123.514 0.726 . . . . 0.0 109.696 172.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 69.2 t -136.51 126.04 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 126.231 1.812 . . . . 0.0 106.244 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.06 -156.37 0.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 -165.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -78.67 -137.89 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.934 1.294 . . . . 0.0 108.438 175.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -63.38 161.82 13.47 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.12 0.873 . . . . 0.0 111.758 -176.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 m -76.11 152.26 36.81 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.368 1.467 . . . . 0.0 108.893 -175.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -76.83 165.82 24.18 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.6 t -49.41 -40.17 35.35 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 126.083 1.753 . . . . 0.0 111.851 -179.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.29 32.21 4.82 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 124.267 1.027 . . . . 0.0 111.742 -177.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 20.4 t -99.69 126.46 45.73 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.637 0.775 . . . . 0.0 109.196 176.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.9 tttm -106.55 -45.36 4.26 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.017 0.927 . . . . 0.0 110.75 -174.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 t -105.28 126.06 51.67 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 172.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.2 t -147.78 142.1 26.27 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.531 1.133 . . . . 0.0 108.172 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.3 tp -148.2 151.77 36.08 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.0 m -126.27 166.18 17.59 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.917 0.887 . . . . 0.0 110.837 -172.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.7 p -83.47 153.52 24.41 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.287 0.635 . . . . 0.0 109.59 171.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -87.55 15.14 7.05 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.675 0.79 . . . . 0.0 111.859 172.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 80.0 p -76.97 -176.45 3.96 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.337 1.055 . . . . 0.0 111.6 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -134.93 114.67 11.92 Favored Pre-proline 0 N--CA 1.451 -0.411 0 C-N-CA 125.007 1.323 . . . . 0.0 108.86 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.06 142.46 72.94 Favored 'Cis proline' 0 N--CA 1.457 -0.659 0 CA-C-N 119.655 0.912 . . . . 0.0 110.033 -1.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.26 125.56 11.48 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.925 2.417 . . . . 0.0 109.097 177.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 30.8 mm100 -106.28 129.85 54.23 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 62.4 m -106.21 149.38 26.9 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.827 0.851 . . . . 0.0 109.325 -175.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.2 mtm105 -142.56 120.79 12.25 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 -160.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 48.4 t -83.8 124.96 31.47 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -178.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -117.97 26.57 9.57 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.266 1.426 . . . . 0.0 111.386 -179.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -57.71 147.2 28.51 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.572 0.749 . . . . 0.0 110.164 -178.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.3 mm -102.32 130.91 51.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 106.198 -1.779 . . . . 0.0 106.198 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 35.5 p -139.81 -171.56 3.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.99 1.316 . . . . 0.0 108.15 -170.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -128.66 15.53 6.47 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.493 1.117 . . . . 0.0 109.922 172.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -159.02 176.91 11.71 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.031 1.333 . . . . 0.0 110.394 -165.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.0 t -123.42 144.81 49.25 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 125.269 1.427 . . . . 0.0 109.63 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -92.51 157.41 40.21 Favored Pre-proline 0 N--CA 1.451 -0.389 0 C-N-CA 125.444 1.498 . . . . 0.0 109.367 175.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.37 162.73 29.3 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.967 2.445 . . . . 0.0 110.789 174.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.08 138.64 58.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 123.825 0.85 . . . . 0.0 112.128 -172.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -81.41 174.97 10.96 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.624 0.77 . . . . 0.0 111.359 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 52.6 m . . . . . 0 C--O 1.25 1.104 0 C-N-CA 125.826 1.65 . . . . 0.0 109.327 173.465 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.6 tptm -75.6 85.8 2.67 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 168.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.7 m -151.6 173.69 14.35 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.326 1.05 . . . . 0.0 109.47 -172.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.2 t -59.6 135.92 57.82 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.1 0.56 . . . . 0.0 110.843 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.2 t -120.99 74.67 1.1 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.276 1.43 . . . . 0.0 108.823 -177.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 64.8 p -65.0 171.03 3.82 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.406 1.083 . . . . 0.0 111.488 178.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.68 101.66 0.09 Allowed 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 124.075 0.95 . . . . 0.0 110.724 174.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.1 p -119.89 -179.2 3.84 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 122.099 0.952 . . . . 0.0 111.023 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.5 t -176.4 175.29 1.81 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 128.17 2.588 . . . . 0.0 105.516 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -142.84 -62.99 0.42 Allowed 'General case' 0 CA--C 1.527 0.083 0 CA-C-N 119.446 1.021 . . . . 0.0 108.833 164.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -90.86 104.78 17.33 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.3 p -118.04 75.01 10.61 Favored Pre-proline 0 CA--C 1.532 0.271 0 C-N-CA 124.852 1.261 . . . . 0.0 111.694 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.42 156.58 65.56 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.707 2.272 . . . . 0.0 110.662 170.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.5 m -142.67 166.2 25.3 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.059 0.944 . . . . 0.0 111.164 -172.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.9 p -82.74 162.0 21.89 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.163 0.985 . . . . 0.0 109.243 166.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -108.24 36.86 2.65 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.884 0.874 . . . . 0.0 109.59 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.7 p -85.15 -177.15 6.45 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.416 1.086 . . . . 0.0 111.018 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.3 tp -123.57 96.65 43.21 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 125.828 1.651 . . . . 0.0 109.474 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.02 163.47 89.38 Favored 'Cis proline' 0 CA--C 1.535 0.558 0 CA-C-N 119.747 0.945 . . . . 0.0 110.549 -3.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -76.89 149.17 28.96 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 123.371 2.714 . . . . 0.0 110.165 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -125.14 133.77 52.69 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.283 1.433 . . . . 0.0 108.413 175.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 77.7 m -109.89 152.73 25.43 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.308 1.443 . . . . 0.0 110.278 176.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -139.42 152.61 47.21 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.136 0.975 . . . . 0.0 108.894 172.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 23.4 m -103.45 118.0 35.74 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 125.03 1.332 . . . . 0.0 107.664 -176.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 50.5 p -107.89 15.95 23.97 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.46 1.104 . . . . 0.0 111.829 -164.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -65.31 152.59 43.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.022 0.439 . . . . 0.0 109.919 167.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.5 t -132.73 119.09 36.63 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.114 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 -176.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.1 mmm-85 -158.79 -162.93 1.16 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.597 1.159 . . . . 0.0 108.857 -162.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.99 -144.92 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.041 0.936 . . . . 0.0 109.082 170.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -61.85 154.62 25.49 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 121.299 -0.876 . . . . 0.0 110.755 -174.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 96.4 m -78.22 168.8 19.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.982 0.913 . . . . 0.0 110.621 -174.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.0 p80 -86.27 171.75 11.0 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.679 0.752 . . . . 0.0 112.818 -175.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.6 t -57.55 -34.42 69.15 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.52 1.528 . . . . 0.0 112.697 -176.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -105.96 44.59 1.03 Allowed 'General case' 0 C--N 1.338 0.096 0 C-N-CA 124.068 0.947 . . . . 0.0 109.723 -175.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 15.9 t -147.57 114.89 6.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -104.6 -36.63 7.42 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.756 1.223 . . . . 0.0 110.549 -162.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.9 t -102.66 108.89 20.31 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 171.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 44.3 t -118.27 129.19 55.32 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.647 1.979 . . . . 0.0 106.833 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -135.02 147.97 49.81 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 125.074 1.349 . . . . 0.0 108.056 -171.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 m -135.44 157.53 46.66 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.371 0.668 . . . . 0.0 110.832 -173.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -84.74 154.37 22.46 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.173 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -90.31 10.74 23.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.693 1.197 . . . . 0.0 111.971 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -70.78 -179.35 2.17 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.681 1.192 . . . . 0.0 111.058 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -120.55 115.17 32.57 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.463 1.105 . . . . 0.0 108.22 171.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -71.97 151.64 96.02 Favored 'Cis proline' 0 N--CA 1.456 -0.681 0 CA-C-N 119.627 0.902 . . . . 0.0 110.04 -2.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -72.25 137.29 28.3 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.458 2.105 . . . . 0.0 107.923 167.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -149.83 145.43 26.57 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -171.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 72.5 m -111.46 162.76 14.75 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.627 0.771 . . . . 0.0 112.658 -161.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 ttp85 -152.44 154.7 36.06 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 127.199 2.2 . . . . 0.0 108.292 -167.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 8.8 m -89.05 125.73 35.13 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.026 0.93 . . . . 0.0 110.23 173.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -105.91 20.33 19.11 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.885 1.274 . . . . 0.0 109.439 169.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -84.25 149.81 25.86 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.702 1.201 . . . . 0.0 109.755 -177.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.9 mm -108.74 135.51 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 124.86 1.264 . . . . 0.0 108.488 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.9 p -139.37 151.21 46.15 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 165.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -64.37 -37.25 86.86 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.635 0.374 . . . . 0.0 110.737 170.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.0 p90 -102.43 -172.94 2.22 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.179 1.792 . . . . 0.0 111.142 -172.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 35.2 t -142.35 149.92 40.05 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.451 1.9 . . . . 0.0 108.763 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -91.65 155.9 43.4 Favored Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 124.914 1.285 . . . . 0.0 109.582 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -63.33 159.69 38.57 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.629 2.219 . . . . 0.0 110.578 175.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.1 m -62.31 143.77 56.52 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 121.252 0.549 . . . . 0.0 111.995 -171.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.7 t -88.04 169.65 11.77 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.956 1.303 . . . . 0.0 110.673 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.251 1.163 0 CA-C-O 117.4 -1.286 . . . . 0.0 108.014 168.592 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 65.7 p . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 120.73 0.3 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -159.9 152.29 20.95 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.761 1.224 . . . . 0.0 108.351 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 40.3 m -151.35 153.67 35.21 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.566 1.146 . . . . 0.0 108.822 173.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.1 t -162.74 165.29 25.72 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.346 1.058 . . . . 0.0 109.378 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 t -78.34 80.85 4.72 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.258 1.023 . . . . 0.0 109.433 173.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 46.3 p -58.79 151.35 21.51 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.736 1.214 . . . . 0.0 111.609 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.25 118.12 6.47 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.793 0.837 . . . . 0.0 110.284 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.0 p -135.49 162.99 31.1 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.264 1.026 . . . . 0.0 111.255 178.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.4 t -171.35 142.02 1.64 Allowed 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 125.939 1.696 . . . . 0.0 108.544 -174.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -103.61 -73.02 0.68 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.195 0.998 . . . . 0.0 108.567 -174.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -77.05 108.05 9.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.0 p -132.94 62.65 63.34 Favored Pre-proline 0 N--CA 1.452 -0.339 0 C-N-CA 124.488 1.115 . . . . 0.0 111.497 -173.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.72 159.38 52.98 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.708 2.272 . . . . 0.0 111.031 178.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 24.1 m -131.3 153.98 49.01 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.839 0.856 . . . . 0.0 110.004 177.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.1 p -82.15 164.12 21.49 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.139 1.375 . . . . 0.0 109.691 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -106.81 25.54 11.15 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.188 0.995 . . . . 0.0 110.744 -177.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.5 p -81.97 -179.68 7.49 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.715 1.206 . . . . 0.0 110.432 176.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -126.84 106.38 22.71 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 124.797 1.239 . . . . 0.0 108.188 179.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.26 159.31 96.06 Favored 'Cis proline' 0 N--CA 1.458 -0.602 0 CA-C-N 119.373 0.812 . . . . 0.0 110.094 -4.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.0 138.23 22.75 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.869 2.38 . . . . 0.0 109.368 173.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -106.52 135.19 48.47 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 173.002 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.8 m -107.1 143.54 35.09 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.283 1.033 . . . . 0.0 108.876 175.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -146.15 159.26 43.55 Favored 'General case' 0 N--CA 1.457 -0.095 0 C-N-CA 124.175 0.99 . . . . 0.0 108.964 -173.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.0 m -106.26 137.47 44.16 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.851 0.86 . . . . 0.0 109.614 -178.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.1 p -120.57 -12.91 8.84 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.429 1.092 . . . . 0.0 112.041 -174.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -65.36 150.38 48.39 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.481 0.582 . . . . 0.0 110.804 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.7 t -118.02 118.16 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 125.186 1.394 . . . . 0.0 107.907 -170.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -141.67 -166.76 2.28 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.781 1.633 . . . . 0.0 108.676 -171.461 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -77.26 -132.86 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 167.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -60.94 150.54 32.96 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.917 1.235 . . . . 0.0 111.31 -173.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.1 p -87.77 151.8 22.61 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 126.357 1.863 . . . . 0.0 109.831 -176.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.3 p80 -72.9 168.24 19.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -159.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.2 t -51.32 -38.09 51.16 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 126.232 1.813 . . . . 0.0 112.188 -178.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.54 31.3 4.77 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.295 1.038 . . . . 0.0 111.513 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 18.2 t -104.48 128.06 52.32 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.153 0.981 . . . . 0.0 108.806 175.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -107.73 -46.68 3.76 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.473 1.109 . . . . 0.0 110.704 -173.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 t -104.97 131.01 53.02 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 172.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 44.8 t -154.75 145.73 22.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.669 1.188 . . . . 0.0 108.434 -174.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 7.4 tt -148.77 150.22 32.71 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.7 m -127.75 159.17 35.61 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.4 1.08 . . . . 0.0 110.211 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 69.0 p -81.56 155.58 25.65 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.569 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.6 ptt85 -93.47 26.01 3.19 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.304 1.441 . . . . 0.0 110.09 170.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.4 m -87.74 178.81 6.63 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.243 1.417 . . . . 0.0 110.66 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -129.19 105.08 17.93 Favored Pre-proline 0 N--CA 1.441 -0.895 0 C-N-CA 126.751 2.021 . . . . 0.0 108.122 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -72.55 155.4 99.01 Favored 'Cis proline' 0 CA--C 1.537 0.653 0 CA-C-N 119.802 0.965 . . . . 0.0 111.054 -1.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -75.84 130.43 12.44 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.604 2.869 . . . . 0.0 109.459 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -121.66 136.64 54.94 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.019 1.328 . . . . 0.0 109.038 -176.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 66.6 m -108.79 156.46 19.6 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.42 1.088 . . . . 0.0 111.556 -172.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -152.85 143.64 22.86 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 124.327 1.051 . . . . 0.0 109.768 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 33.0 t -92.53 121.15 33.69 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 124.928 1.291 . . . . 0.0 109.363 -177.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.07 20.84 18.45 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.874 1.269 . . . . 0.0 111.14 -174.01 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -62.7 150.33 41.39 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.658 0.783 . . . . 0.0 110.964 -175.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.1 mm -105.77 126.41 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 70.4 p -136.34 -169.37 2.43 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.01 1.324 . . . . 0.0 108.714 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -128.83 9.03 5.8 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.392 1.477 . . . . 0.0 110.983 173.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -148.9 -176.11 5.21 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 126.008 1.723 . . . . 0.0 109.811 -169.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.4 t -132.11 144.4 50.69 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.714 1.206 . . . . 0.0 109.207 174.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -88.58 160.27 44.98 Favored Pre-proline 0 CA--C 1.534 0.348 0 C-N-CA 125.14 1.376 . . . . 0.0 109.089 174.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -61.23 162.52 19.74 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.185 1.924 . . . . 0.0 111.198 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.61 138.79 33.7 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.929 1.291 . . . . 0.0 112.076 -177.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.31 175.63 5.99 Favored 'General case' 0 C--O 1.23 0.071 0 C-N-CA 124.406 1.082 . . . . 0.0 110.347 178.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.7 t . . . . . 0 C--O 1.251 1.165 0 C-N-CA 125.247 1.419 . . . . 0.0 108.763 -178.328 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -77.5 -170.32 1.75 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.826 1.25 . . . . 0.0 109.875 172.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.2 m -55.46 155.64 5.19 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.718 1.207 . . . . 0.0 112.391 -177.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.2 t -65.8 163.5 16.62 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.916 0.886 . . . . 0.0 111.991 -174.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.6 t -77.32 85.09 3.75 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.265 1.026 . . . . 0.0 108.896 172.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.2 p -59.85 173.7 0.56 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.783 1.233 . . . . 0.0 110.935 172.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -48.39 109.15 0.21 Allowed 'General case' 0 C--N 1.339 0.149 0 C-N-CA 124.313 1.045 . . . . 0.0 110.987 178.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.6 p -129.73 -176.17 3.83 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 124.844 1.258 . . . . 0.0 109.329 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 49.6 t -171.98 158.22 4.65 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 126.16 1.784 . . . . 0.0 107.447 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -105.67 -60.91 1.56 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -114.8 115.31 26.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.799 1.239 . . . . 0.0 108.54 -177.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 11.0 p -131.81 78.88 69.29 Favored Pre-proline 0 N--CA 1.453 -0.322 0 C-N-CA 125.037 1.335 . . . . 0.0 112.063 -173.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -71.09 161.89 44.47 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.628 2.219 . . . . 0.0 110.919 173.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.0 m -133.03 156.99 46.34 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.382 1.073 . . . . 0.0 109.462 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.1 p -84.5 164.96 18.48 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.098 1.359 . . . . 0.0 110.31 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.7 ptt-85 -108.52 5.49 25.22 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.881 1.272 . . . . 0.0 112.463 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.3 p -73.19 175.99 6.29 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.047 1.339 . . . . 0.0 110.857 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 tp -124.74 115.38 26.65 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 125.001 1.32 . . . . 0.0 108.943 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -70.48 152.23 93.97 Favored 'Cis proline' 0 N--CA 1.458 -0.589 0 CA-C-N 119.798 0.964 . . . . 0.0 109.869 -6.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -79.48 136.77 12.64 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.018 2.478 . . . . 0.0 109.779 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.43 149.93 28.08 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.454 1.501 . . . . 0.0 109.715 170.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 96.6 m -112.47 148.69 33.88 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.515 1.526 . . . . 0.0 109.287 170.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -156.1 169.68 23.94 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.63 1.172 . . . . 0.0 108.981 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 92.3 m -106.87 141.64 37.78 Favored 'General case' 0 CA--C 1.521 -0.173 0 C-N-CA 123.135 0.574 . . . . 0.0 110.916 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.2 t -108.52 -26.17 10.56 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.97 1.308 . . . . 0.0 110.668 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -58.67 142.36 49.88 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-O 121.561 0.696 . . . . 0.0 111.198 -177.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.6 t -113.25 133.96 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 C-N-CA 125.8 1.64 . . . . 0.0 107.471 -172.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.7 tpp180 -160.84 -150.47 0.21 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -174.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -80.05 -150.48 0.06 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.668 0.787 . . . . 0.0 108.93 173.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -60.17 158.12 11.98 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.476 0.655 . . . . 0.0 110.912 -177.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 65.1 m -80.45 163.12 24.04 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.127 -170.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -80.04 172.67 13.47 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.513 0.673 . . . . 0.0 112.242 -174.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.2 t -55.12 -28.93 56.24 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.466 1.507 . . . . 0.0 113.003 -176.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.86 48.59 0.84 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.441 1.096 . . . . 0.0 110.161 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 84.5 m -128.92 133.69 47.97 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 164.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -103.96 -42.19 5.64 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.167 1.387 . . . . 0.0 108.925 -177.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.9 t -105.95 130.04 53.97 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 171.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.8 t -138.91 132.92 31.17 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 125.707 1.603 . . . . 0.0 107.023 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -138.23 148.36 44.69 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 124.205 1.002 . . . . 0.0 109.06 -170.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.0 m -136.41 158.86 43.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.716 0.806 . . . . 0.0 110.318 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.2 t -87.36 155.38 20.06 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 123.516 0.51 . . . . 0.0 110.118 175.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -90.15 8.89 30.61 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.879 1.271 . . . . 0.0 111.578 174.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.6 m -65.55 177.19 1.24 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.244 1.018 . . . . 0.0 110.934 174.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -122.93 113.4 30.02 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 174.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.55 147.37 89.01 Favored 'Cis proline' 0 CA--C 1.538 0.698 0 CA-C-N 119.788 0.96 . . . . 0.0 111.13 0.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.03 106.02 2.19 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.493 2.795 . . . . 0.0 108.772 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -107.9 147.98 30.24 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.051 0.94 . . . . 0.0 109.516 -173.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 91.8 m -116.62 159.68 21.81 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.322 1.049 . . . . 0.0 112.043 -166.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.7 ttp-105 -155.56 149.4 25.37 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 125.05 1.34 . . . . 0.0 109.722 -174.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 44.6 t -82.66 136.59 34.73 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.906 1.282 . . . . 0.0 109.882 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -122.36 18.0 10.59 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.171 1.389 . . . . 0.0 110.917 -178.269 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -79.25 149.1 31.96 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.036 0.934 . . . . 0.0 110.114 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 52.1 mm -108.73 133.73 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 C-N-CA 124.693 1.197 . . . . 0.0 108.763 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 67.4 p -138.9 -169.87 2.73 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.065 1.346 . . . . 0.0 108.233 175.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -117.66 5.71 12.37 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.05 1.34 . . . . 0.0 111.393 171.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -142.33 -178.0 5.53 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.233 1.413 . . . . 0.0 110.39 -171.129 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 41.5 t -140.54 145.5 36.87 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.546 1.138 . . . . 0.0 109.223 174.226 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -79.67 157.6 74.31 Favored Pre-proline 0 N--CA 1.451 -0.382 0 C-N-CA 125.097 1.359 . . . . 0.0 109.793 176.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -60.85 154.35 56.55 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.651 2.234 . . . . 0.0 110.823 177.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.2 138.04 57.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.594 0.758 . . . . 0.0 112.49 -168.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.26 -176.66 5.74 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.035 176.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.7 p . . . . . 0 C--O 1.251 1.15 0 CA-C-O 117.197 -1.382 . . . . 0.0 109.915 167.475 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 48.8 p . . . . . 0 N--CA 1.473 0.702 0 CA-C-O 119.48 -0.295 . . . . 0.0 110.701 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -138.98 144.94 39.17 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 124.252 1.021 . . . . 0.0 109.148 175.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.7 m -159.8 163.07 34.83 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.36 1.464 . . . . 0.0 108.909 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 66.2 p -72.27 169.18 16.75 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.927 0.891 . . . . 0.0 110.642 175.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.1 t -77.5 68.31 3.57 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.536 1.135 . . . . 0.0 110.902 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 69.9 p -65.64 166.16 11.2 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.469 1.108 . . . . 0.0 110.568 175.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.46 86.24 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.705 0.802 . . . . 0.0 110.423 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.7 p -120.17 -168.12 1.57 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 125.765 1.626 . . . . 0.0 109.875 -176.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.8 t -163.05 -178.87 6.31 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.442 1.497 . . . . 0.0 107.296 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -140.34 -56.61 0.53 Allowed 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 164.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 14.4 m-30 -93.43 112.66 24.63 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 176.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.1 m -113.2 68.38 1.2 Allowed Pre-proline 0 CA--C 1.537 0.443 0 C-N-CA 125.723 1.609 . . . . 0.0 111.303 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -79.85 165.15 22.4 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 121.631 1.554 . . . . 0.0 109.854 171.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.6 t -156.69 163.58 39.13 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.957 -178.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 70.6 p -72.96 175.98 6.13 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.981 171.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -106.48 4.93 28.81 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.317 1.047 . . . . 0.0 111.569 170.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 55.8 p -81.2 179.69 7.74 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.7 1.2 . . . . 0.0 112.043 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.5 tp -132.68 107.25 12.94 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 126.337 1.855 . . . . 0.0 108.194 -174.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -70.05 158.75 91.57 Favored 'Cis proline' 0 N--CA 1.457 -0.67 0 CA-C-N 119.808 0.967 . . . . 0.0 111.783 -1.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -78.74 135.95 13.16 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 124.067 3.178 . . . . 0.0 110.315 178.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -106.35 101.82 11.26 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 176.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 38.7 m -108.13 143.25 37.15 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.301 1.04 . . . . 0.0 108.783 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -139.46 177.24 8.07 Favored 'General case' 0 C--N 1.339 0.136 0 O-C-N 123.686 0.616 . . . . 0.0 111.294 -171.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 53.3 m -106.71 131.67 53.58 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 163.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 53.5 p -120.92 -1.71 9.86 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -67.01 137.77 56.73 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 118.507 0.594 . . . . 0.0 110.342 174.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.7 t -112.54 120.78 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 -170.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.1 mmm-85 -150.53 -161.11 1.27 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.225 1.41 . . . . 0.0 108.293 -164.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -68.38 -153.6 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 165.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -56.77 150.74 15.53 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -170.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.6 p -64.02 145.7 55.42 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 113.92 -1.491 . . . . 0.0 110.954 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.1 p80 -71.92 176.04 5.34 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -164.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.5 t -75.05 26.42 0.09 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.857 1.263 . . . . 0.0 113.18 -175.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -157.03 62.79 0.5 Allowed 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.622 0.769 . . . . 0.0 109.693 171.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.2 m -127.07 130.93 50.87 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.935 0.894 . . . . 0.0 109.82 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -105.48 -45.33 4.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.494 1.518 . . . . 0.0 107.572 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.2 t -107.88 139.64 42.17 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 166.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 18.8 t -156.28 147.54 22.4 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.536 1.534 . . . . 0.0 107.914 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.4 tp -156.53 157.05 34.71 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.4 m -126.41 160.69 29.77 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.029 0.932 . . . . 0.0 109.807 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 60.3 p -77.18 155.14 32.47 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.509 0.723 . . . . 0.0 110.596 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -91.25 10.65 26.34 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.918 0.887 . . . . 0.0 111.932 173.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 p -73.31 176.55 5.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.965 0.906 . . . . 0.0 111.071 176.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -128.16 112.23 19.94 Favored Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 124.645 1.178 . . . . 0.0 108.008 174.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.32 150.25 91.27 Favored 'Cis proline' 0 N--CA 1.456 -0.707 0 CA-C-N 119.517 0.863 . . . . 0.0 110.392 -1.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.06 154.6 47.44 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.31 2.673 . . . . 0.0 109.1 172.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -149.92 137.85 20.23 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.121 0.568 . . . . 0.0 109.487 -172.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.3 m -108.22 154.75 21.31 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 123.638 0.775 . . . . 0.0 112.542 -164.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -152.24 148.16 27.24 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.399 1.08 . . . . 0.0 109.526 -176.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 36.2 t -99.71 118.94 37.29 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 125.95 1.7 . . . . 0.0 109.157 -176.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -107.49 26.41 10.27 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.945 0.898 . . . . 0.0 111.704 -171.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -62.11 138.82 58.45 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.526 0.73 . . . . 0.0 110.4 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 19.3 mm -105.4 111.62 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.3 p -138.05 161.15 37.49 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.775 0.83 . . . . 0.0 109.767 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -74.73 -20.7 59.72 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.21 0.604 . . . . 0.0 111.774 173.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 36.0 p90 -115.3 -172.54 2.16 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 125.936 1.694 . . . . 0.0 109.982 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.5 t -145.74 155.45 42.96 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.37 1.068 . . . . 0.0 109.066 171.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -82.64 157.22 67.47 Favored Pre-proline 0 N--CA 1.451 -0.391 0 C-N-CA 124.252 1.021 . . . . 0.0 109.642 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.38 176.23 8.27 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.064 2.509 . . . . 0.0 111.442 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 p -63.3 141.72 58.66 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.948 0.899 . . . . 0.0 112.123 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -82.39 -170.21 2.82 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.539 1.136 . . . . 0.0 111.238 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.6 t . . . . . 0 C--O 1.255 1.39 0 C-N-CA 125.05 1.34 . . . . 0.0 108.621 166.858 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 35.9 p . . . . . 0 N--CA 1.475 0.81 0 CA-C-O 120.754 0.311 . . . . 0.0 111.451 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -164.29 -57.1 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.837 0.855 . . . . 0.0 109.405 176.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 26.5 m -61.26 135.89 57.88 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.031 0.932 . . . . 0.0 110.366 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.1 m -52.64 121.41 7.08 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.798 1.239 . . . . 0.0 111.391 -176.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 42.6 p 1.52 79.06 0.0 OUTLIER 'General case' 0 C--N 1.345 0.402 0 C-N-CA 129.544 3.138 . . . . 0.0 114.559 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 65.1 p -69.22 159.01 33.84 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.058 0.543 . . . . 0.0 110.771 -176.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -72.23 93.28 1.45 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 174.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.0 p -143.15 169.32 17.82 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 122.1 0.952 . . . . 0.0 111.505 178.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.8 t -158.32 153.13 24.96 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 126.234 1.814 . . . . 0.0 107.113 -168.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -107.26 -70.79 0.78 Allowed 'General case' 0 C--N 1.339 0.109 0 C-N-CA 123.406 0.682 . . . . 0.0 109.751 -170.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -89.89 111.68 22.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 173.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 4.8 t -126.68 69.1 70.47 Favored Pre-proline 0 CA--C 1.533 0.302 0 O-C-N 123.853 0.721 . . . . 0.0 112.461 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.1 158.99 55.69 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.8 2.333 . . . . 0.0 110.924 174.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.1 m -136.75 158.09 45.26 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.972 0.909 . . . . 0.0 110.926 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.3 p -79.2 163.83 24.69 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.618 0.767 . . . . 0.0 109.082 172.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 68.9 mtp85 -113.36 33.39 5.14 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.827 0.851 . . . . 0.0 109.862 172.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.3 p -78.71 176.91 9.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.507 1.123 . . . . 0.0 109.687 168.071 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.6 mm -127.76 111.72 20.56 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.577 1.151 . . . . 0.0 108.203 176.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.1 157.67 89.93 Favored 'Cis proline' 0 CA--C 1.537 0.668 0 CA-C-N 119.206 0.752 . . . . 0.0 110.218 -5.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -82.46 146.87 13.91 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.866 3.044 . . . . 0.0 110.734 175.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -120.64 130.14 54.02 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.673 1.589 . . . . 0.0 108.106 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 80.1 m -106.93 144.39 33.64 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.979 1.311 . . . . 0.0 109.164 174.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -140.74 160.34 40.26 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.103 1.361 . . . . 0.0 109.652 -176.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.6 m -107.29 125.96 51.82 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 124.271 1.028 . . . . 0.0 109.535 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.1 p -108.95 -17.8 13.83 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.475 1.11 . . . . 0.0 112.157 -172.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -62.34 142.84 57.59 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.127 0.571 . . . . 0.0 111.191 176.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.8 t -114.16 137.32 47.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 125.342 1.457 . . . . 0.0 107.838 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -160.07 -153.63 0.35 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 -174.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -76.72 -153.83 0.05 Allowed 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.834 0.854 . . . . 0.0 108.887 167.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 158.44 7.75 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.368 0.667 . . . . 0.0 112.017 -171.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.2 m -72.51 164.83 25.78 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.997 0.919 . . . . 0.0 111.424 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 22.7 p80 -78.07 168.76 19.37 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.79 0.805 . . . . 0.0 112.689 -171.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.7 t -58.62 -23.14 58.34 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 114.055 -1.43 . . . . 0.0 113.401 -172.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -119.74 29.57 7.5 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.373 1.069 . . . . 0.0 112.11 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.9 t -88.16 139.16 30.79 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 172.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -104.31 -51.9 3.02 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.649 1.18 . . . . 0.0 109.92 -175.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.3 t -107.22 119.67 40.03 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 48.8 t -126.81 138.92 53.42 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 125.441 1.497 . . . . 0.0 108.107 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.6 tp -144.29 153.31 41.89 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.7 m -130.41 156.28 45.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.053 0.941 . . . . 0.0 109.666 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -90.31 152.55 20.98 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 123.446 0.467 . . . . 0.0 110.002 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -88.54 15.3 8.21 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.222 1.009 . . . . 0.0 111.887 174.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 m -67.24 172.87 4.3 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.883 0.873 . . . . 0.0 110.545 173.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -125.93 113.14 24.44 Favored Pre-proline 0 CA--C 1.532 0.264 0 C-N-CA 124.018 0.927 . . . . 0.0 109.075 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.03 154.02 93.86 Favored 'Cis proline' 0 CA--C 1.54 0.783 0 CA-C-N 119.56 0.879 . . . . 0.0 110.92 -2.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -84.43 126.38 3.6 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.221 3.281 . . . . 0.0 109.987 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -113.83 158.44 21.02 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.555 1.142 . . . . 0.0 109.237 174.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 98.6 m -113.64 159.53 19.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.871 1.269 . . . . 0.0 110.52 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -156.19 144.8 20.12 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.699 1.2 . . . . 0.0 108.786 -174.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 53.1 t -91.64 122.36 34.14 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.655 -175.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -103.68 5.15 36.14 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.459 1.504 . . . . 0.0 111.286 -174.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -59.93 127.91 34.26 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.669 0.788 . . . . 0.0 109.787 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 35.8 mm -106.72 129.68 59.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 p -142.99 153.83 43.39 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 123.163 0.585 . . . . 0.0 109.648 178.288 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -62.83 -39.77 95.37 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.154 0.581 . . . . 0.0 110.67 172.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -88.89 -176.65 5.27 Favored 'General case' 0 N--CA 1.458 -0.071 0 C-N-CA 124.36 1.064 . . . . 0.0 110.045 173.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 10.6 t -151.78 153.16 33.73 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.464 0.706 . . . . 0.0 110.112 165.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -73.95 153.32 88.88 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 124.58 1.152 . . . . 0.0 109.464 175.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -72.75 179.9 4.82 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.097 2.531 . . . . 0.0 111.291 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.96 136.63 51.75 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.613 1.165 . . . . 0.0 112.132 -176.044 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -87.03 171.83 10.44 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.78 177.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 C--O 1.249 1.057 0 C-N-CA 129.996 3.319 . . . . 0.0 107.677 -174.44 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 47.6 p . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 110.807 -0.072 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -73.51 96.74 2.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.701 0.801 . . . . 0.0 110.325 -176.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 71.6 p -114.2 75.48 0.93 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.812 1.245 . . . . 0.0 109.736 -176.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.2 t -155.82 169.78 23.61 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.255 1.022 . . . . 0.0 109.437 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 76.9 p -1.14 84.64 0.0 OUTLIER 'General case' 0 C--N 1.347 0.468 0 C-N-CA 129.403 3.081 . . . . 0.0 113.72 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.2 p -78.99 148.76 32.45 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.527 0.731 . . . . 0.0 110.699 -173.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.08 135.99 56.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.453 0.701 . . . . 0.0 109.67 171.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.6 p -156.7 166.1 34.36 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.897 0.856 . . . . 0.0 111.932 170.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 t -168.08 156.48 8.9 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.496 1.918 . . . . 0.0 108.122 -176.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -104.22 -68.2 0.86 Allowed 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -84.63 99.23 10.65 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.7 t -117.14 77.49 9.38 Favored Pre-proline 0 CA--C 1.531 0.227 0 C-N-CA 124.233 1.013 . . . . 0.0 111.292 178.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -74.44 159.64 42.88 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.02 1.813 . . . . 0.0 110.242 170.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.5 m -134.39 156.85 47.79 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.669 1.188 . . . . 0.0 108.638 173.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.4 p -77.84 170.13 17.11 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.501 0.721 . . . . 0.0 109.984 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -108.28 10.09 27.8 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.813 1.245 . . . . 0.0 112.309 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.4 p -73.17 179.78 3.7 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.559 1.544 . . . . 0.0 111.868 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 tp -128.4 101.42 21.61 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 125.858 1.663 . . . . 0.0 108.966 -176.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -75.12 155.31 99.83 Favored 'Cis proline' 0 CA--C 1.536 0.61 0 CA-C-N 119.788 0.96 . . . . 0.0 110.492 -2.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -81.64 140.5 11.81 Favored 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 123.245 2.63 . . . . 0.0 109.712 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.46 141.13 40.79 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.27 1.428 . . . . 0.0 108.004 174.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 93.0 m -107.54 144.69 34.18 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.879 1.272 . . . . 0.0 109.333 176.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -144.27 -179.84 6.78 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.641 1.576 . . . . 0.0 108.576 -173.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 8.2 m -135.05 146.58 49.1 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 120.97 0.414 . . . . 0.0 111.352 175.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 80.7 p -121.64 17.51 11.18 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.271 1.428 . . . . 0.0 110.518 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -75.13 150.9 38.64 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.987 0.915 . . . . 0.0 108.98 174.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.406 HG13 ' HG2' ' A' ' 49' ' ' ARG . 59.8 t -141.46 112.35 3.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 C-N-CA 125.029 1.332 . . . . 0.0 108.536 -170.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.1 mtp-105 -144.07 -153.3 0.46 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.833 0.853 . . . . 0.0 108.8 -171.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -76.2 -131.03 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 169.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -63.7 162.82 12.53 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.46 1.027 . . . . 0.0 112.098 -174.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.7 m -88.11 151.01 23.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.374 1.469 . . . . 0.0 109.347 -172.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.0 p80 -84.03 174.72 10.06 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 121.934 0.873 . . . . 0.0 113.131 -172.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.7 t -59.11 -34.99 72.66 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.568 1.547 . . . . 0.0 112.873 -173.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.59 46.23 0.98 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.122 0.969 . . . . 0.0 110.164 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 11.2 t -144.13 103.3 3.99 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 175.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -102.77 -35.2 8.73 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 125.801 1.64 . . . . 0.0 109.255 -166.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t -102.81 125.33 49.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 170.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 11.0 t -154.87 144.29 21.27 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.57 1.148 . . . . 0.0 107.953 -172.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.5 tp -146.95 141.39 26.43 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -176.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.1 m -113.0 153.94 27.26 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.215 1.006 . . . . 0.0 110.488 -174.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.7 t -89.75 154.76 19.67 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.364 -175.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -90.13 16.33 8.65 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.76 1.224 . . . . 0.0 111.572 174.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 m -75.44 178.47 5.89 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.209 1.004 . . . . 0.0 110.547 174.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -126.88 115.65 22.26 Favored Pre-proline 0 CA--C 1.535 0.388 0 C-N-CA 124.441 1.096 . . . . 0.0 108.47 174.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.0 146.57 87.04 Favored 'Cis proline' 0 N--CA 1.456 -0.708 0 CA-C-N 119.772 0.954 . . . . 0.0 110.509 0.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -76.73 121.53 5.96 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 123.05 2.5 . . . . 0.0 109.485 176.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -120.78 156.89 30.91 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.265 1.426 . . . . 0.0 109.401 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.9 m -108.08 142.48 38.2 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.508 0.723 . . . . 0.0 110.608 -176.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.406 ' HG2' HG13 ' A' ' 27' ' ' VAL . 16.4 mtm-85 -126.71 131.63 51.32 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 126.782 2.033 . . . . 0.0 106.783 -167.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 5.8 m -76.36 136.1 39.52 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.171 0.441 . . . . 0.0 110.023 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -118.34 15.46 13.91 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.64 1.576 . . . . 0.0 109.866 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -82.01 152.25 26.76 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.529 1.132 . . . . 0.0 111.299 -169.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 45.6 mm -116.5 132.65 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 124.963 1.305 . . . . 0.0 108.202 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.9 p -134.95 177.89 7.45 Favored 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 159.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -78.64 -20.56 50.04 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.974 -0.454 . . . . 0.0 111.145 172.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -123.47 174.36 7.43 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 126.045 1.738 . . . . 0.0 111.721 -169.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 7.6 m -107.55 157.13 18.29 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.314 1.446 . . . . 0.0 110.33 176.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -100.27 156.9 34.73 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 126.67 1.988 . . . . 0.0 108.086 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -69.19 174.33 9.16 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.04 2.493 . . . . 0.0 112.073 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.7 p -63.11 145.14 56.11 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.92 0.888 . . . . 0.0 112.105 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -113.23 -179.05 3.53 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 125.115 1.366 . . . . 0.0 111.903 -173.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.251 1.178 0 C-N-CA 125.347 1.459 . . . . 0.0 110.302 179.166 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.474 0.753 0 CA-C-O 119.845 -0.121 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -167.27 117.59 0.86 Allowed 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.424 1.09 . . . . 0.0 108.123 177.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.5 m -149.77 124.82 10.01 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.9 t -164.19 179.85 6.6 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.319 1.048 . . . . 0.0 109.232 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.0 t -150.25 67.41 0.97 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.843 1.257 . . . . 0.0 108.539 177.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.1 p -71.43 -179.45 2.5 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.653 1.181 . . . . 0.0 111.526 -178.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -52.33 118.95 3.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.95 0.9 . . . . 0.0 110.488 172.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.9 p -146.25 -179.97 7.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.582 1.153 . . . . 0.0 109.705 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 44.5 t -170.68 156.97 5.48 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.176 1.79 . . . . 0.0 107.2 174.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -105.57 -64.63 1.12 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.379 0.671 . . . . 0.0 109.552 -176.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -101.46 112.1 24.53 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 172.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 9.1 t -130.29 75.75 78.75 Favored Pre-proline 0 CA--C 1.531 0.227 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.84 158.29 53.28 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 122.605 2.203 . . . . 0.0 111.149 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.6 m -136.97 156.95 47.79 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.27 1.028 . . . . 0.0 110.61 -178.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 74.7 p -82.54 159.45 22.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 168.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 -106.65 31.21 5.41 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.506 0.722 . . . . 0.0 109.929 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.8 p -75.21 176.96 6.85 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.034 1.334 . . . . 0.0 110.167 173.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 34.4 mm -125.4 106.41 27.42 Favored Pre-proline 0 CA--C 1.533 0.292 0 C-N-CA 124.525 1.13 . . . . 0.0 108.384 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -72.8 161.38 93.55 Favored 'Cis proline' 0 CA--C 1.539 0.742 0 N-CA-C 109.856 -0.863 . . . . 0.0 109.856 -5.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -74.93 151.6 40.11 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 123.393 2.729 . . . . 0.0 110.418 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -122.32 119.26 30.58 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.941 1.296 . . . . 0.0 108.171 176.456 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 75.5 m -106.93 141.52 38.02 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.055 1.342 . . . . 0.0 109.492 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.19 162.41 36.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.919 1.288 . . . . 0.0 110.579 -178.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.3 m -104.29 131.28 51.79 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.977 1.311 . . . . 0.0 109.385 -176.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 47.4 p -107.55 -26.36 10.94 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.293 1.037 . . . . 0.0 111.124 -178.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -61.67 144.01 55.22 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.076 0.465 . . . . 0.0 109.82 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.5 t -118.73 142.34 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -158.23 -150.84 0.27 Allowed 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -170.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -74.75 -149.57 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 162.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -64.14 160.19 18.85 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.951 0.881 . . . . 0.0 112.267 -170.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 7.4 p -67.22 162.12 23.32 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.193 1.797 . . . . 0.0 111.626 176.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -82.0 173.11 12.51 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.032 0.933 . . . . 0.0 113.123 -172.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.8 t -57.75 -33.09 68.11 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.551 1.541 . . . . 0.0 112.943 -173.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.57 42.8 1.27 Allowed 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 124.064 0.946 . . . . 0.0 110.574 -177.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.6 t -117.59 128.95 55.45 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.03 0.932 . . . . 0.0 108.936 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.0 tttp -104.78 -47.31 4.08 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 124.064 0.945 . . . . 0.0 110.113 -171.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.0 p -103.61 125.85 50.38 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 125.639 1.576 . . . . 0.0 106.993 172.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 38.5 t -148.95 140.22 23.19 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.474 1.11 . . . . 0.0 108.244 -166.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.88 156.82 46.03 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 124.178 0.991 . . . . 0.0 109.673 -167.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 34.1 m -138.59 161.69 36.45 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.069 0.948 . . . . 0.0 109.815 174.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 44.9 p -87.28 150.78 23.65 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.046 0.938 . . . . 0.0 110.082 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -85.55 10.36 13.34 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.784 0.833 . . . . 0.0 112.411 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.0 p -71.28 176.41 4.59 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.859 1.264 . . . . 0.0 111.145 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -129.68 114.72 18.0 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.625 171.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.09 145.43 82.28 Favored 'Cis proline' 0 CA--C 1.54 0.806 0 CA-C-N 119.596 0.891 . . . . 0.0 110.743 -0.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.33 125.18 8.94 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.372 2.714 . . . . 0.0 109.43 177.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -109.36 143.0 39.49 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.635 1.174 . . . . 0.0 109.269 -178.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 64.1 m -113.5 160.81 18.09 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.043 0.937 . . . . 0.0 111.754 -169.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -159.5 163.68 35.05 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.75 1.22 . . . . 0.0 110.142 -170.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 52.8 t -99.28 142.6 30.56 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.746 1.218 . . . . 0.0 109.441 175.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -111.91 -12.17 13.8 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.441 1.097 . . . . 0.0 111.635 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.31 142.72 54.34 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.335 1.054 . . . . 0.0 112.708 -174.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.0 mm -105.96 133.27 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 125.748 1.619 . . . . 0.0 107.597 -172.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.8 p -131.88 158.23 41.9 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.088 0.47 . . . . 0.0 111.137 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -74.42 -44.08 53.46 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.023 1.329 . . . . 0.0 110.627 172.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -93.06 -167.95 1.83 Allowed 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 124.96 1.304 . . . . 0.0 108.294 170.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 7.8 t -147.61 154.96 41.31 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 157.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -72.27 153.4 92.28 Favored Pre-proline 0 N--CA 1.451 -0.424 0 C-N-CA 124.693 1.197 . . . . 0.0 109.817 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -72.7 174.83 11.14 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.277 2.652 . . . . 0.0 111.472 -176.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.38 132.06 43.38 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.491 1.116 . . . . 0.0 111.88 -176.459 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.6 t -86.35 169.09 13.26 Favored 'General case' 0 N--CA 1.457 -0.092 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.02 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.25 1.093 0 CA-C-O 117.349 -1.31 . . . . 0.0 108.38 168.043 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 43.6 p . . . . . 0 N--CA 1.475 0.776 0 CA-C-O 119.644 -0.217 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -163.54 127.03 2.71 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.292 1.037 . . . . 0.0 108.51 178.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 69.4 p -83.09 69.71 9.91 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.933 0.893 . . . . 0.0 110.703 -176.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 19.8 p -136.22 147.27 47.52 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 125.741 1.617 . . . . 0.0 108.249 177.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 12.3 t -155.31 -154.12 0.48 Allowed 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -177.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.3 p -75.47 -176.18 3.09 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.359 1.864 . . . . 0.0 110.737 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -44.88 121.37 2.73 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.671 1.189 . . . . 0.0 110.246 167.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.1 p -141.29 -179.59 6.21 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.08 0.952 . . . . 0.0 110.197 -175.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 29.5 t -173.68 150.63 1.75 Allowed 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.459 1.904 . . . . 0.0 106.582 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -106.0 -70.9 0.77 Allowed 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -174.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -85.04 109.33 18.13 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 174.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.4 t -126.2 73.16 72.05 Favored Pre-proline 0 CA--C 1.528 0.134 0 C-N-CA 122.721 0.408 . . . . 0.0 111.453 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -69.27 162.11 43.15 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.284 1.989 . . . . 0.0 110.504 172.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 21.3 m -136.12 158.68 43.83 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.944 0.898 . . . . 0.0 109.803 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.9 p -80.86 163.51 23.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.71 0.804 . . . . 0.0 109.324 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 85.4 mtm180 -108.73 32.26 5.01 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.782 0.833 . . . . 0.0 110.665 175.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 29.9 p -87.6 -177.54 5.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.576 1.151 . . . . 0.0 110.92 179.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.2 tp -127.1 100.6 26.8 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 125.519 1.528 . . . . 0.0 109.568 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.62 159.14 97.93 Favored 'Cis proline' 0 N--CA 1.458 -0.575 0 CA-C-N 119.684 0.923 . . . . 0.0 110.357 -3.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -80.12 147.85 18.86 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.162 2.575 . . . . 0.0 109.775 171.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.64 137.68 52.48 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.342 1.457 . . . . 0.0 107.985 172.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.6 m -108.23 144.77 35.24 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.992 1.317 . . . . 0.0 108.724 173.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -150.63 155.91 40.31 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.989 1.316 . . . . 0.0 108.47 -171.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.8 m -104.63 128.44 52.66 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.344 0.657 . . . . 0.0 109.671 -174.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 46.3 p -108.78 1.86 21.31 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.934 0.894 . . . . 0.0 111.802 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -71.17 154.03 42.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.39 0.614 . . . . 0.0 109.949 170.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.422 HG13 ' HG3' ' A' ' 49' ' ' ARG . 95.8 t -142.42 131.8 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 125.276 1.43 . . . . 0.0 107.409 -175.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.4 ttp85 -156.43 -145.76 0.16 Allowed 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 -173.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -69.05 -92.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.098 1.759 . . . . 0.0 109.96 -176.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -105.05 168.69 8.89 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.334 1.453 . . . . 0.0 109.136 168.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.2 p -82.51 169.61 16.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.654 1.582 . . . . 0.0 110.804 170.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -84.51 175.17 9.47 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.91 0.884 . . . . 0.0 111.687 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.8 t -61.71 -30.85 71.03 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.684 1.194 . . . . 0.0 112.832 -176.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.79 45.78 0.96 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.048 0.939 . . . . 0.0 110.196 -174.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -130.69 124.31 31.28 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.134 1.374 . . . . 0.0 108.844 170.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -106.27 -32.06 8.35 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 125.943 1.697 . . . . 0.0 110.133 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.1 p -99.55 57.61 1.03 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.283 1.433 . . . . 0.0 107.843 -175.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.3 t -106.97 131.49 53.98 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.1 -1.864 . . . . 0.0 108.717 -172.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.3 tp -155.48 141.92 18.64 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -172.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 m -120.08 151.57 38.84 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.251 1.02 . . . . 0.0 110.472 -173.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -85.19 154.18 22.16 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 -176.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.7 mtm105 -91.59 11.83 22.97 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.449 1.1 . . . . 0.0 111.498 176.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -72.5 178.94 3.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.586 1.154 . . . . 0.0 109.919 175.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -123.99 118.71 26.8 Favored Pre-proline 0 CA--C 1.532 0.27 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -75.03 143.58 78.24 Favored 'Cis proline' 0 CA--C 1.539 0.739 0 CA-C-N 119.664 0.916 . . . . 0.0 110.932 2.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -77.09 106.45 2.25 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.453 2.768 . . . . 0.0 109.122 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -110.74 150.42 29.1 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.926 1.29 . . . . 0.0 109.758 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -108.83 147.76 31.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.422 ' HG3' HG13 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -128.92 167.32 17.57 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.334 1.854 . . . . 0.0 109.13 -178.667 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 44.7 t -135.84 135.37 39.75 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.506 1.122 . . . . 0.0 110.449 174.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -112.97 42.25 1.92 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.621 1.568 . . . . 0.0 110.624 -173.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -62.75 158.24 19.14 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -174.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 30.3 mm -133.65 104.05 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 176.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.5 p -138.23 152.13 48.3 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.082 0.553 . . . . 0.0 109.879 175.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -66.65 -41.11 88.73 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.934 0.494 . . . . 0.0 110.242 172.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -88.8 -173.46 4.12 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.532 1.133 . . . . 0.0 109.447 172.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 6.6 t -156.58 159.65 38.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.768 0.827 . . . . 0.0 109.468 165.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -74.85 148.81 85.16 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 123.61 0.764 . . . . 0.0 109.527 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.28 171.32 16.29 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.133 2.556 . . . . 0.0 111.229 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.26 131.86 46.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.467 1.107 . . . . 0.0 111.737 -177.114 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -81.01 177.91 8.76 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.108 174.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.1 p . . . . . 0 C--O 1.252 1.191 0 CA-C-O 117.278 -1.344 . . . . 0.0 108.704 168.307 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 70.1 p . . . . . 0 N--CA 1.475 0.822 0 CA-C-O 119.655 -0.212 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -73.1 96.32 2.18 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 175.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.6 t -158.27 143.87 16.83 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.067 0.947 . . . . 0.0 109.306 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.0 t -165.3 143.09 6.01 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.516 1.126 . . . . 0.0 109.327 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 11.6 t -165.96 43.36 0.07 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.712 1.205 . . . . 0.0 109.326 176.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.3 p -70.05 148.86 48.29 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.753 0.821 . . . . 0.0 111.146 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.52 97.78 3.13 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 124.272 1.029 . . . . 0.0 110.175 178.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.2 p -135.12 -176.21 4.18 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.09 0.956 . . . . 0.0 110.542 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 39.1 t -166.33 167.07 16.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.37 1.868 . . . . 0.0 107.313 175.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -113.98 -66.24 1.11 Allowed 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 168.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -80.33 110.42 15.76 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.292 1.037 . . . . 0.0 109.959 178.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.1 m -117.35 69.74 5.79 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 124.869 1.267 . . . . 0.0 111.055 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -76.81 162.4 32.5 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.083 1.856 . . . . 0.0 110.634 171.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 43.8 t -154.28 157.58 38.89 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.113 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.4 p -90.37 157.0 17.84 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.221 1.009 . . . . 0.0 109.066 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.9 mtm105 -106.88 42.59 1.27 Allowed 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.913 0.885 . . . . 0.0 109.823 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 p -96.6 179.77 4.88 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 126.066 1.746 . . . . 0.0 110.153 177.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -131.58 101.68 15.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 124.927 1.291 . . . . 0.0 107.989 -178.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -71.82 156.96 97.34 Favored 'Cis proline' 0 CA--C 1.537 0.642 0 CA-C-N 119.407 0.824 . . . . 0.0 110.615 -1.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -74.66 141.92 28.35 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 123.476 2.784 . . . . 0.0 110.542 174.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -104.77 109.6 21.61 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 171.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 68.4 m -107.21 148.1 29.33 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 125.009 1.324 . . . . 0.0 109.297 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -153.55 163.0 40.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.484 -167.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.1 t -107.77 128.46 54.6 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.651 1.18 . . . . 0.0 108.537 174.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 77.2 p -122.56 6.96 9.48 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.426 0.691 . . . . 0.0 112.385 -172.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -67.05 143.31 56.8 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 119.029 0.831 . . . . 0.0 111.345 179.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.9 t -108.69 126.35 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 125.947 1.699 . . . . 0.0 106.733 -178.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -165.8 -160.52 0.45 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -166.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -72.53 -153.07 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.594 0.758 . . . . 0.0 109.017 168.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -58.85 151.2 22.07 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.514 0.674 . . . . 0.0 112.051 -169.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 p -71.92 148.91 45.59 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.228 1.411 . . . . 0.0 111.037 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.2 p80 -75.02 170.75 15.39 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.459 -0.791 . . . . 0.0 113.097 -169.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.5 t -60.45 -31.83 70.81 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.774 1.23 . . . . 0.0 112.355 -174.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.39 36.59 2.55 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.993 0.917 . . . . 0.0 111.118 -177.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 48.7 t -114.56 136.2 53.29 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 125.409 1.483 . . . . 0.0 107.832 174.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -105.84 -54.91 2.4 Favored 'General case' 0 CA--C 1.522 -0.097 0 C-N-CA 124.116 0.966 . . . . 0.0 109.684 -168.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.3 t -105.35 137.1 43.69 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 107.381 -1.341 . . . . 0.0 107.381 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.6 t -154.42 143.71 21.29 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.167 0.987 . . . . 0.0 109.164 -168.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 64.6 tp -152.41 151.75 31.18 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 124.458 1.103 . . . . 0.0 108.874 -175.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.2 m -130.28 163.95 25.65 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.874 0.87 . . . . 0.0 110.866 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.8 p -84.25 156.99 21.73 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.84 0.856 . . . . 0.0 110.39 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.5 ptt180 -93.46 12.82 23.69 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.342 1.057 . . . . 0.0 111.753 174.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.3 p -77.35 -179.96 6.05 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 124.467 1.107 . . . . 0.0 111.687 -177.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -130.24 106.71 16.21 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.784 1.234 . . . . 0.0 108.391 174.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.66 152.84 96.76 Favored 'Cis proline' 0 N--CA 1.456 -0.7 0 CA-C-N 119.513 0.862 . . . . 0.0 110.862 1.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.16 153.83 46.45 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.184 2.589 . . . . 0.0 108.713 170.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -148.58 135.81 20.24 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -174.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 74.8 m -107.3 157.45 17.92 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.067 0.947 . . . . 0.0 111.32 -168.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 19.8 ttp-105 -154.23 153.13 31.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.916 1.286 . . . . 0.0 108.879 -171.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.7 m -89.43 152.41 21.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.584 1.154 . . . . 0.0 110.754 173.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -130.41 21.93 5.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.109 1.764 . . . . 0.0 109.384 170.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -67.48 124.75 24.06 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.022 1.329 . . . . 0.0 109.796 -177.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 32.3 mm -107.84 122.05 61.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.9 p -139.41 179.46 6.53 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.264 1.426 . . . . 0.0 108.662 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -78.57 -9.64 59.43 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.967 -0.458 . . . . 0.0 111.431 172.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -138.02 -170.22 2.74 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.94 1.696 . . . . 0.0 110.34 -170.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 35.4 t -154.51 153.11 30.94 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.353 1.461 . . . . 0.0 108.506 171.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -78.9 151.59 76.5 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.975 0.91 . . . . 0.0 110.44 -176.344 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -70.13 173.47 11.25 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.053 2.502 . . . . 0.0 112.062 -173.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.1 p -59.28 133.59 56.24 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.115 0.966 . . . . 0.0 112.413 -174.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.84 176.29 8.18 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.341 -1.299 . . . . 0.0 110.903 178.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 59.2 p . . . . . 0 C--O 1.251 1.141 0 CA-C-O 117.15 -1.405 . . . . 0.0 108.961 168.641 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 76.1 p . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 119.944 -0.074 . . . . 0.0 110.806 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -67.77 169.83 8.96 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 171.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 72.7 p -59.5 -175.67 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.706 1.202 . . . . 0.0 111.176 164.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.8 p -76.73 -149.93 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.227 1.011 . . . . 0.0 109.994 177.308 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.0 t -78.85 55.68 1.77 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.582 1.153 . . . . 0.0 111.258 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 65.5 p -71.6 175.58 5.49 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.002 1.321 . . . . 0.0 110.393 174.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.91 115.4 2.37 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.773 0.829 . . . . 0.0 110.109 174.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.0 p -149.65 -171.34 3.87 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 123.779 0.831 . . . . 0.0 110.07 -170.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 t -169.96 -177.34 2.57 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.101 1.76 . . . . 0.0 106.906 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.422 ' H ' ' HB2' ' A' ' 26' ' ' ASP . 9.3 t70 -108.42 -52.65 2.74 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 171.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -147.89 146.64 29.13 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.302 1.041 . . . . 0.0 108.601 162.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -136.03 96.34 12.98 Favored Pre-proline 0 N--CA 1.448 -0.541 0 C-N-CA 124.916 1.286 . . . . 0.0 111.139 -175.753 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.01 166.68 28.68 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.578 2.185 . . . . 0.0 110.819 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.4 m -128.71 153.44 47.33 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.213 1.005 . . . . 0.0 110.215 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.4 p -84.31 158.78 21.08 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.834 1.653 . . . . 0.0 108.998 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 42.1 mtm105 -106.13 36.71 2.48 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.083 0.953 . . . . 0.0 109.825 -177.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -90.83 178.04 6.15 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.786 1.634 . . . . 0.0 110.124 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.9 tp -131.18 98.68 18.46 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 125.481 1.513 . . . . 0.0 108.849 -175.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -73.95 154.96 99.87 Favored 'Cis proline' 0 CA--C 1.536 0.622 0 CA-C-N 119.693 0.926 . . . . 0.0 111.126 0.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -78.82 140.25 16.17 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 123.54 2.826 . . . . 0.0 109.924 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -107.24 159.15 16.56 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.696 1.198 . . . . 0.0 108.833 173.401 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 72.8 m -132.12 142.53 49.53 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.9 1.28 . . . . 0.0 109.132 179.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -143.8 174.25 10.98 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.211 1.004 . . . . 0.0 108.605 -173.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.1 m -102.68 150.89 22.99 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 174.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.6 t -104.68 -9.52 18.14 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.366 163.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.422 ' HB2' ' H ' ' A' ' 10' ' ' ASP . 21.9 t0 -55.92 149.7 14.64 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.986 1.314 . . . . 0.0 112.313 173.427 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.535 HG13 ' HG2' ' A' ' 49' ' ' ARG . 53.6 t -144.23 147.15 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 127.763 2.425 . . . . 0.0 105.914 174.427 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -155.19 -152.41 0.4 Allowed 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 -173.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -78.9 -116.3 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 155.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -68.53 158.27 34.22 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.894 1.225 . . . . 0.0 111.855 -178.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 4.1 p -82.59 163.3 21.55 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.49 1.916 . . . . 0.0 110.754 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 33.5 p80 -71.22 168.05 18.1 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -167.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.4 t -52.02 -37.85 54.87 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.871 1.668 . . . . 0.0 112.634 -173.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.35 24.77 12.34 Favored 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 124.367 1.067 . . . . 0.0 112.513 -175.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.9 t -91.21 127.46 36.65 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 175.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 tttp -104.85 -45.25 4.62 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.573 0.749 . . . . 0.0 110.452 -172.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.5 t -104.67 129.55 52.82 Favored 'General case' 0 CA--C 1.523 -0.085 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 172.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.6 t -150.38 140.66 22.26 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.006 0.922 . . . . 0.0 108.634 -168.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 22.4 tp -153.38 158.97 42.27 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.875 0.87 . . . . 0.0 109.436 -169.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 24.6 m -123.74 165.98 16.35 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.344 0.657 . . . . 0.0 111.102 -175.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -93.18 150.67 20.33 Favored 'General case' 0 C--N 1.341 0.221 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 169.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -91.69 15.24 13.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.54 1.136 . . . . 0.0 111.922 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -67.2 172.36 4.79 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 123.86 0.864 . . . . 0.0 110.593 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -121.07 110.32 34.75 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 172.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -74.21 152.7 98.56 Favored 'Cis proline' 0 CA--C 1.54 0.816 0 CA-C-N 119.592 0.89 . . . . 0.0 110.775 -0.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -82.01 131.76 7.07 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 124.148 3.232 . . . . 0.0 109.942 173.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -113.4 152.01 30.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.611 1.565 . . . . 0.0 108.063 174.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 92.1 m -113.53 154.4 27.17 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.606 0.762 . . . . 0.0 110.931 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.535 ' HG2' HG13 ' A' ' 27' ' ' VAL . 14.4 mtm105 -147.79 147.26 29.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.305 1.042 . . . . 0.0 109.448 -155.323 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 43.2 t -84.67 136.72 33.62 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 172.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -106.62 -23.59 12.4 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.109 1.364 . . . . 0.0 110.585 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -47.66 143.69 3.69 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 126.045 1.738 . . . . 0.0 113.26 -172.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.0 mm -106.37 127.92 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 C-N-CA 125.122 1.369 . . . . 0.0 107.327 -176.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.1 p -126.99 173.1 9.91 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.538 0.735 . . . . 0.0 109.476 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -88.99 -9.6 50.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.633 0.773 . . . . 0.0 111.328 174.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -133.75 173.28 11.7 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 125.43 1.492 . . . . 0.0 110.95 -174.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.1 t -110.12 137.06 48.38 Favored 'General case' 0 N--CA 1.458 -0.07 0 C-N-CA 125.853 1.661 . . . . 0.0 108.86 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -75.29 157.97 84.31 Favored Pre-proline 0 N--CA 1.449 -0.49 0 C-N-CA 126.635 1.974 . . . . 0.0 109.881 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -67.59 158.11 58.67 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 122.071 1.847 . . . . 0.0 109.817 170.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.0 p -67.41 149.27 50.49 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 120.937 0.399 . . . . 0.0 111.21 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.33 -170.12 2.03 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.548 1.139 . . . . 0.0 110.6 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.9 m . . . . . 0 C--O 1.25 1.111 0 CA-C-O 116.72 -1.61 . . . . 0.0 109.833 165.725 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.0 t . . . . . 0 N--CA 1.474 0.755 0 CA-C-O 121.196 0.522 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -162.13 160.74 27.64 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.457 1.103 . . . . 0.0 109.148 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 80.6 p -122.31 172.01 8.62 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.002 1.321 . . . . 0.0 109.81 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.3 t -150.2 137.91 19.96 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.665 0.786 . . . . 0.0 109.342 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.3 t -163.74 46.89 0.12 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.607 1.563 . . . . 0.0 107.929 177.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 82.8 p -82.34 174.21 11.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.106 0.962 . . . . 0.0 111.591 -168.227 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.95 119.48 5.09 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.898 0.879 . . . . 0.0 109.323 168.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.7 p -143.63 164.86 29.21 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.439 0.638 . . . . 0.0 112.001 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 53.3 t -174.32 143.53 0.87 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.869 -166.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -104.8 -65.99 1.0 Allowed 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.743 0.817 . . . . 0.0 108.915 -174.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -85.81 107.79 17.81 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 26.5 p -124.26 61.11 25.83 Favored Pre-proline 0 CA--C 1.535 0.396 0 C-N-CA 124.914 1.286 . . . . 0.0 111.292 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -71.56 159.73 50.39 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.561 2.174 . . . . 0.0 111.042 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 24.9 m -129.19 157.4 41.92 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.035 0.934 . . . . 0.0 110.263 178.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.6 p -73.82 173.03 10.46 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.488 0.715 . . . . 0.0 110.289 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -106.05 10.67 32.09 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.663 1.185 . . . . 0.0 111.61 176.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 p -73.58 172.72 10.84 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 124.264 1.026 . . . . 0.0 111.681 179.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.8 tp -128.79 100.09 21.87 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 126.012 1.725 . . . . 0.0 108.727 -177.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.92 158.48 96.35 Favored 'Cis proline' 0 CA--C 1.534 0.51 0 CA-C-N 119.68 0.921 . . . . 0.0 111.616 0.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.79 145.99 14.6 Favored 'Trans proline' 0 N--CA 1.451 -0.978 0 C-N-CA 123.305 2.67 . . . . 0.0 110.236 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -113.71 131.54 56.14 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.029 1.731 . . . . 0.0 106.739 175.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 88.7 m -105.5 144.2 32.6 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 123.724 0.81 . . . . 0.0 108.866 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -143.58 159.71 41.95 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.137 0.975 . . . . 0.0 108.763 -171.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 18.2 m -107.35 121.24 44.17 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.671 0.788 . . . . 0.0 109.317 178.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 70.8 p -107.9 22.85 15.36 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.419 1.087 . . . . 0.0 109.948 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -76.13 148.61 37.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 170.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.2 t -143.1 127.4 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 125.102 1.361 . . . . 0.0 107.787 -173.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -165.25 -156.06 0.27 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.227 0.611 . . . . 0.0 109.48 -173.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -57.69 -81.01 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.109 0.964 . . . . 0.0 110.664 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -116.12 169.86 8.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.297 1.439 . . . . 0.0 111.712 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 p -96.54 159.31 15.0 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.838 2.055 . . . . 0.0 111.424 177.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -88.47 172.29 9.46 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.021 0.928 . . . . 0.0 113.47 -170.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.4 t -51.93 -39.51 59.29 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.975 1.71 . . . . 0.0 112.797 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.81 42.79 1.34 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.176 0.991 . . . . 0.0 110.871 -174.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 51.1 t -123.26 119.8 31.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 173.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -102.51 -40.76 6.53 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.837 1.255 . . . . 0.0 110.188 -165.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.9 t -104.11 118.72 37.33 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 170.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.3 t -144.98 133.06 21.42 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.903 1.681 . . . . 0.0 107.322 -175.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.2 tt -153.68 140.44 19.05 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -172.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.4 m -118.87 159.67 23.33 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.437 1.095 . . . . 0.0 111.311 -169.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.6 t -78.83 148.15 32.97 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 29.6 ptt-85 -93.81 41.06 1.08 Allowed 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.881 1.272 . . . . 0.0 110.447 -175.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 t -163.23 -160.8 0.63 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.334 0.654 . . . . 0.0 110.056 -174.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -107.79 131.62 21.6 Favored Pre-proline 0 N--CA 1.442 -0.867 0 C-N-CA 127.124 2.169 . . . . 0.0 108.648 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -73.53 145.96 85.55 Favored 'Cis proline' 0 N--CA 1.456 -0.71 0 N-CA-C 109.283 -1.084 . . . . 0.0 109.283 -4.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -77.71 84.36 1.99 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.115 2.543 . . . . 0.0 108.953 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -107.2 145.99 31.94 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.485 1.514 . . . . 0.0 108.547 -177.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -116.13 148.19 40.57 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.422 0.629 . . . . 0.0 112.486 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 27.8 mtm-85 -119.67 156.64 30.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.956 1.702 . . . . 0.0 109.16 -175.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 1.7 m -100.11 160.23 14.48 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.989 0.916 . . . . 0.0 109.328 165.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -154.04 27.53 0.47 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.292 1.037 . . . . 0.0 109.688 175.429 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -73.26 153.07 40.76 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 123.813 0.845 . . . . 0.0 110.544 -176.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.0 mm -106.47 132.48 53.57 Favored 'Isoleucine or valine' 0 C--N 1.34 0.18 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -176.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 56.4 p -144.1 -165.19 2.06 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.443 1.497 . . . . 0.0 108.238 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -134.87 18.58 3.5 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.245 1.018 . . . . 0.0 110.609 172.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -156.5 178.61 10.12 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.365 1.466 . . . . 0.0 110.215 -173.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.0 t -111.21 148.2 33.33 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.843 1.257 . . . . 0.0 109.97 178.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -97.75 151.99 37.88 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.394 1.478 . . . . 0.0 108.79 172.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -64.59 163.67 26.47 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.222 2.615 . . . . 0.0 111.714 -176.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.2 p -57.33 139.14 53.77 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.038 0.935 . . . . 0.0 112.555 -175.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.96 -177.63 3.69 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 124.453 1.101 . . . . 0.0 112.085 -173.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 71.1 p . . . . . 0 C--O 1.25 1.086 0 CA-C-O 116.962 -1.494 . . . . 0.0 110.91 176.204 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 39.3 p . . . . . 0 N--CA 1.473 0.719 0 CA-C-O 120.247 0.07 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.6 tpmt? -80.51 63.67 5.04 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.443 1.097 . . . . 0.0 108.162 174.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.9 m -133.35 61.96 1.67 Allowed 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.457 1.103 . . . . 0.0 109.219 -174.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.9 t -156.18 159.2 38.76 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.305 1.042 . . . . 0.0 108.987 177.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.0 t 1.41 77.46 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 129.149 2.979 . . . . 0.0 114.39 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 48.0 p -70.66 156.77 39.04 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.965 0.906 . . . . 0.0 110.205 -178.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.52 121.84 13.73 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.922 0.489 . . . . 0.0 110.721 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.3 p -149.21 173.15 13.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.679 0.752 . . . . 0.0 111.768 -175.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 t -170.23 152.41 4.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 126.323 1.849 . . . . 0.0 108.219 -174.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -105.14 -66.86 0.95 Allowed 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 -177.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -93.19 104.24 16.44 Favored 'General case' 0 C--N 1.344 0.337 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 21.4 p -119.93 64.32 9.26 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 126.916 2.086 . . . . 0.0 110.764 -174.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -67.3 156.65 65.32 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.517 2.144 . . . . 0.0 111.817 -177.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 63.4 m -130.33 159.32 37.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.471 1.108 . . . . 0.0 109.99 178.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 81.9 p -89.27 172.17 9.24 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.421 1.489 . . . . 0.0 110.245 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 33.0 ptt-85 -107.47 -1.59 21.26 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.132 1.373 . . . . 0.0 112.436 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.7 p -71.36 179.37 2.96 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.516 1.526 . . . . 0.0 111.315 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.0 mm -128.46 117.57 20.01 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 124.973 1.309 . . . . 0.0 108.548 -177.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -69.91 146.57 82.88 Favored 'Cis proline' 0 N--CA 1.456 -0.689 0 N-CA-C 109.525 -0.991 . . . . 0.0 109.525 -5.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -72.16 125.97 11.33 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.703 2.269 . . . . 0.0 109.024 178.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.7 pm0 -105.33 151.36 24.26 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.233 1.013 . . . . 0.0 109.224 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.7 m -127.66 145.84 50.75 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.466 1.507 . . . . 0.0 109.809 -177.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -150.52 163.96 37.16 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.545 1.538 . . . . 0.0 108.287 -171.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 68.7 m -107.68 141.68 38.82 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.548 0.739 . . . . 0.0 110.097 171.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.0 t -107.53 -12.03 15.36 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.462 -172.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.67 146.91 51.03 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.812 0.845 . . . . 0.0 110.452 -176.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 85.0 t -110.35 126.04 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 174.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.75 -166.25 2.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.922 0.889 . . . . 0.0 111.515 -171.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -71.69 -136.94 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 165.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -63.03 157.17 22.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 120.633 -1.292 . . . . 0.0 112.347 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.1 m -75.45 166.55 23.42 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.147 175.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -88.3 171.18 10.36 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.704 0.802 . . . . 0.0 112.916 -173.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.6 t -63.52 -24.39 67.8 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.073 1.349 . . . . 0.0 113.102 -175.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -103.7 34.59 2.93 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.225 1.01 . . . . 0.0 110.781 178.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.8 t -119.59 126.59 51.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.563 1.145 . . . . 0.0 108.309 175.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -105.84 -38.93 6.2 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.753 1.221 . . . . 0.0 109.923 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.1 t -106.38 113.82 27.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 174.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.8 t -128.9 137.96 51.73 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 126.293 1.837 . . . . 0.0 107.249 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.403 HD23 ' H ' ' A' ' 40' ' ' CYS . 0.5 OUTLIER -143.02 152.16 41.61 Favored 'General case' 0 N--CA 1.46 0.069 0 C-N-CA 124.328 1.051 . . . . 0.0 108.634 -174.624 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.403 ' H ' HD23 ' A' ' 39' ' ' LEU . 6.8 m -137.75 157.08 47.2 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.802 0.841 . . . . 0.0 110.459 -173.595 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.8 t -91.87 151.87 20.35 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 123.406 0.441 . . . . 0.0 109.886 178.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.4 ptt-85 -97.32 19.04 13.81 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.709 1.204 . . . . 0.0 111.557 177.111 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -69.05 178.33 2.3 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 124.275 1.03 . . . . 0.0 110.563 170.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -123.56 117.09 27.82 Favored Pre-proline 0 CA--C 1.533 0.313 0 C-N-CA 124.071 0.948 . . . . 0.0 109.222 175.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -71.78 151.12 95.28 Favored 'Cis proline' 0 CA--C 1.54 0.804 0 CA-C-N 119.587 0.888 . . . . 0.0 110.287 -5.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -83.29 127.11 4.43 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.95 3.1 . . . . 0.0 110.244 175.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -115.95 161.48 18.77 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.761 1.224 . . . . 0.0 108.93 174.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 99.5 m -112.56 169.52 8.83 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.46 1.104 . . . . 0.0 110.618 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.1 ttp85 -159.53 146.83 16.91 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.192 1.397 . . . . 0.0 108.54 -174.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 49.9 t -89.97 124.0 34.36 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.742 0.817 . . . . 0.0 109.25 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.67 10.37 29.0 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.903 1.681 . . . . 0.0 110.571 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -67.72 145.63 54.57 Favored 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.707 -0.62 . . . . 0.0 110.635 -175.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 49.0 mm -107.45 133.85 50.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 124.497 1.119 . . . . 0.0 108.97 -169.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.2 p -141.99 -178.14 5.55 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.722 1.209 . . . . 0.0 109.551 -177.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -107.86 -5.33 17.29 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.95 1.3 . . . . 0.0 110.985 169.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -133.42 -173.19 3.15 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.982 1.713 . . . . 0.0 110.364 -168.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.7 t -121.33 146.3 47.0 Favored 'General case' 0 CA--C 1.527 0.061 0 C-N-CA 125.628 1.571 . . . . 0.0 109.207 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -78.57 160.58 72.08 Favored Pre-proline 0 N--CA 1.452 -0.349 0 C-N-CA 124.476 1.11 . . . . 0.0 108.953 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -60.0 159.7 24.76 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.392 2.061 . . . . 0.0 110.651 174.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.3 p -62.44 138.18 58.41 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 122.796 0.438 . . . . 0.0 111.017 -177.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.11 -172.82 2.35 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 124.529 1.131 . . . . 0.0 109.592 177.709 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.449 -1.262 . . . . 0.0 110.093 177.004 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 72.7 p . . . . . 0 N--CA 1.474 0.772 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -61.04 107.06 0.67 Allowed 'General case' 0 C--N 1.343 0.294 0 C-N-CA 123.483 0.713 . . . . 0.0 109.858 -178.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 80.9 p -86.57 -175.87 5.61 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.825 1.25 . . . . 0.0 110.832 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.1 t -66.31 171.06 5.15 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.627 161.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.3 t 3.49 83.51 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 128.662 2.785 . . . . 0.0 114.189 -170.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 76.7 p -69.43 178.06 2.61 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.959 1.304 . . . . 0.0 110.961 -177.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.27 114.39 2.88 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.827 178.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.7 p -140.26 -170.39 2.97 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.459 1.104 . . . . 0.0 109.219 -170.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.1 t -173.58 170.99 3.97 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.387 1.875 . . . . 0.0 106.434 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -108.22 -60.74 1.68 Allowed 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 166.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -119.2 109.74 16.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.265 1.026 . . . . 0.0 109.046 -177.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.86 89.21 47.96 Favored Pre-proline 0 N--CA 1.452 -0.366 0 C-N-CA 124.596 1.158 . . . . 0.0 111.979 176.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.31 171.57 14.81 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.122 1.881 . . . . 0.0 110.859 169.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.8 m -133.17 156.54 47.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.379 1.072 . . . . 0.0 109.692 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 36.8 p -88.08 162.94 16.5 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.742 1.217 . . . . 0.0 109.611 178.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -106.47 35.24 3.03 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.31 1.044 . . . . 0.0 110.045 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 p -90.21 179.27 5.95 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.592 1.557 . . . . 0.0 110.327 175.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.37 106.21 17.55 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.954 1.302 . . . . 0.0 108.33 -178.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.37 156.78 96.62 Favored 'Cis proline' 0 CA--C 1.535 0.531 0 CA-C-N 119.618 0.899 . . . . 0.0 109.835 -4.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.05 139.95 19.64 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.657 2.238 . . . . 0.0 110.072 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -107.78 132.9 52.9 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.817 1.247 . . . . 0.0 108.107 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 79.2 m -108.07 143.97 36.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.452 1.101 . . . . 0.0 109.423 172.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -157.01 170.22 23.04 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.006 0.922 . . . . 0.0 109.365 -173.515 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 89.3 m -104.27 143.96 32.26 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.694 0.798 . . . . 0.0 109.877 -177.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 11.3 t -115.32 -16.69 11.44 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.682 1.193 . . . . 0.0 111.212 177.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.08 155.45 31.33 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 121.289 0.566 . . . . 0.0 111.158 -178.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.7 t -122.64 143.03 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 125.994 1.717 . . . . 0.0 107.92 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.6 tpp180 -161.67 -145.2 0.11 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.958 1.303 . . . . 0.0 107.902 -174.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -91.79 -130.84 0.11 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 125.021 1.329 . . . . 0.0 108.301 167.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -65.63 171.85 3.85 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.594 1.158 . . . . 0.0 114.086 -165.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -71.18 151.1 44.7 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.01 1.324 . . . . 0.0 109.69 179.38 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.3 p80 -81.9 -178.84 7.16 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 121.495 0.664 . . . . 0.0 112.073 173.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 t -78.44 23.95 0.29 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.311 1.045 . . . . 0.0 113.167 -172.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -160.38 69.35 0.38 Allowed 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.599 0.636 . . . . 0.0 109.866 172.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 94.1 m -124.89 124.77 42.78 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.852 0.861 . . . . 0.0 110.044 -176.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 tmtp? -105.7 -30.68 9.3 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.882 1.673 . . . . 0.0 108.75 176.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.4 t -118.86 131.46 56.07 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.438 1.495 . . . . 0.0 108.279 169.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.3 t -154.99 143.52 20.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.078 1.351 . . . . 0.0 108.376 177.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.1 tp -152.47 170.21 20.69 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 122.986 0.515 . . . . 0.0 110.069 -172.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 65.4 m -134.37 163.76 28.95 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.128 0.971 . . . . 0.0 110.598 172.112 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.8 p -79.68 148.94 31.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.12 0.968 . . . . 0.0 110.186 178.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.3 ptt85 -98.32 52.44 1.03 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.234 1.414 . . . . 0.0 109.122 176.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.3 t -153.39 -163.93 1.79 Allowed 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.448 1.099 . . . . 0.0 109.476 177.016 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -129.63 129.49 23.15 Favored Pre-proline 0 CA--C 1.533 0.312 0 C-N-CA 125.416 1.486 . . . . 0.0 108.73 -178.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -70.87 147.8 87.82 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 CA-C-N 119.682 0.922 . . . . 0.0 110.592 -0.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -74.45 98.91 1.16 Allowed 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 123.502 2.801 . . . . 0.0 108.721 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -106.55 140.73 38.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.184 1.394 . . . . 0.0 108.49 -173.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 79.1 m -126.11 153.79 44.03 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.472 0.709 . . . . 0.0 111.024 -168.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.73 162.14 36.24 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.419 1.088 . . . . 0.0 110.544 -176.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.9 t -118.68 126.4 51.84 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 125.389 1.475 . . . . 0.0 107.491 172.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -119.78 37.92 4.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.41 1.084 . . . . 0.0 110.194 -168.282 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -62.59 152.12 35.94 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.735 1.214 . . . . 0.0 112.07 -174.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 46.4 mm -108.05 101.96 13.29 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 C-N-CA 124.414 1.086 . . . . 0.0 108.233 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.3 p -113.45 -175.93 2.78 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.893 1.277 . . . . 0.0 108.63 171.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -110.49 11.3 23.11 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.937 0.895 . . . . 0.0 110.631 173.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -148.56 170.1 18.82 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.882 1.673 . . . . 0.0 110.244 -174.078 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 19.8 t -118.75 138.72 52.47 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 126.003 1.721 . . . . 0.0 108.556 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -82.73 154.94 68.39 Favored Pre-proline 0 N--CA 1.45 -0.466 0 C-N-CA 125.576 1.55 . . . . 0.0 109.79 -177.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -67.13 163.91 32.28 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.622 2.214 . . . . 0.0 110.473 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.3 133.25 53.86 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.413 0.685 . . . . 0.0 112.129 -172.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -79.05 -174.89 4.29 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.714 1.206 . . . . 0.0 110.425 176.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.4 t . . . . . 0 C--O 1.251 1.171 0 CA-C-O 117.105 -1.426 . . . . 0.0 108.598 168.01 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.8 p -122.49 -168.75 1.78 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.425 1.49 . . . . 0.0 109.832 -172.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.1 t -165.99 179.22 5.95 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 170.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -132.71 -74.94 0.5 Allowed 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 170.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -90.33 115.75 27.76 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 171.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 30.0 p -119.96 72.52 17.39 Favored Pre-proline 0 CA--C 1.532 0.285 0 C-N-CA 123.571 0.748 . . . . 0.0 112.277 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -75.55 161.3 37.35 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.638 2.225 . . . . 0.0 110.758 176.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.0 m -139.27 158.48 44.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.206 1.002 . . . . 0.0 110.694 -179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.7 p -77.88 157.06 29.99 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 169.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -106.89 36.47 2.65 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.76 0.824 . . . . 0.0 109.604 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.2 p -86.52 179.46 6.83 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.924 1.69 . . . . 0.0 110.328 175.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -126.16 104.74 25.58 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 125.28 1.432 . . . . 0.0 107.888 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.34 159.06 97.95 Favored 'Cis proline' 0 CA--C 1.536 0.593 0 CA-C-N 119.619 0.9 . . . . 0.0 110.297 -3.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -75.73 142.12 25.36 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.272 2.648 . . . . 0.0 109.885 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.87 126.98 55.69 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.57 1.148 . . . . 0.0 107.976 171.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.3 m -104.82 151.3 23.96 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.668 1.187 . . . . 0.0 109.339 175.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -141.86 -179.58 6.29 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 123.997 0.919 . . . . 0.0 109.866 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 93.3 m -110.83 141.61 43.96 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 167.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.7 p -117.64 34.28 5.22 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 166.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -81.66 149.77 28.38 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.526 0.679 . . . . 0.0 110.259 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.442 HG13 ' HG2' ' A' ' 49' ' ' ARG . 62.6 t -142.7 122.13 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 C-N-CA 126.004 1.722 . . . . 0.0 106.415 -177.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -162.91 -150.25 0.16 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -166.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -68.72 -142.96 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 162.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -67.48 158.37 32.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 120.876 -1.14 . . . . 0.0 111.827 -174.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.6 p -74.12 159.2 32.93 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.569 1.548 . . . . 0.0 111.643 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -80.62 177.37 9.06 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -169.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.5 t -78.48 21.59 0.37 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.5 -1.227 . . . . 0.0 113.054 -172.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -155.3 64.34 0.62 Allowed 'General case' 0 C--N 1.341 0.236 0 CA-C-N 118.741 0.7 . . . . 0.0 109.797 173.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 76.5 m -123.79 127.93 48.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.868 0.867 . . . . 0.0 109.327 179.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -102.86 -36.52 8.21 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.769 1.628 . . . . 0.0 107.806 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -106.03 114.87 29.28 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 162.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 24.9 t -134.17 132.64 40.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.622 1.569 . . . . 0.0 107.445 169.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.2 tp -157.34 157.3 33.87 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.6 m -122.22 166.17 15.03 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.827 0.851 . . . . 0.0 110.352 -174.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.7 t -89.73 150.25 22.38 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 168.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -82.88 0.93 41.91 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.149 1.38 . . . . 0.0 112.403 177.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 m -69.33 -178.09 1.28 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.036 1.334 . . . . 0.0 111.512 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -120.3 111.05 35.41 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.727 1.211 . . . . 0.0 108.163 175.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -74.36 149.86 94.62 Favored 'Cis proline' 0 N--CA 1.458 -0.611 0 CA-C-N 119.972 1.026 . . . . 0.0 110.611 0.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -75.94 108.58 2.71 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.754 2.303 . . . . 0.0 108.338 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -104.4 140.17 38.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -177.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 65.8 m -107.07 151.04 25.89 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 123.843 0.857 . . . . 0.0 109.701 -172.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.442 ' HG2' HG13 ' A' ' 27' ' ' VAL . 10.0 mtm105 -144.86 143.27 30.52 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.528 -1.215 . . . . 0.0 108.668 -156.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 46.5 t -112.05 131.92 55.13 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 124.072 0.949 . . . . 0.0 109.014 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -127.43 37.35 4.25 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.286 1.434 . . . . 0.0 109.942 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -56.33 154.99 7.41 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.242 1.017 . . . . 0.0 111.628 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.7 mm -115.25 111.72 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 171.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.3 p -130.5 163.53 26.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.933 1.293 . . . . 0.0 108.135 173.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -70.02 -21.27 63.22 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.895 -0.503 . . . . 0.0 111.54 174.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -130.55 -179.29 5.19 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.898 1.279 . . . . 0.0 111.911 -165.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.8 t -112.78 147.88 35.97 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.642 1.977 . . . . 0.0 109.992 177.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -97.58 159.37 31.23 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 125.914 1.686 . . . . 0.0 109.566 176.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.2 164.5 22.47 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.284 2.656 . . . . 0.0 112.266 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.22 141.61 58.7 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.469 1.107 . . . . 0.0 112.178 -174.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.135 0 C-N-CA 124.55 1.14 . . . . 0.0 111.81 -178.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.986 0.422 . . . . 0.0 111.371 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.4 p -127.46 -175.77 3.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.436 1.494 . . . . 0.0 109.785 -176.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 46.4 t -172.0 160.55 5.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.642 1.977 . . . . 0.0 107.329 171.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -108.44 -77.01 0.6 Allowed 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 171.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -88.52 111.49 21.9 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.8 p -118.14 67.08 6.34 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 124.749 1.22 . . . . 0.0 111.377 -177.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.93 145.67 56.85 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.624 2.216 . . . . 0.0 110.453 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.1 m -132.46 159.06 40.43 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.049 0.94 . . . . 0.0 110.933 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.0 p -90.04 157.85 17.61 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.648 1.179 . . . . 0.0 108.932 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.5 mtm105 -108.47 35.92 3.01 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.914 0.886 . . . . 0.0 109.515 176.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 76.1 p -89.15 -176.67 5.2 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.902 1.281 . . . . 0.0 110.264 175.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.5 mm -129.71 113.08 17.72 Favored Pre-proline 0 CA--C 1.536 0.41 0 C-N-CA 124.75 1.22 . . . . 0.0 108.842 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.44 151.63 90.79 Favored 'Cis proline' 0 CA--C 1.538 0.679 0 N-CA-C 109.131 -1.142 . . . . 0.0 109.131 -9.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -75.25 132.54 15.21 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.209 2.606 . . . . 0.0 109.417 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.9 137.17 43.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 173.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 54.0 m -107.74 149.85 27.67 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.227 1.411 . . . . 0.0 108.744 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -135.71 172.19 13.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.134 1.374 . . . . 0.0 108.432 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 18.5 m -127.47 134.42 49.83 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 172.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 67.5 p -115.68 24.97 11.12 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.439 1.096 . . . . 0.0 109.953 174.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -70.82 150.38 45.89 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 123.514 0.726 . . . . 0.0 109.696 172.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 69.2 t -136.51 126.04 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 126.231 1.812 . . . . 0.0 106.244 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.06 -156.37 0.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 -165.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -78.67 -137.89 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.934 1.294 . . . . 0.0 108.438 175.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -63.38 161.82 13.47 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.12 0.873 . . . . 0.0 111.758 -176.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 m -76.11 152.26 36.81 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.368 1.467 . . . . 0.0 108.893 -175.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -76.83 165.82 24.18 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.6 t -49.41 -40.17 35.35 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 126.083 1.753 . . . . 0.0 111.851 -179.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.29 32.21 4.82 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 124.267 1.027 . . . . 0.0 111.742 -177.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 20.4 t -99.69 126.46 45.73 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.637 0.775 . . . . 0.0 109.196 176.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.9 tttm -106.55 -45.36 4.26 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.017 0.927 . . . . 0.0 110.75 -174.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 t -105.28 126.06 51.67 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 172.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.2 t -147.78 142.1 26.27 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.531 1.133 . . . . 0.0 108.172 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.3 tp -148.2 151.77 36.08 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.0 m -126.27 166.18 17.59 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.917 0.887 . . . . 0.0 110.837 -172.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.7 p -83.47 153.52 24.41 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.287 0.635 . . . . 0.0 109.59 171.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -87.55 15.14 7.05 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.675 0.79 . . . . 0.0 111.859 172.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 80.0 p -76.97 -176.45 3.96 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.337 1.055 . . . . 0.0 111.6 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -134.93 114.67 11.92 Favored Pre-proline 0 N--CA 1.451 -0.411 0 C-N-CA 125.007 1.323 . . . . 0.0 108.86 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.06 142.46 72.94 Favored 'Cis proline' 0 N--CA 1.457 -0.659 0 CA-C-N 119.655 0.912 . . . . 0.0 110.033 -1.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.26 125.56 11.48 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.925 2.417 . . . . 0.0 109.097 177.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 30.8 mm100 -106.28 129.85 54.23 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 62.4 m -106.21 149.38 26.9 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.827 0.851 . . . . 0.0 109.325 -175.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.2 mtm105 -142.56 120.79 12.25 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 -160.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 48.4 t -83.8 124.96 31.47 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -178.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -117.97 26.57 9.57 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.266 1.426 . . . . 0.0 111.386 -179.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -57.71 147.2 28.51 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.572 0.749 . . . . 0.0 110.164 -178.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.3 mm -102.32 130.91 51.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 106.198 -1.779 . . . . 0.0 106.198 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 35.5 p -139.81 -171.56 3.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.99 1.316 . . . . 0.0 108.15 -170.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -128.66 15.53 6.47 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.493 1.117 . . . . 0.0 109.922 172.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -159.02 176.91 11.71 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.031 1.333 . . . . 0.0 110.394 -165.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.0 t -123.42 144.81 49.25 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 125.269 1.427 . . . . 0.0 109.63 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -92.51 157.41 40.21 Favored Pre-proline 0 N--CA 1.451 -0.389 0 C-N-CA 125.444 1.498 . . . . 0.0 109.367 175.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.37 162.73 29.3 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.967 2.445 . . . . 0.0 110.789 174.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.08 138.64 58.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 123.825 0.85 . . . . 0.0 112.128 -172.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.529 0.146 0 C-N-CA 123.624 0.77 . . . . 0.0 111.359 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.147 0 N-CA-C 110.724 -0.102 . . . . 0.0 110.724 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.1 p -119.89 -179.2 3.84 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 122.099 0.952 . . . . 0.0 111.023 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.5 t -176.4 175.29 1.81 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 128.17 2.588 . . . . 0.0 105.516 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -142.84 -62.99 0.42 Allowed 'General case' 0 CA--C 1.527 0.083 0 CA-C-N 119.446 1.021 . . . . 0.0 108.833 164.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -90.86 104.78 17.33 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.3 p -118.04 75.01 10.61 Favored Pre-proline 0 CA--C 1.532 0.271 0 C-N-CA 124.852 1.261 . . . . 0.0 111.694 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.42 156.58 65.56 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.707 2.272 . . . . 0.0 110.662 170.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.5 m -142.67 166.2 25.3 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.059 0.944 . . . . 0.0 111.164 -172.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.9 p -82.74 162.0 21.89 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.163 0.985 . . . . 0.0 109.243 166.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -108.24 36.86 2.65 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.884 0.874 . . . . 0.0 109.59 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.7 p -85.15 -177.15 6.45 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.416 1.086 . . . . 0.0 111.018 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.3 tp -123.57 96.65 43.21 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 125.828 1.651 . . . . 0.0 109.474 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.02 163.47 89.38 Favored 'Cis proline' 0 CA--C 1.535 0.558 0 CA-C-N 119.747 0.945 . . . . 0.0 110.549 -3.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -76.89 149.17 28.96 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 123.371 2.714 . . . . 0.0 110.165 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -125.14 133.77 52.69 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.283 1.433 . . . . 0.0 108.413 175.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 77.7 m -109.89 152.73 25.43 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.308 1.443 . . . . 0.0 110.278 176.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -139.42 152.61 47.21 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.136 0.975 . . . . 0.0 108.894 172.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 23.4 m -103.45 118.0 35.74 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 125.03 1.332 . . . . 0.0 107.664 -176.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 50.5 p -107.89 15.95 23.97 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.46 1.104 . . . . 0.0 111.829 -164.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -65.31 152.59 43.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.022 0.439 . . . . 0.0 109.919 167.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.5 t -132.73 119.09 36.63 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.114 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 -176.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.1 mmm-85 -158.79 -162.93 1.16 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.597 1.159 . . . . 0.0 108.857 -162.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.99 -144.92 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.041 0.936 . . . . 0.0 109.082 170.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -61.85 154.62 25.49 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 121.299 -0.876 . . . . 0.0 110.755 -174.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 96.4 m -78.22 168.8 19.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.982 0.913 . . . . 0.0 110.621 -174.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.0 p80 -86.27 171.75 11.0 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.679 0.752 . . . . 0.0 112.818 -175.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.6 t -57.55 -34.42 69.15 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.52 1.528 . . . . 0.0 112.697 -176.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -105.96 44.59 1.03 Allowed 'General case' 0 C--N 1.338 0.096 0 C-N-CA 124.068 0.947 . . . . 0.0 109.723 -175.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 15.9 t -147.57 114.89 6.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -104.6 -36.63 7.42 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.756 1.223 . . . . 0.0 110.549 -162.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.9 t -102.66 108.89 20.31 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 171.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 44.3 t -118.27 129.19 55.32 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.647 1.979 . . . . 0.0 106.833 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -135.02 147.97 49.81 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 125.074 1.349 . . . . 0.0 108.056 -171.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 m -135.44 157.53 46.66 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.371 0.668 . . . . 0.0 110.832 -173.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -84.74 154.37 22.46 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.173 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -90.31 10.74 23.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.693 1.197 . . . . 0.0 111.971 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -70.78 -179.35 2.17 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.681 1.192 . . . . 0.0 111.058 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -120.55 115.17 32.57 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.463 1.105 . . . . 0.0 108.22 171.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -71.97 151.64 96.02 Favored 'Cis proline' 0 N--CA 1.456 -0.681 0 CA-C-N 119.627 0.902 . . . . 0.0 110.04 -2.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -72.25 137.29 28.3 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.458 2.105 . . . . 0.0 107.923 167.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -149.83 145.43 26.57 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -171.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 72.5 m -111.46 162.76 14.75 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.627 0.771 . . . . 0.0 112.658 -161.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 ttp85 -152.44 154.7 36.06 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 127.199 2.2 . . . . 0.0 108.292 -167.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 8.8 m -89.05 125.73 35.13 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.026 0.93 . . . . 0.0 110.23 173.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -105.91 20.33 19.11 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.885 1.274 . . . . 0.0 109.439 169.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -84.25 149.81 25.86 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.702 1.201 . . . . 0.0 109.755 -177.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.9 mm -108.74 135.51 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 124.86 1.264 . . . . 0.0 108.488 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.9 p -139.37 151.21 46.15 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 165.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -64.37 -37.25 86.86 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.635 0.374 . . . . 0.0 110.737 170.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.0 p90 -102.43 -172.94 2.22 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.179 1.792 . . . . 0.0 111.142 -172.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 35.2 t -142.35 149.92 40.05 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.451 1.9 . . . . 0.0 108.763 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -91.65 155.9 43.4 Favored Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 124.914 1.285 . . . . 0.0 109.582 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -63.33 159.69 38.57 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.629 2.219 . . . . 0.0 110.578 175.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.1 m -62.31 143.77 56.52 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 121.252 0.549 . . . . 0.0 111.995 -171.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.454 -0.241 0 C-N-CA 124.956 1.303 . . . . 0.0 110.673 -179.17 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.205 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.0 p -135.49 162.99 31.1 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.264 1.026 . . . . 0.0 111.255 178.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.4 t -171.35 142.02 1.64 Allowed 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 125.939 1.696 . . . . 0.0 108.544 -174.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -103.61 -73.02 0.68 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.195 0.998 . . . . 0.0 108.567 -174.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -77.05 108.05 9.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.0 p -132.94 62.65 63.34 Favored Pre-proline 0 N--CA 1.452 -0.339 0 C-N-CA 124.488 1.115 . . . . 0.0 111.497 -173.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.72 159.38 52.98 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.708 2.272 . . . . 0.0 111.031 178.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 24.1 m -131.3 153.98 49.01 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.839 0.856 . . . . 0.0 110.004 177.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.1 p -82.15 164.12 21.49 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.139 1.375 . . . . 0.0 109.691 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -106.81 25.54 11.15 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.188 0.995 . . . . 0.0 110.744 -177.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.5 p -81.97 -179.68 7.49 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.715 1.206 . . . . 0.0 110.432 176.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -126.84 106.38 22.71 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 124.797 1.239 . . . . 0.0 108.188 179.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.26 159.31 96.06 Favored 'Cis proline' 0 N--CA 1.458 -0.602 0 CA-C-N 119.373 0.812 . . . . 0.0 110.094 -4.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.0 138.23 22.75 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.869 2.38 . . . . 0.0 109.368 173.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -106.52 135.19 48.47 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 173.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.8 m -107.1 143.54 35.09 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.283 1.033 . . . . 0.0 108.876 175.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -146.15 159.26 43.55 Favored 'General case' 0 N--CA 1.457 -0.095 0 C-N-CA 124.175 0.99 . . . . 0.0 108.964 -173.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.0 m -106.26 137.47 44.16 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.851 0.86 . . . . 0.0 109.614 -178.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.1 p -120.57 -12.91 8.84 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.429 1.092 . . . . 0.0 112.041 -174.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -65.36 150.38 48.39 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.481 0.582 . . . . 0.0 110.804 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.7 t -118.02 118.16 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 125.186 1.394 . . . . 0.0 107.907 -170.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -141.67 -166.76 2.28 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.781 1.633 . . . . 0.0 108.676 -171.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -77.26 -132.86 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 167.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -60.94 150.54 32.96 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.917 1.235 . . . . 0.0 111.31 -173.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.1 p -87.77 151.8 22.61 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 126.357 1.863 . . . . 0.0 109.831 -176.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.3 p80 -72.9 168.24 19.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -159.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.2 t -51.32 -38.09 51.16 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 126.232 1.813 . . . . 0.0 112.188 -178.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.54 31.3 4.77 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.295 1.038 . . . . 0.0 111.513 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 18.2 t -104.48 128.06 52.32 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.153 0.981 . . . . 0.0 108.806 175.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -107.73 -46.68 3.76 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.473 1.109 . . . . 0.0 110.704 -173.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 t -104.97 131.01 53.02 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 172.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 44.8 t -154.75 145.73 22.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.669 1.188 . . . . 0.0 108.434 -174.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 7.4 tt -148.77 150.22 32.71 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.7 m -127.75 159.17 35.61 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.4 1.08 . . . . 0.0 110.211 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 69.0 p -81.56 155.58 25.65 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.569 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.6 ptt85 -93.47 26.01 3.19 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.304 1.441 . . . . 0.0 110.09 170.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.4 m -87.74 178.81 6.63 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.243 1.417 . . . . 0.0 110.66 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -129.19 105.08 17.93 Favored Pre-proline 0 N--CA 1.441 -0.895 0 C-N-CA 126.751 2.021 . . . . 0.0 108.122 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -72.55 155.4 99.01 Favored 'Cis proline' 0 CA--C 1.537 0.653 0 CA-C-N 119.802 0.965 . . . . 0.0 111.054 -1.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -75.84 130.43 12.44 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.604 2.869 . . . . 0.0 109.459 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -121.66 136.64 54.94 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.019 1.328 . . . . 0.0 109.038 -176.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 66.6 m -108.79 156.46 19.6 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.42 1.088 . . . . 0.0 111.556 -172.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -152.85 143.64 22.86 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 124.327 1.051 . . . . 0.0 109.768 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 33.0 t -92.53 121.15 33.69 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 124.928 1.291 . . . . 0.0 109.363 -177.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.07 20.84 18.45 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.874 1.269 . . . . 0.0 111.14 -174.01 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -62.7 150.33 41.39 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.658 0.783 . . . . 0.0 110.964 -175.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.1 mm -105.77 126.41 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 70.4 p -136.34 -169.37 2.43 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.01 1.324 . . . . 0.0 108.714 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -128.83 9.03 5.8 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.392 1.477 . . . . 0.0 110.983 173.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -148.9 -176.11 5.21 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 126.008 1.723 . . . . 0.0 109.811 -169.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.4 t -132.11 144.4 50.69 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.714 1.206 . . . . 0.0 109.207 174.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -88.58 160.27 44.98 Favored Pre-proline 0 CA--C 1.534 0.348 0 C-N-CA 125.14 1.376 . . . . 0.0 109.089 174.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -61.23 162.52 19.74 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.185 1.924 . . . . 0.0 111.198 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.61 138.79 33.7 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.929 1.291 . . . . 0.0 112.076 -177.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.071 0 C-N-CA 124.406 1.082 . . . . 0.0 110.347 178.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.107 0 CA-C-O 120.373 0.13 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.6 p -129.73 -176.17 3.83 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 124.844 1.258 . . . . 0.0 109.329 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 49.6 t -171.98 158.22 4.65 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 126.16 1.784 . . . . 0.0 107.447 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -105.67 -60.91 1.56 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -114.8 115.31 26.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.799 1.239 . . . . 0.0 108.54 -177.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 11.0 p -131.81 78.88 69.29 Favored Pre-proline 0 N--CA 1.453 -0.322 0 C-N-CA 125.037 1.335 . . . . 0.0 112.063 -173.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -71.09 161.89 44.47 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.628 2.219 . . . . 0.0 110.919 173.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.0 m -133.03 156.99 46.34 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.382 1.073 . . . . 0.0 109.462 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.1 p -84.5 164.96 18.48 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.098 1.359 . . . . 0.0 110.31 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.7 ptt-85 -108.52 5.49 25.22 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.881 1.272 . . . . 0.0 112.463 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.3 p -73.19 175.99 6.29 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.047 1.339 . . . . 0.0 110.857 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 tp -124.74 115.38 26.65 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 125.001 1.32 . . . . 0.0 108.943 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -70.48 152.23 93.97 Favored 'Cis proline' 0 N--CA 1.458 -0.589 0 CA-C-N 119.798 0.964 . . . . 0.0 109.869 -6.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -79.48 136.77 12.64 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.018 2.478 . . . . 0.0 109.779 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -108.43 149.93 28.08 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.454 1.501 . . . . 0.0 109.715 170.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 96.6 m -112.47 148.69 33.88 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.515 1.526 . . . . 0.0 109.287 170.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -156.1 169.68 23.94 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.63 1.172 . . . . 0.0 108.981 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 92.3 m -106.87 141.64 37.78 Favored 'General case' 0 CA--C 1.521 -0.173 0 C-N-CA 123.135 0.574 . . . . 0.0 110.916 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.2 t -108.52 -26.17 10.56 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.97 1.308 . . . . 0.0 110.668 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -58.67 142.36 49.88 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-O 121.561 0.696 . . . . 0.0 111.198 -177.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.6 t -113.25 133.96 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 C-N-CA 125.8 1.64 . . . . 0.0 107.471 -172.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.7 tpp180 -160.84 -150.47 0.21 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -174.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -80.05 -150.48 0.06 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.668 0.787 . . . . 0.0 108.93 173.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -60.17 158.12 11.98 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.476 0.655 . . . . 0.0 110.912 -177.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 65.1 m -80.45 163.12 24.04 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.127 -170.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -80.04 172.67 13.47 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.513 0.673 . . . . 0.0 112.242 -174.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.2 t -55.12 -28.93 56.24 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.466 1.507 . . . . 0.0 113.003 -176.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.86 48.59 0.84 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.441 1.096 . . . . 0.0 110.161 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 84.5 m -128.92 133.69 47.97 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 164.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -103.96 -42.19 5.64 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.167 1.387 . . . . 0.0 108.925 -177.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.9 t -105.95 130.04 53.97 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 171.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.8 t -138.91 132.92 31.17 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 125.707 1.603 . . . . 0.0 107.023 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -138.23 148.36 44.69 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 124.205 1.002 . . . . 0.0 109.06 -170.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.0 m -136.41 158.86 43.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.716 0.806 . . . . 0.0 110.318 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.2 t -87.36 155.38 20.06 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 123.516 0.51 . . . . 0.0 110.118 175.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -90.15 8.89 30.61 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.879 1.271 . . . . 0.0 111.578 174.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.6 m -65.55 177.19 1.24 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.244 1.018 . . . . 0.0 110.934 174.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -122.93 113.4 30.02 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 174.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.55 147.37 89.01 Favored 'Cis proline' 0 CA--C 1.538 0.698 0 CA-C-N 119.788 0.96 . . . . 0.0 111.13 0.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.03 106.02 2.19 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.493 2.795 . . . . 0.0 108.772 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -107.9 147.98 30.24 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.051 0.94 . . . . 0.0 109.516 -173.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 91.8 m -116.62 159.68 21.81 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.322 1.049 . . . . 0.0 112.043 -166.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.7 ttp-105 -155.56 149.4 25.37 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 125.05 1.34 . . . . 0.0 109.722 -174.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 44.6 t -82.66 136.59 34.73 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.906 1.282 . . . . 0.0 109.882 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -122.36 18.0 10.59 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.171 1.389 . . . . 0.0 110.917 -178.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -79.25 149.1 31.96 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.036 0.934 . . . . 0.0 110.114 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 52.1 mm -108.73 133.73 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 C-N-CA 124.693 1.197 . . . . 0.0 108.763 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 67.4 p -138.9 -169.87 2.73 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.065 1.346 . . . . 0.0 108.233 175.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -117.66 5.71 12.37 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.05 1.34 . . . . 0.0 111.393 171.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -142.33 -178.0 5.53 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.233 1.413 . . . . 0.0 110.39 -171.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 41.5 t -140.54 145.5 36.87 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.546 1.138 . . . . 0.0 109.223 174.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -79.67 157.6 74.31 Favored Pre-proline 0 N--CA 1.451 -0.382 0 C-N-CA 125.097 1.359 . . . . 0.0 109.793 176.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -60.85 154.35 56.55 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.651 2.234 . . . . 0.0 110.823 177.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.2 138.04 57.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.594 0.758 . . . . 0.0 112.49 -168.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.531 0.246 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.035 176.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.273 0 CA-C-O 121.009 0.433 . . . . 0.0 110.423 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.7 p -120.17 -168.12 1.57 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 125.765 1.626 . . . . 0.0 109.875 -176.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.8 t -163.05 -178.87 6.31 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.442 1.497 . . . . 0.0 107.296 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -140.34 -56.61 0.53 Allowed 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 164.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 14.4 m-30 -93.43 112.66 24.63 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 176.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.1 m -113.2 68.38 1.2 Allowed Pre-proline 0 CA--C 1.537 0.443 0 C-N-CA 125.723 1.609 . . . . 0.0 111.303 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -79.85 165.15 22.4 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 121.631 1.554 . . . . 0.0 109.854 171.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.6 t -156.69 163.58 39.13 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.957 -178.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 70.6 p -72.96 175.98 6.13 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.981 171.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -106.48 4.93 28.81 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.317 1.047 . . . . 0.0 111.569 170.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 55.8 p -81.2 179.69 7.74 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.7 1.2 . . . . 0.0 112.043 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.5 tp -132.68 107.25 12.94 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 126.337 1.855 . . . . 0.0 108.194 -174.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -70.05 158.75 91.57 Favored 'Cis proline' 0 N--CA 1.457 -0.67 0 CA-C-N 119.808 0.967 . . . . 0.0 111.783 -1.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -78.74 135.95 13.16 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 124.067 3.178 . . . . 0.0 110.315 178.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -106.35 101.82 11.26 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 176.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 38.7 m -108.13 143.25 37.15 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.301 1.04 . . . . 0.0 108.783 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -139.46 177.24 8.07 Favored 'General case' 0 C--N 1.339 0.136 0 O-C-N 123.686 0.616 . . . . 0.0 111.294 -171.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 53.3 m -106.71 131.67 53.58 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 163.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 53.5 p -120.92 -1.71 9.86 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -67.01 137.77 56.73 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 118.507 0.594 . . . . 0.0 110.342 174.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.7 t -112.54 120.78 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 -170.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.1 mmm-85 -150.53 -161.11 1.27 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.225 1.41 . . . . 0.0 108.293 -164.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -68.38 -153.6 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 165.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -56.77 150.74 15.53 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -170.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.6 p -64.02 145.7 55.42 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 113.92 -1.491 . . . . 0.0 110.954 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.1 p80 -71.92 176.04 5.34 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -164.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.5 t -75.05 26.42 0.09 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.857 1.263 . . . . 0.0 113.18 -175.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -157.03 62.79 0.5 Allowed 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.622 0.769 . . . . 0.0 109.693 171.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.2 m -127.07 130.93 50.87 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.935 0.894 . . . . 0.0 109.82 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -105.48 -45.33 4.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.494 1.518 . . . . 0.0 107.572 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.2 t -107.88 139.64 42.17 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 166.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 18.8 t -156.28 147.54 22.4 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.536 1.534 . . . . 0.0 107.914 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.4 tp -156.53 157.05 34.71 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.4 m -126.41 160.69 29.77 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.029 0.932 . . . . 0.0 109.807 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 60.3 p -77.18 155.14 32.47 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.509 0.723 . . . . 0.0 110.596 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -91.25 10.65 26.34 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.918 0.887 . . . . 0.0 111.932 173.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 p -73.31 176.55 5.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.965 0.906 . . . . 0.0 111.071 176.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -128.16 112.23 19.94 Favored Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 124.645 1.178 . . . . 0.0 108.008 174.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.32 150.25 91.27 Favored 'Cis proline' 0 N--CA 1.456 -0.707 0 CA-C-N 119.517 0.863 . . . . 0.0 110.392 -1.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.06 154.6 47.44 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.31 2.673 . . . . 0.0 109.1 172.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -149.92 137.85 20.23 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.121 0.568 . . . . 0.0 109.487 -172.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.3 m -108.22 154.75 21.31 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 123.638 0.775 . . . . 0.0 112.542 -164.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -152.24 148.16 27.24 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.399 1.08 . . . . 0.0 109.526 -176.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 36.2 t -99.71 118.94 37.29 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 125.95 1.7 . . . . 0.0 109.157 -176.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -107.49 26.41 10.27 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.945 0.898 . . . . 0.0 111.704 -171.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -62.11 138.82 58.45 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.526 0.73 . . . . 0.0 110.4 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 19.3 mm -105.4 111.62 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.3 p -138.05 161.15 37.49 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.775 0.83 . . . . 0.0 109.767 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -74.73 -20.7 59.72 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.21 0.604 . . . . 0.0 111.774 173.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 36.0 p90 -115.3 -172.54 2.16 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 125.936 1.694 . . . . 0.0 109.982 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.5 t -145.74 155.45 42.96 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.37 1.068 . . . . 0.0 109.066 171.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -82.64 157.22 67.47 Favored Pre-proline 0 N--CA 1.451 -0.391 0 C-N-CA 124.252 1.021 . . . . 0.0 109.642 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.38 176.23 8.27 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.064 2.509 . . . . 0.0 111.442 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 p -63.3 141.72 58.66 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.948 0.899 . . . . 0.0 112.123 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.532 0.276 0 C-N-CA 124.539 1.136 . . . . 0.0 111.238 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.465 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.0 p -143.15 169.32 17.82 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 122.1 0.952 . . . . 0.0 111.505 178.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.8 t -158.32 153.13 24.96 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 126.234 1.814 . . . . 0.0 107.113 -168.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -107.26 -70.79 0.78 Allowed 'General case' 0 C--N 1.339 0.109 0 C-N-CA 123.406 0.682 . . . . 0.0 109.751 -170.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -89.89 111.68 22.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 173.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 4.8 t -126.68 69.1 70.47 Favored Pre-proline 0 CA--C 1.533 0.302 0 O-C-N 123.853 0.721 . . . . 0.0 112.461 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.1 158.99 55.69 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.8 2.333 . . . . 0.0 110.924 174.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.1 m -136.75 158.09 45.26 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.972 0.909 . . . . 0.0 110.926 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.3 p -79.2 163.83 24.69 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.618 0.767 . . . . 0.0 109.082 172.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 68.9 mtp85 -113.36 33.39 5.14 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.827 0.851 . . . . 0.0 109.862 172.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.3 p -78.71 176.91 9.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.507 1.123 . . . . 0.0 109.687 168.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.6 mm -127.76 111.72 20.56 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.577 1.151 . . . . 0.0 108.203 176.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.1 157.67 89.93 Favored 'Cis proline' 0 CA--C 1.537 0.668 0 CA-C-N 119.206 0.752 . . . . 0.0 110.218 -5.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -82.46 146.87 13.91 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.866 3.044 . . . . 0.0 110.734 175.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -120.64 130.14 54.02 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.673 1.589 . . . . 0.0 108.106 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 80.1 m -106.93 144.39 33.64 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.979 1.311 . . . . 0.0 109.164 174.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -140.74 160.34 40.26 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.103 1.361 . . . . 0.0 109.652 -176.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.6 m -107.29 125.96 51.82 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 124.271 1.028 . . . . 0.0 109.535 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.1 p -108.95 -17.8 13.83 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.475 1.11 . . . . 0.0 112.157 -172.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -62.34 142.84 57.59 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.127 0.571 . . . . 0.0 111.191 176.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.8 t -114.16 137.32 47.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 125.342 1.457 . . . . 0.0 107.838 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -160.07 -153.63 0.35 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 -174.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -76.72 -153.83 0.05 Allowed 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.834 0.854 . . . . 0.0 108.887 167.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 158.44 7.75 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.368 0.667 . . . . 0.0 112.017 -171.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.2 m -72.51 164.83 25.78 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.997 0.919 . . . . 0.0 111.424 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 22.7 p80 -78.07 168.76 19.37 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.79 0.805 . . . . 0.0 112.689 -171.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.7 t -58.62 -23.14 58.34 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 114.055 -1.43 . . . . 0.0 113.401 -172.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -119.74 29.57 7.5 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.373 1.069 . . . . 0.0 112.11 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.9 t -88.16 139.16 30.79 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 172.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -104.31 -51.9 3.02 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.649 1.18 . . . . 0.0 109.92 -175.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.3 t -107.22 119.67 40.03 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 48.8 t -126.81 138.92 53.42 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 125.441 1.497 . . . . 0.0 108.107 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.6 tp -144.29 153.31 41.89 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.7 m -130.41 156.28 45.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.053 0.941 . . . . 0.0 109.666 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -90.31 152.55 20.98 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 123.446 0.467 . . . . 0.0 110.002 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -88.54 15.3 8.21 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.222 1.009 . . . . 0.0 111.887 174.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 m -67.24 172.87 4.3 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.883 0.873 . . . . 0.0 110.545 173.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -125.93 113.14 24.44 Favored Pre-proline 0 CA--C 1.532 0.264 0 C-N-CA 124.018 0.927 . . . . 0.0 109.075 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.03 154.02 93.86 Favored 'Cis proline' 0 CA--C 1.54 0.783 0 CA-C-N 119.56 0.879 . . . . 0.0 110.92 -2.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -84.43 126.38 3.6 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.221 3.281 . . . . 0.0 109.987 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -113.83 158.44 21.02 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.555 1.142 . . . . 0.0 109.237 174.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 98.6 m -113.64 159.53 19.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.871 1.269 . . . . 0.0 110.52 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -156.19 144.8 20.12 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.699 1.2 . . . . 0.0 108.786 -174.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 53.1 t -91.64 122.36 34.14 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.655 -175.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -103.68 5.15 36.14 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.459 1.504 . . . . 0.0 111.286 -174.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -59.93 127.91 34.26 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.669 0.788 . . . . 0.0 109.787 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 35.8 mm -106.72 129.68 59.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 p -142.99 153.83 43.39 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 123.163 0.585 . . . . 0.0 109.648 178.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -62.83 -39.77 95.37 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.154 0.581 . . . . 0.0 110.67 172.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -88.89 -176.65 5.27 Favored 'General case' 0 N--CA 1.458 -0.071 0 C-N-CA 124.36 1.064 . . . . 0.0 110.045 173.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 10.6 t -151.78 153.16 33.73 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.464 0.706 . . . . 0.0 110.112 165.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -73.95 153.32 88.88 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 124.58 1.152 . . . . 0.0 109.464 175.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -72.75 179.9 4.82 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.097 2.531 . . . . 0.0 111.291 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.96 136.63 51.75 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.613 1.165 . . . . 0.0 112.132 -176.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.097 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.78 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.6 p -156.7 166.1 34.36 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.897 0.856 . . . . 0.0 111.932 170.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 t -168.08 156.48 8.9 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.496 1.918 . . . . 0.0 108.122 -176.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -104.22 -68.2 0.86 Allowed 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -84.63 99.23 10.65 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.7 t -117.14 77.49 9.38 Favored Pre-proline 0 CA--C 1.531 0.227 0 C-N-CA 124.233 1.013 . . . . 0.0 111.292 178.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -74.44 159.64 42.88 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.02 1.813 . . . . 0.0 110.242 170.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.5 m -134.39 156.85 47.79 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.669 1.188 . . . . 0.0 108.638 173.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.4 p -77.84 170.13 17.11 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.501 0.721 . . . . 0.0 109.984 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -108.28 10.09 27.8 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.813 1.245 . . . . 0.0 112.309 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.4 p -73.17 179.78 3.7 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.559 1.544 . . . . 0.0 111.868 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 tp -128.4 101.42 21.61 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 125.858 1.663 . . . . 0.0 108.966 -176.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -75.12 155.31 99.83 Favored 'Cis proline' 0 CA--C 1.536 0.61 0 CA-C-N 119.788 0.96 . . . . 0.0 110.492 -2.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -81.64 140.5 11.81 Favored 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 123.245 2.63 . . . . 0.0 109.712 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.46 141.13 40.79 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.27 1.428 . . . . 0.0 108.004 174.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 93.0 m -107.54 144.69 34.18 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.879 1.272 . . . . 0.0 109.333 176.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -144.27 -179.84 6.78 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.641 1.576 . . . . 0.0 108.576 -173.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 8.2 m -135.05 146.58 49.1 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 120.97 0.414 . . . . 0.0 111.352 175.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 80.7 p -121.64 17.51 11.18 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.271 1.428 . . . . 0.0 110.518 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -75.13 150.9 38.64 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.987 0.915 . . . . 0.0 108.98 174.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.406 HG13 ' HG2' ' A' ' 49' ' ' ARG . 59.8 t -141.46 112.35 3.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 C-N-CA 125.029 1.332 . . . . 0.0 108.536 -170.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.1 mtp-105 -144.07 -153.3 0.46 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.833 0.853 . . . . 0.0 108.8 -171.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -76.2 -131.03 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 169.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -63.7 162.82 12.53 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.46 1.027 . . . . 0.0 112.098 -174.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.7 m -88.11 151.01 23.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.374 1.469 . . . . 0.0 109.347 -172.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.0 p80 -84.03 174.72 10.06 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 121.934 0.873 . . . . 0.0 113.131 -172.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.7 t -59.11 -34.99 72.66 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.568 1.547 . . . . 0.0 112.873 -173.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.59 46.23 0.98 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.122 0.969 . . . . 0.0 110.164 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 11.2 t -144.13 103.3 3.99 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 175.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -102.77 -35.2 8.73 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 125.801 1.64 . . . . 0.0 109.255 -166.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t -102.81 125.33 49.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 170.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 11.0 t -154.87 144.29 21.27 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.57 1.148 . . . . 0.0 107.953 -172.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.5 tp -146.95 141.39 26.43 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -176.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.1 m -113.0 153.94 27.26 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.215 1.006 . . . . 0.0 110.488 -174.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.7 t -89.75 154.76 19.67 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.364 -175.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -90.13 16.33 8.65 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.76 1.224 . . . . 0.0 111.572 174.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 m -75.44 178.47 5.89 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.209 1.004 . . . . 0.0 110.547 174.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -126.88 115.65 22.26 Favored Pre-proline 0 CA--C 1.535 0.388 0 C-N-CA 124.441 1.096 . . . . 0.0 108.47 174.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.0 146.57 87.04 Favored 'Cis proline' 0 N--CA 1.456 -0.708 0 CA-C-N 119.772 0.954 . . . . 0.0 110.509 0.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -76.73 121.53 5.96 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 123.05 2.5 . . . . 0.0 109.485 176.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -120.78 156.89 30.91 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.265 1.426 . . . . 0.0 109.401 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.9 m -108.08 142.48 38.2 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.508 0.723 . . . . 0.0 110.608 -176.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.406 ' HG2' HG13 ' A' ' 27' ' ' VAL . 16.4 mtm-85 -126.71 131.63 51.32 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 126.782 2.033 . . . . 0.0 106.783 -167.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 5.8 m -76.36 136.1 39.52 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.171 0.441 . . . . 0.0 110.023 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -118.34 15.46 13.91 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.64 1.576 . . . . 0.0 109.866 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -82.01 152.25 26.76 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.529 1.132 . . . . 0.0 111.299 -169.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 45.6 mm -116.5 132.65 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 124.963 1.305 . . . . 0.0 108.202 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.9 p -134.95 177.89 7.45 Favored 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 159.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -78.64 -20.56 50.04 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.974 -0.454 . . . . 0.0 111.145 172.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -123.47 174.36 7.43 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 126.045 1.738 . . . . 0.0 111.721 -169.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 7.6 m -107.55 157.13 18.29 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.314 1.446 . . . . 0.0 110.33 176.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -100.27 156.9 34.73 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 126.67 1.988 . . . . 0.0 108.086 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -69.19 174.33 9.16 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.04 2.493 . . . . 0.0 112.073 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.7 p -63.11 145.14 56.11 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.92 0.888 . . . . 0.0 112.105 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.177 0 C-N-CA 125.115 1.366 . . . . 0.0 111.903 -173.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.258 0 CA-C-O 120.572 0.225 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.9 p -146.25 -179.97 7.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.582 1.153 . . . . 0.0 109.705 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 44.5 t -170.68 156.97 5.48 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.176 1.79 . . . . 0.0 107.2 174.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -105.57 -64.63 1.12 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.379 0.671 . . . . 0.0 109.552 -176.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -101.46 112.1 24.53 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 172.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 9.1 t -130.29 75.75 78.75 Favored Pre-proline 0 CA--C 1.531 0.227 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.84 158.29 53.28 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 122.605 2.203 . . . . 0.0 111.149 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.6 m -136.97 156.95 47.79 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.27 1.028 . . . . 0.0 110.61 -178.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 74.7 p -82.54 159.45 22.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 168.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 -106.65 31.21 5.41 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.506 0.722 . . . . 0.0 109.929 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.8 p -75.21 176.96 6.85 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.034 1.334 . . . . 0.0 110.167 173.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 34.4 mm -125.4 106.41 27.42 Favored Pre-proline 0 CA--C 1.533 0.292 0 C-N-CA 124.525 1.13 . . . . 0.0 108.384 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -72.8 161.38 93.55 Favored 'Cis proline' 0 CA--C 1.539 0.742 0 N-CA-C 109.856 -0.863 . . . . 0.0 109.856 -5.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -74.93 151.6 40.11 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 123.393 2.729 . . . . 0.0 110.418 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -122.32 119.26 30.58 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.941 1.296 . . . . 0.0 108.171 176.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 75.5 m -106.93 141.52 38.02 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.055 1.342 . . . . 0.0 109.492 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.19 162.41 36.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.919 1.288 . . . . 0.0 110.579 -178.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.3 m -104.29 131.28 51.79 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.977 1.311 . . . . 0.0 109.385 -176.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 47.4 p -107.55 -26.36 10.94 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.293 1.037 . . . . 0.0 111.124 -178.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -61.67 144.01 55.22 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.076 0.465 . . . . 0.0 109.82 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.5 t -118.73 142.34 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -158.23 -150.84 0.27 Allowed 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -170.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -74.75 -149.57 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 162.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -64.14 160.19 18.85 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.951 0.881 . . . . 0.0 112.267 -170.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 7.4 p -67.22 162.12 23.32 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.193 1.797 . . . . 0.0 111.626 176.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -82.0 173.11 12.51 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.032 0.933 . . . . 0.0 113.123 -172.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.8 t -57.75 -33.09 68.11 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.551 1.541 . . . . 0.0 112.943 -173.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.57 42.8 1.27 Allowed 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 124.064 0.946 . . . . 0.0 110.574 -177.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.6 t -117.59 128.95 55.45 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.03 0.932 . . . . 0.0 108.936 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.0 tttp -104.78 -47.31 4.08 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 124.064 0.945 . . . . 0.0 110.113 -171.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.0 p -103.61 125.85 50.38 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 125.639 1.576 . . . . 0.0 106.993 172.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 38.5 t -148.95 140.22 23.19 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.474 1.11 . . . . 0.0 108.244 -166.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.88 156.82 46.03 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 124.178 0.991 . . . . 0.0 109.673 -167.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 34.1 m -138.59 161.69 36.45 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.069 0.948 . . . . 0.0 109.815 174.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 44.9 p -87.28 150.78 23.65 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.046 0.938 . . . . 0.0 110.082 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -85.55 10.36 13.34 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.784 0.833 . . . . 0.0 112.411 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.0 p -71.28 176.41 4.59 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.859 1.264 . . . . 0.0 111.145 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -129.68 114.72 18.0 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.625 171.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.09 145.43 82.28 Favored 'Cis proline' 0 CA--C 1.54 0.806 0 CA-C-N 119.596 0.891 . . . . 0.0 110.743 -0.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.33 125.18 8.94 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.372 2.714 . . . . 0.0 109.43 177.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -109.36 143.0 39.49 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.635 1.174 . . . . 0.0 109.269 -178.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 64.1 m -113.5 160.81 18.09 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.043 0.937 . . . . 0.0 111.754 -169.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -159.5 163.68 35.05 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.75 1.22 . . . . 0.0 110.142 -170.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 52.8 t -99.28 142.6 30.56 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.746 1.218 . . . . 0.0 109.441 175.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -111.91 -12.17 13.8 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.441 1.097 . . . . 0.0 111.635 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.31 142.72 54.34 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.335 1.054 . . . . 0.0 112.708 -174.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.0 mm -105.96 133.27 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 125.748 1.619 . . . . 0.0 107.597 -172.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.8 p -131.88 158.23 41.9 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.088 0.47 . . . . 0.0 111.137 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -74.42 -44.08 53.46 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.023 1.329 . . . . 0.0 110.627 172.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -93.06 -167.95 1.83 Allowed 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 124.96 1.304 . . . . 0.0 108.294 170.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 7.8 t -147.61 154.96 41.31 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 157.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -72.27 153.4 92.28 Favored Pre-proline 0 N--CA 1.451 -0.424 0 C-N-CA 124.693 1.197 . . . . 0.0 109.817 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -72.7 174.83 11.14 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.277 2.652 . . . . 0.0 111.472 -176.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.38 132.06 43.38 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.491 1.116 . . . . 0.0 111.88 -176.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.6 t . . . . . 0 N--CA 1.457 -0.092 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.02 177.12 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.198 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.1 p -141.29 -179.59 6.21 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.08 0.952 . . . . 0.0 110.197 -175.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 29.5 t -173.68 150.63 1.75 Allowed 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.459 1.904 . . . . 0.0 106.582 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -106.0 -70.9 0.77 Allowed 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -174.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -85.04 109.33 18.13 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 174.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.4 t -126.2 73.16 72.05 Favored Pre-proline 0 CA--C 1.528 0.134 0 C-N-CA 122.721 0.408 . . . . 0.0 111.453 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -69.27 162.11 43.15 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.284 1.989 . . . . 0.0 110.504 172.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 21.3 m -136.12 158.68 43.83 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.944 0.898 . . . . 0.0 109.803 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.9 p -80.86 163.51 23.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.71 0.804 . . . . 0.0 109.324 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 85.4 mtm180 -108.73 32.26 5.01 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.782 0.833 . . . . 0.0 110.665 175.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 29.9 p -87.6 -177.54 5.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.576 1.151 . . . . 0.0 110.92 179.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.2 tp -127.1 100.6 26.8 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 125.519 1.528 . . . . 0.0 109.568 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.62 159.14 97.93 Favored 'Cis proline' 0 N--CA 1.458 -0.575 0 CA-C-N 119.684 0.923 . . . . 0.0 110.357 -3.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -80.12 147.85 18.86 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.162 2.575 . . . . 0.0 109.775 171.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.64 137.68 52.48 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.342 1.457 . . . . 0.0 107.985 172.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.6 m -108.23 144.77 35.24 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.992 1.317 . . . . 0.0 108.724 173.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -150.63 155.91 40.31 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.989 1.316 . . . . 0.0 108.47 -171.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.8 m -104.63 128.44 52.66 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.344 0.657 . . . . 0.0 109.671 -174.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 46.3 p -108.78 1.86 21.31 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.934 0.894 . . . . 0.0 111.802 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -71.17 154.03 42.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.39 0.614 . . . . 0.0 109.949 170.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.422 HG13 ' HG3' ' A' ' 49' ' ' ARG . 95.8 t -142.42 131.8 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 125.276 1.43 . . . . 0.0 107.409 -175.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.4 ttp85 -156.43 -145.76 0.16 Allowed 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 -173.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -69.05 -92.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.098 1.759 . . . . 0.0 109.96 -176.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -105.05 168.69 8.89 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.334 1.453 . . . . 0.0 109.136 168.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.2 p -82.51 169.61 16.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.654 1.582 . . . . 0.0 110.804 170.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -84.51 175.17 9.47 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.91 0.884 . . . . 0.0 111.687 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.8 t -61.71 -30.85 71.03 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.684 1.194 . . . . 0.0 112.832 -176.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.79 45.78 0.96 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.048 0.939 . . . . 0.0 110.196 -174.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -130.69 124.31 31.28 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.134 1.374 . . . . 0.0 108.844 170.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -106.27 -32.06 8.35 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 125.943 1.697 . . . . 0.0 110.133 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.1 p -99.55 57.61 1.03 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.283 1.433 . . . . 0.0 107.843 -175.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.3 t -106.97 131.49 53.98 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.1 -1.864 . . . . 0.0 108.717 -172.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.3 tp -155.48 141.92 18.64 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -172.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 m -120.08 151.57 38.84 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.251 1.02 . . . . 0.0 110.472 -173.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -85.19 154.18 22.16 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 -176.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.7 mtm105 -91.59 11.83 22.97 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.449 1.1 . . . . 0.0 111.498 176.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -72.5 178.94 3.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.586 1.154 . . . . 0.0 109.919 175.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -123.99 118.71 26.8 Favored Pre-proline 0 CA--C 1.532 0.27 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -75.03 143.58 78.24 Favored 'Cis proline' 0 CA--C 1.539 0.739 0 CA-C-N 119.664 0.916 . . . . 0.0 110.932 2.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -77.09 106.45 2.25 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.453 2.768 . . . . 0.0 109.122 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -110.74 150.42 29.1 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.926 1.29 . . . . 0.0 109.758 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -108.83 147.76 31.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.422 ' HG3' HG13 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -128.92 167.32 17.57 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.334 1.854 . . . . 0.0 109.13 -178.667 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 44.7 t -135.84 135.37 39.75 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.506 1.122 . . . . 0.0 110.449 174.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -112.97 42.25 1.92 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.621 1.568 . . . . 0.0 110.624 -173.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -62.75 158.24 19.14 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -174.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 30.3 mm -133.65 104.05 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 176.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.5 p -138.23 152.13 48.3 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.082 0.553 . . . . 0.0 109.879 175.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -66.65 -41.11 88.73 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.934 0.494 . . . . 0.0 110.242 172.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -88.8 -173.46 4.12 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.532 1.133 . . . . 0.0 109.447 172.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 6.6 t -156.58 159.65 38.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.768 0.827 . . . . 0.0 109.468 165.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -74.85 148.81 85.16 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 123.61 0.764 . . . . 0.0 109.527 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.28 171.32 16.29 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.133 2.556 . . . . 0.0 111.229 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.26 131.86 46.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.467 1.107 . . . . 0.0 111.737 -177.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.53 0.21 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.108 174.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.147 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.2 p -135.12 -176.21 4.18 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.09 0.956 . . . . 0.0 110.542 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 39.1 t -166.33 167.07 16.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.37 1.868 . . . . 0.0 107.313 175.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -113.98 -66.24 1.11 Allowed 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 168.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -80.33 110.42 15.76 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.292 1.037 . . . . 0.0 109.959 178.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.1 m -117.35 69.74 5.79 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 124.869 1.267 . . . . 0.0 111.055 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -76.81 162.4 32.5 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.083 1.856 . . . . 0.0 110.634 171.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 43.8 t -154.28 157.58 38.89 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.113 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.4 p -90.37 157.0 17.84 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.221 1.009 . . . . 0.0 109.066 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.9 mtm105 -106.88 42.59 1.27 Allowed 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.913 0.885 . . . . 0.0 109.823 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 p -96.6 179.77 4.88 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 126.066 1.746 . . . . 0.0 110.153 177.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -131.58 101.68 15.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 124.927 1.291 . . . . 0.0 107.989 -178.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -71.82 156.96 97.34 Favored 'Cis proline' 0 CA--C 1.537 0.642 0 CA-C-N 119.407 0.824 . . . . 0.0 110.615 -1.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -74.66 141.92 28.35 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 123.476 2.784 . . . . 0.0 110.542 174.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -104.77 109.6 21.61 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 171.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 68.4 m -107.21 148.1 29.33 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 125.009 1.324 . . . . 0.0 109.297 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -153.55 163.0 40.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.484 -167.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.1 t -107.77 128.46 54.6 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.651 1.18 . . . . 0.0 108.537 174.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 77.2 p -122.56 6.96 9.48 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.426 0.691 . . . . 0.0 112.385 -172.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -67.05 143.31 56.8 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 119.029 0.831 . . . . 0.0 111.345 179.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.9 t -108.69 126.35 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 125.947 1.699 . . . . 0.0 106.733 -178.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -165.8 -160.52 0.45 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -166.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -72.53 -153.07 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.594 0.758 . . . . 0.0 109.017 168.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -58.85 151.2 22.07 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.514 0.674 . . . . 0.0 112.051 -169.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 p -71.92 148.91 45.59 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.228 1.411 . . . . 0.0 111.037 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.2 p80 -75.02 170.75 15.39 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.459 -0.791 . . . . 0.0 113.097 -169.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.5 t -60.45 -31.83 70.81 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.774 1.23 . . . . 0.0 112.355 -174.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.39 36.59 2.55 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.993 0.917 . . . . 0.0 111.118 -177.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 48.7 t -114.56 136.2 53.29 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 125.409 1.483 . . . . 0.0 107.832 174.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -105.84 -54.91 2.4 Favored 'General case' 0 CA--C 1.522 -0.097 0 C-N-CA 124.116 0.966 . . . . 0.0 109.684 -168.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.3 t -105.35 137.1 43.69 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 107.381 -1.341 . . . . 0.0 107.381 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.6 t -154.42 143.71 21.29 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.167 0.987 . . . . 0.0 109.164 -168.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 64.6 tp -152.41 151.75 31.18 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 124.458 1.103 . . . . 0.0 108.874 -175.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.2 m -130.28 163.95 25.65 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.874 0.87 . . . . 0.0 110.866 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.8 p -84.25 156.99 21.73 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.84 0.856 . . . . 0.0 110.39 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.5 ptt180 -93.46 12.82 23.69 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.342 1.057 . . . . 0.0 111.753 174.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.3 p -77.35 -179.96 6.05 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 124.467 1.107 . . . . 0.0 111.687 -177.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -130.24 106.71 16.21 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.784 1.234 . . . . 0.0 108.391 174.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.66 152.84 96.76 Favored 'Cis proline' 0 N--CA 1.456 -0.7 0 CA-C-N 119.513 0.862 . . . . 0.0 110.862 1.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.16 153.83 46.45 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.184 2.589 . . . . 0.0 108.713 170.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -148.58 135.81 20.24 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -174.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 74.8 m -107.3 157.45 17.92 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.067 0.947 . . . . 0.0 111.32 -168.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 19.8 ttp-105 -154.23 153.13 31.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.916 1.286 . . . . 0.0 108.879 -171.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.7 m -89.43 152.41 21.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.584 1.154 . . . . 0.0 110.754 173.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -130.41 21.93 5.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.109 1.764 . . . . 0.0 109.384 170.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -67.48 124.75 24.06 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.022 1.329 . . . . 0.0 109.796 -177.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 32.3 mm -107.84 122.05 61.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.9 p -139.41 179.46 6.53 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.264 1.426 . . . . 0.0 108.662 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -78.57 -9.64 59.43 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.967 -0.458 . . . . 0.0 111.431 172.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -138.02 -170.22 2.74 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.94 1.696 . . . . 0.0 110.34 -170.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 35.4 t -154.51 153.11 30.94 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.353 1.461 . . . . 0.0 108.506 171.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -78.9 151.59 76.5 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.975 0.91 . . . . 0.0 110.44 -176.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -70.13 173.47 11.25 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.053 2.502 . . . . 0.0 112.062 -173.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.1 p -59.28 133.59 56.24 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.115 0.966 . . . . 0.0 112.413 -174.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.239 0 CA-C-N 114.341 -1.299 . . . . 0.0 110.903 178.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.162 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.0 p -149.65 -171.34 3.87 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 123.779 0.831 . . . . 0.0 110.07 -170.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 t -169.96 -177.34 2.57 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.101 1.76 . . . . 0.0 106.906 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.422 ' H ' ' HB2' ' A' ' 26' ' ' ASP . 9.3 t70 -108.42 -52.65 2.74 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 171.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -147.89 146.64 29.13 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.302 1.041 . . . . 0.0 108.601 162.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -136.03 96.34 12.98 Favored Pre-proline 0 N--CA 1.448 -0.541 0 C-N-CA 124.916 1.286 . . . . 0.0 111.139 -175.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.01 166.68 28.68 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.578 2.185 . . . . 0.0 110.819 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.4 m -128.71 153.44 47.33 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.213 1.005 . . . . 0.0 110.215 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.4 p -84.31 158.78 21.08 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.834 1.653 . . . . 0.0 108.998 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 42.1 mtm105 -106.13 36.71 2.48 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.083 0.953 . . . . 0.0 109.825 -177.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -90.83 178.04 6.15 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.786 1.634 . . . . 0.0 110.124 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.9 tp -131.18 98.68 18.46 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 125.481 1.513 . . . . 0.0 108.849 -175.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -73.95 154.96 99.87 Favored 'Cis proline' 0 CA--C 1.536 0.622 0 CA-C-N 119.693 0.926 . . . . 0.0 111.126 0.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -78.82 140.25 16.17 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 123.54 2.826 . . . . 0.0 109.924 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -107.24 159.15 16.56 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.696 1.198 . . . . 0.0 108.833 173.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 72.8 m -132.12 142.53 49.53 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.9 1.28 . . . . 0.0 109.132 179.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -143.8 174.25 10.98 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.211 1.004 . . . . 0.0 108.605 -173.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.1 m -102.68 150.89 22.99 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 174.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.6 t -104.68 -9.52 18.14 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.366 163.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.422 ' HB2' ' H ' ' A' ' 10' ' ' ASP . 21.9 t0 -55.92 149.7 14.64 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.986 1.314 . . . . 0.0 112.313 173.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.535 HG13 ' HG2' ' A' ' 49' ' ' ARG . 53.6 t -144.23 147.15 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 127.763 2.425 . . . . 0.0 105.914 174.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -155.19 -152.41 0.4 Allowed 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 -173.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -78.9 -116.3 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 155.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -68.53 158.27 34.22 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.894 1.225 . . . . 0.0 111.855 -178.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 4.1 p -82.59 163.3 21.55 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.49 1.916 . . . . 0.0 110.754 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 33.5 p80 -71.22 168.05 18.1 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -167.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.4 t -52.02 -37.85 54.87 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.871 1.668 . . . . 0.0 112.634 -173.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.35 24.77 12.34 Favored 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 124.367 1.067 . . . . 0.0 112.513 -175.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.9 t -91.21 127.46 36.65 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 175.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 tttp -104.85 -45.25 4.62 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.573 0.749 . . . . 0.0 110.452 -172.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.5 t -104.67 129.55 52.82 Favored 'General case' 0 CA--C 1.523 -0.085 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 172.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.6 t -150.38 140.66 22.26 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.006 0.922 . . . . 0.0 108.634 -168.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 22.4 tp -153.38 158.97 42.27 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.875 0.87 . . . . 0.0 109.436 -169.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 24.6 m -123.74 165.98 16.35 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.344 0.657 . . . . 0.0 111.102 -175.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -93.18 150.67 20.33 Favored 'General case' 0 C--N 1.341 0.221 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 169.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -91.69 15.24 13.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.54 1.136 . . . . 0.0 111.922 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -67.2 172.36 4.79 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 123.86 0.864 . . . . 0.0 110.593 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -121.07 110.32 34.75 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 172.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -74.21 152.7 98.56 Favored 'Cis proline' 0 CA--C 1.54 0.816 0 CA-C-N 119.592 0.89 . . . . 0.0 110.775 -0.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -82.01 131.76 7.07 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 124.148 3.232 . . . . 0.0 109.942 173.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -113.4 152.01 30.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.611 1.565 . . . . 0.0 108.063 174.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 92.1 m -113.53 154.4 27.17 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.606 0.762 . . . . 0.0 110.931 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.535 ' HG2' HG13 ' A' ' 27' ' ' VAL . 14.4 mtm105 -147.79 147.26 29.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.305 1.042 . . . . 0.0 109.448 -155.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 43.2 t -84.67 136.72 33.62 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 172.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -106.62 -23.59 12.4 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.109 1.364 . . . . 0.0 110.585 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -47.66 143.69 3.69 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 126.045 1.738 . . . . 0.0 113.26 -172.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.0 mm -106.37 127.92 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 C-N-CA 125.122 1.369 . . . . 0.0 107.327 -176.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.1 p -126.99 173.1 9.91 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.538 0.735 . . . . 0.0 109.476 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -88.99 -9.6 50.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.633 0.773 . . . . 0.0 111.328 174.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -133.75 173.28 11.7 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 125.43 1.492 . . . . 0.0 110.95 -174.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.1 t -110.12 137.06 48.38 Favored 'General case' 0 N--CA 1.458 -0.07 0 C-N-CA 125.853 1.661 . . . . 0.0 108.86 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -75.29 157.97 84.31 Favored Pre-proline 0 N--CA 1.449 -0.49 0 C-N-CA 126.635 1.974 . . . . 0.0 109.881 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -67.59 158.11 58.67 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 122.071 1.847 . . . . 0.0 109.817 170.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.0 p -67.41 149.27 50.49 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 120.937 0.399 . . . . 0.0 111.21 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.266 0 C-N-CA 124.548 1.139 . . . . 0.0 110.6 -178.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.275 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.7 p -143.63 164.86 29.21 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.439 0.638 . . . . 0.0 112.001 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 53.3 t -174.32 143.53 0.87 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.869 -166.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -104.8 -65.99 1.0 Allowed 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.743 0.817 . . . . 0.0 108.915 -174.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -85.81 107.79 17.81 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 26.5 p -124.26 61.11 25.83 Favored Pre-proline 0 CA--C 1.535 0.396 0 C-N-CA 124.914 1.286 . . . . 0.0 111.292 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -71.56 159.73 50.39 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.561 2.174 . . . . 0.0 111.042 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 24.9 m -129.19 157.4 41.92 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.035 0.934 . . . . 0.0 110.263 178.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.6 p -73.82 173.03 10.46 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.488 0.715 . . . . 0.0 110.289 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -106.05 10.67 32.09 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.663 1.185 . . . . 0.0 111.61 176.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 p -73.58 172.72 10.84 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 124.264 1.026 . . . . 0.0 111.681 179.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.8 tp -128.79 100.09 21.87 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 126.012 1.725 . . . . 0.0 108.727 -177.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.92 158.48 96.35 Favored 'Cis proline' 0 CA--C 1.534 0.51 0 CA-C-N 119.68 0.921 . . . . 0.0 111.616 0.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.79 145.99 14.6 Favored 'Trans proline' 0 N--CA 1.451 -0.978 0 C-N-CA 123.305 2.67 . . . . 0.0 110.236 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -113.71 131.54 56.14 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.029 1.731 . . . . 0.0 106.739 175.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 88.7 m -105.5 144.2 32.6 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 123.724 0.81 . . . . 0.0 108.866 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -143.58 159.71 41.95 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.137 0.975 . . . . 0.0 108.763 -171.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 18.2 m -107.35 121.24 44.17 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.671 0.788 . . . . 0.0 109.317 178.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 70.8 p -107.9 22.85 15.36 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.419 1.087 . . . . 0.0 109.948 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -76.13 148.61 37.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 170.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.2 t -143.1 127.4 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 125.102 1.361 . . . . 0.0 107.787 -173.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -165.25 -156.06 0.27 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.227 0.611 . . . . 0.0 109.48 -173.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -57.69 -81.01 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.109 0.964 . . . . 0.0 110.664 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -116.12 169.86 8.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.297 1.439 . . . . 0.0 111.712 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 p -96.54 159.31 15.0 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.838 2.055 . . . . 0.0 111.424 177.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -88.47 172.29 9.46 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.021 0.928 . . . . 0.0 113.47 -170.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.4 t -51.93 -39.51 59.29 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.975 1.71 . . . . 0.0 112.797 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.81 42.79 1.34 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.176 0.991 . . . . 0.0 110.871 -174.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 51.1 t -123.26 119.8 31.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 173.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -102.51 -40.76 6.53 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.837 1.255 . . . . 0.0 110.188 -165.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.9 t -104.11 118.72 37.33 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 170.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.3 t -144.98 133.06 21.42 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.903 1.681 . . . . 0.0 107.322 -175.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.2 tt -153.68 140.44 19.05 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -172.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.4 m -118.87 159.67 23.33 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.437 1.095 . . . . 0.0 111.311 -169.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.6 t -78.83 148.15 32.97 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 29.6 ptt-85 -93.81 41.06 1.08 Allowed 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.881 1.272 . . . . 0.0 110.447 -175.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 t -163.23 -160.8 0.63 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.334 0.654 . . . . 0.0 110.056 -174.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -107.79 131.62 21.6 Favored Pre-proline 0 N--CA 1.442 -0.867 0 C-N-CA 127.124 2.169 . . . . 0.0 108.648 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -73.53 145.96 85.55 Favored 'Cis proline' 0 N--CA 1.456 -0.71 0 N-CA-C 109.283 -1.084 . . . . 0.0 109.283 -4.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -77.71 84.36 1.99 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.115 2.543 . . . . 0.0 108.953 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -107.2 145.99 31.94 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.485 1.514 . . . . 0.0 108.547 -177.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -116.13 148.19 40.57 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.422 0.629 . . . . 0.0 112.486 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 27.8 mtm-85 -119.67 156.64 30.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.956 1.702 . . . . 0.0 109.16 -175.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 1.7 m -100.11 160.23 14.48 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.989 0.916 . . . . 0.0 109.328 165.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -154.04 27.53 0.47 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.292 1.037 . . . . 0.0 109.688 175.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -73.26 153.07 40.76 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 123.813 0.845 . . . . 0.0 110.544 -176.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.0 mm -106.47 132.48 53.57 Favored 'Isoleucine or valine' 0 C--N 1.34 0.18 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -176.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 56.4 p -144.1 -165.19 2.06 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.443 1.497 . . . . 0.0 108.238 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -134.87 18.58 3.5 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.245 1.018 . . . . 0.0 110.609 172.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -156.5 178.61 10.12 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.365 1.466 . . . . 0.0 110.215 -173.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.0 t -111.21 148.2 33.33 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.843 1.257 . . . . 0.0 109.97 178.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -97.75 151.99 37.88 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.394 1.478 . . . . 0.0 108.79 172.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -64.59 163.67 26.47 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.222 2.615 . . . . 0.0 111.714 -176.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.2 p -57.33 139.14 53.77 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.038 0.935 . . . . 0.0 112.555 -175.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.462 0.136 0 C-N-CA 124.453 1.101 . . . . 0.0 112.085 -173.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 119.759 -0.162 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.3 p -149.21 173.15 13.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.679 0.752 . . . . 0.0 111.768 -175.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 t -170.23 152.41 4.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 126.323 1.849 . . . . 0.0 108.219 -174.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -105.14 -66.86 0.95 Allowed 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 -177.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -93.19 104.24 16.44 Favored 'General case' 0 C--N 1.344 0.337 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 21.4 p -119.93 64.32 9.26 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 126.916 2.086 . . . . 0.0 110.764 -174.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -67.3 156.65 65.32 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.517 2.144 . . . . 0.0 111.817 -177.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 63.4 m -130.33 159.32 37.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.471 1.108 . . . . 0.0 109.99 178.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 81.9 p -89.27 172.17 9.24 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.421 1.489 . . . . 0.0 110.245 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 33.0 ptt-85 -107.47 -1.59 21.26 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.132 1.373 . . . . 0.0 112.436 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.7 p -71.36 179.37 2.96 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.516 1.526 . . . . 0.0 111.315 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.0 mm -128.46 117.57 20.01 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 124.973 1.309 . . . . 0.0 108.548 -177.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -69.91 146.57 82.88 Favored 'Cis proline' 0 N--CA 1.456 -0.689 0 N-CA-C 109.525 -0.991 . . . . 0.0 109.525 -5.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -72.16 125.97 11.33 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.703 2.269 . . . . 0.0 109.024 178.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.33 151.36 24.26 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.233 1.013 . . . . 0.0 109.224 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.7 m -127.66 145.84 50.75 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.466 1.507 . . . . 0.0 109.809 -177.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -150.52 163.96 37.16 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.545 1.538 . . . . 0.0 108.287 -171.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 68.7 m -107.68 141.68 38.82 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.548 0.739 . . . . 0.0 110.097 171.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.0 t -107.53 -12.03 15.36 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.462 -172.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.67 146.91 51.03 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.812 0.845 . . . . 0.0 110.452 -176.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 85.0 t -110.35 126.04 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 174.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.75 -166.25 2.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.922 0.889 . . . . 0.0 111.515 -171.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -71.69 -136.94 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 165.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -63.03 157.17 22.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 120.633 -1.292 . . . . 0.0 112.347 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.1 m -75.45 166.55 23.42 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.147 175.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -88.3 171.18 10.36 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.704 0.802 . . . . 0.0 112.916 -173.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.6 t -63.52 -24.39 67.8 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.073 1.349 . . . . 0.0 113.102 -175.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -103.7 34.59 2.93 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.225 1.01 . . . . 0.0 110.781 178.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.8 t -119.59 126.59 51.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.563 1.145 . . . . 0.0 108.309 175.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -105.84 -38.93 6.2 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.753 1.221 . . . . 0.0 109.923 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.1 t -106.38 113.82 27.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 174.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.8 t -128.9 137.96 51.73 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 126.293 1.837 . . . . 0.0 107.249 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.403 HD23 ' H ' ' A' ' 40' ' ' CYS . 0.5 OUTLIER -143.02 152.16 41.61 Favored 'General case' 0 N--CA 1.46 0.069 0 C-N-CA 124.328 1.051 . . . . 0.0 108.634 -174.624 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.403 ' H ' HD23 ' A' ' 39' ' ' LEU . 6.8 m -137.75 157.08 47.2 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.802 0.841 . . . . 0.0 110.459 -173.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.8 t -91.87 151.87 20.35 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 123.406 0.441 . . . . 0.0 109.886 178.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.4 ptt-85 -97.32 19.04 13.81 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.709 1.204 . . . . 0.0 111.557 177.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -69.05 178.33 2.3 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 124.275 1.03 . . . . 0.0 110.563 170.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -123.56 117.09 27.82 Favored Pre-proline 0 CA--C 1.533 0.313 0 C-N-CA 124.071 0.948 . . . . 0.0 109.222 175.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -71.78 151.12 95.28 Favored 'Cis proline' 0 CA--C 1.54 0.804 0 CA-C-N 119.587 0.888 . . . . 0.0 110.287 -5.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -83.29 127.11 4.43 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.95 3.1 . . . . 0.0 110.244 175.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -115.95 161.48 18.77 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.761 1.224 . . . . 0.0 108.93 174.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 99.5 m -112.56 169.52 8.83 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.46 1.104 . . . . 0.0 110.618 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.1 ttp85 -159.53 146.83 16.91 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.192 1.397 . . . . 0.0 108.54 -174.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 49.9 t -89.97 124.0 34.36 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.742 0.817 . . . . 0.0 109.25 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.67 10.37 29.0 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.903 1.681 . . . . 0.0 110.571 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -67.72 145.63 54.57 Favored 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.707 -0.62 . . . . 0.0 110.635 -175.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 49.0 mm -107.45 133.85 50.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 124.497 1.119 . . . . 0.0 108.97 -169.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.2 p -141.99 -178.14 5.55 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.722 1.209 . . . . 0.0 109.551 -177.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -107.86 -5.33 17.29 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.95 1.3 . . . . 0.0 110.985 169.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -133.42 -173.19 3.15 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.982 1.713 . . . . 0.0 110.364 -168.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.7 t -121.33 146.3 47.0 Favored 'General case' 0 CA--C 1.527 0.061 0 C-N-CA 125.628 1.571 . . . . 0.0 109.207 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -78.57 160.58 72.08 Favored Pre-proline 0 N--CA 1.452 -0.349 0 C-N-CA 124.476 1.11 . . . . 0.0 108.953 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -60.0 159.7 24.76 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.392 2.061 . . . . 0.0 110.651 174.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.3 p -62.44 138.18 58.41 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 122.796 0.438 . . . . 0.0 111.017 -177.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.131 0 C-N-CA 124.529 1.131 . . . . 0.0 109.592 177.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.386 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.7 p -140.26 -170.39 2.97 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.459 1.104 . . . . 0.0 109.219 -170.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.1 t -173.58 170.99 3.97 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.387 1.875 . . . . 0.0 106.434 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -108.22 -60.74 1.68 Allowed 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 166.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -119.2 109.74 16.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.265 1.026 . . . . 0.0 109.046 -177.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.86 89.21 47.96 Favored Pre-proline 0 N--CA 1.452 -0.366 0 C-N-CA 124.596 1.158 . . . . 0.0 111.979 176.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.31 171.57 14.81 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.122 1.881 . . . . 0.0 110.859 169.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.8 m -133.17 156.54 47.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.379 1.072 . . . . 0.0 109.692 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 36.8 p -88.08 162.94 16.5 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.742 1.217 . . . . 0.0 109.611 178.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -106.47 35.24 3.03 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.31 1.044 . . . . 0.0 110.045 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 p -90.21 179.27 5.95 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.592 1.557 . . . . 0.0 110.327 175.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.37 106.21 17.55 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.954 1.302 . . . . 0.0 108.33 -178.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.37 156.78 96.62 Favored 'Cis proline' 0 CA--C 1.535 0.531 0 CA-C-N 119.618 0.899 . . . . 0.0 109.835 -4.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.05 139.95 19.64 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.657 2.238 . . . . 0.0 110.072 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -107.78 132.9 52.9 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.817 1.247 . . . . 0.0 108.107 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 79.2 m -108.07 143.97 36.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.452 1.101 . . . . 0.0 109.423 172.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -157.01 170.22 23.04 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.006 0.922 . . . . 0.0 109.365 -173.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 89.3 m -104.27 143.96 32.26 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.694 0.798 . . . . 0.0 109.877 -177.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 11.3 t -115.32 -16.69 11.44 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.682 1.193 . . . . 0.0 111.212 177.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.08 155.45 31.33 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 121.289 0.566 . . . . 0.0 111.158 -178.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.7 t -122.64 143.03 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 125.994 1.717 . . . . 0.0 107.92 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.6 tpp180 -161.67 -145.2 0.11 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.958 1.303 . . . . 0.0 107.902 -174.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -91.79 -130.84 0.11 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 125.021 1.329 . . . . 0.0 108.301 167.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -65.63 171.85 3.85 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.594 1.158 . . . . 0.0 114.086 -165.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -71.18 151.1 44.7 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.01 1.324 . . . . 0.0 109.69 179.38 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.3 p80 -81.9 -178.84 7.16 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 121.495 0.664 . . . . 0.0 112.073 173.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 t -78.44 23.95 0.29 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.311 1.045 . . . . 0.0 113.167 -172.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -160.38 69.35 0.38 Allowed 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.599 0.636 . . . . 0.0 109.866 172.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 94.1 m -124.89 124.77 42.78 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.852 0.861 . . . . 0.0 110.044 -176.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 tmtp? -105.7 -30.68 9.3 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.882 1.673 . . . . 0.0 108.75 176.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.4 t -118.86 131.46 56.07 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.438 1.495 . . . . 0.0 108.279 169.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.3 t -154.99 143.52 20.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.078 1.351 . . . . 0.0 108.376 177.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.1 tp -152.47 170.21 20.69 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 122.986 0.515 . . . . 0.0 110.069 -172.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 65.4 m -134.37 163.76 28.95 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.128 0.971 . . . . 0.0 110.598 172.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.8 p -79.68 148.94 31.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.12 0.968 . . . . 0.0 110.186 178.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.3 ptt85 -98.32 52.44 1.03 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.234 1.414 . . . . 0.0 109.122 176.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.3 t -153.39 -163.93 1.79 Allowed 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.448 1.099 . . . . 0.0 109.476 177.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -129.63 129.49 23.15 Favored Pre-proline 0 CA--C 1.533 0.312 0 C-N-CA 125.416 1.486 . . . . 0.0 108.73 -178.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -70.87 147.8 87.82 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 CA-C-N 119.682 0.922 . . . . 0.0 110.592 -0.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -74.45 98.91 1.16 Allowed 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 123.502 2.801 . . . . 0.0 108.721 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -106.55 140.73 38.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.184 1.394 . . . . 0.0 108.49 -173.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 79.1 m -126.11 153.79 44.03 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.472 0.709 . . . . 0.0 111.024 -168.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.73 162.14 36.24 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.419 1.088 . . . . 0.0 110.544 -176.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.9 t -118.68 126.4 51.84 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 125.389 1.475 . . . . 0.0 107.491 172.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -119.78 37.92 4.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.41 1.084 . . . . 0.0 110.194 -168.282 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -62.59 152.12 35.94 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.735 1.214 . . . . 0.0 112.07 -174.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 46.4 mm -108.05 101.96 13.29 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 C-N-CA 124.414 1.086 . . . . 0.0 108.233 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.3 p -113.45 -175.93 2.78 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.893 1.277 . . . . 0.0 108.63 171.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -110.49 11.3 23.11 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.937 0.895 . . . . 0.0 110.631 173.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -148.56 170.1 18.82 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.882 1.673 . . . . 0.0 110.244 -174.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 19.8 t -118.75 138.72 52.47 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 126.003 1.721 . . . . 0.0 108.556 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -82.73 154.94 68.39 Favored Pre-proline 0 N--CA 1.45 -0.466 0 C-N-CA 125.576 1.55 . . . . 0.0 109.79 -177.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -67.13 163.91 32.28 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.622 2.214 . . . . 0.0 110.473 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.3 133.25 53.86 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.413 0.685 . . . . 0.0 112.129 -172.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.534 0.345 0 C-N-CA 124.714 1.206 . . . . 0.0 110.425 176.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 40.3 p . . . . . 0 N--CA 1.473 0.712 0 CA-C-O 119.565 -0.255 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -159.37 -58.16 0.06 Allowed 'General case' 0 C--N 1.342 0.244 0 C-N-CA 123.515 0.726 . . . . 0.0 109.894 176.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p -161.63 -174.45 4.23 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.571 1.148 . . . . 0.0 109.269 -178.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.4 t -154.94 -170.8 3.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.129 0.971 . . . . 0.0 109.981 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.6 p -80.86 79.02 7.59 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.395 1.478 . . . . 0.0 109.954 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 67.8 p -74.86 -177.93 3.5 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.046 1.338 . . . . 0.0 111.418 177.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.34 110.52 1.45 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.987 0.915 . . . . 0.0 109.866 175.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.8 p -122.49 -168.75 1.78 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.425 1.49 . . . . 0.0 109.832 -172.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 5.1 t -165.99 179.22 5.95 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 170.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -132.71 -74.94 0.5 Allowed 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 170.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -90.33 115.75 27.76 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 171.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 30.0 p -119.96 72.52 17.39 Favored Pre-proline 0 CA--C 1.532 0.285 0 C-N-CA 123.571 0.748 . . . . 0.0 112.277 -178.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -75.55 161.3 37.35 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.638 2.225 . . . . 0.0 110.758 176.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.0 m -139.27 158.48 44.08 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.206 1.002 . . . . 0.0 110.694 -179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.7 p -77.88 157.06 29.99 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 169.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -106.89 36.47 2.65 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.76 0.824 . . . . 0.0 109.604 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.2 p -86.52 179.46 6.83 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.924 1.69 . . . . 0.0 110.328 175.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -126.16 104.74 25.58 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 125.28 1.432 . . . . 0.0 107.888 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.34 159.06 97.95 Favored 'Cis proline' 0 CA--C 1.536 0.593 0 CA-C-N 119.619 0.9 . . . . 0.0 110.297 -3.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -75.73 142.12 25.36 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.272 2.648 . . . . 0.0 109.885 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -111.87 126.98 55.69 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.57 1.148 . . . . 0.0 107.976 171.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.3 m -104.82 151.3 23.96 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.668 1.187 . . . . 0.0 109.339 175.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -141.86 -179.58 6.29 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 123.997 0.919 . . . . 0.0 109.866 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 93.3 m -110.83 141.61 43.96 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 167.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.7 p -117.64 34.28 5.22 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 166.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -81.66 149.77 28.38 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.526 0.679 . . . . 0.0 110.259 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.442 HG13 ' HG2' ' A' ' 49' ' ' ARG . 62.6 t -142.7 122.13 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 C-N-CA 126.004 1.722 . . . . 0.0 106.415 -177.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -162.91 -150.25 0.16 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 -166.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -68.72 -142.96 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 162.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -67.48 158.37 32.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 120.876 -1.14 . . . . 0.0 111.827 -174.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.6 p -74.12 159.2 32.93 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.569 1.548 . . . . 0.0 111.643 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -80.62 177.37 9.06 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -169.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.5 t -78.48 21.59 0.37 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.5 -1.227 . . . . 0.0 113.054 -172.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -155.3 64.34 0.62 Allowed 'General case' 0 C--N 1.341 0.236 0 CA-C-N 118.741 0.7 . . . . 0.0 109.797 173.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 76.5 m -123.79 127.93 48.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.868 0.867 . . . . 0.0 109.327 179.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -102.86 -36.52 8.21 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.769 1.628 . . . . 0.0 107.806 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.9 t -106.03 114.87 29.28 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 162.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 24.9 t -134.17 132.64 40.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.622 1.569 . . . . 0.0 107.445 169.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.2 tp -157.34 157.3 33.87 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.6 m -122.22 166.17 15.03 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.827 0.851 . . . . 0.0 110.352 -174.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.7 t -89.73 150.25 22.38 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 168.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -82.88 0.93 41.91 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.149 1.38 . . . . 0.0 112.403 177.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 m -69.33 -178.09 1.28 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.036 1.334 . . . . 0.0 111.512 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -120.3 111.05 35.41 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.727 1.211 . . . . 0.0 108.163 175.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -74.36 149.86 94.62 Favored 'Cis proline' 0 N--CA 1.458 -0.611 0 CA-C-N 119.972 1.026 . . . . 0.0 110.611 0.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -75.94 108.58 2.71 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.754 2.303 . . . . 0.0 108.338 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -104.4 140.17 38.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -177.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 65.8 m -107.07 151.04 25.89 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 123.843 0.857 . . . . 0.0 109.701 -172.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.442 ' HG2' HG13 ' A' ' 27' ' ' VAL . 10.0 mtm105 -144.86 143.27 30.52 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.528 -1.215 . . . . 0.0 108.668 -156.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 46.5 t -112.05 131.92 55.13 Favored 'General case' 0 CA--C 1.527 0.091 0 C-N-CA 124.072 0.949 . . . . 0.0 109.014 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -127.43 37.35 4.25 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.286 1.434 . . . . 0.0 109.942 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -56.33 154.99 7.41 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.242 1.017 . . . . 0.0 111.628 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.7 mm -115.25 111.72 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 171.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.3 p -130.5 163.53 26.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.933 1.293 . . . . 0.0 108.135 173.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -70.02 -21.27 63.22 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.895 -0.503 . . . . 0.0 111.54 174.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -130.55 -179.29 5.19 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.898 1.279 . . . . 0.0 111.911 -165.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.8 t -112.78 147.88 35.97 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.642 1.977 . . . . 0.0 109.992 177.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -97.58 159.37 31.23 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 125.914 1.686 . . . . 0.0 109.566 176.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.2 164.5 22.47 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.284 2.656 . . . . 0.0 112.266 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -63.22 141.61 58.7 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 124.469 1.107 . . . . 0.0 112.178 -174.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -93.04 -177.03 4.36 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.55 1.14 . . . . 0.0 111.81 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 C--O 1.251 1.142 0 C-N-CA 125.28 1.432 . . . . 0.0 107.863 166.099 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 45.8 p . . . . . 0 N--CA 1.474 0.728 0 N-CA-C 111.283 0.105 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -80.01 168.43 19.2 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.258 0.623 . . . . 0.0 109.667 169.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.8 t -66.62 111.48 3.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.397 0.679 . . . . 0.0 109.957 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.8 t -154.67 146.72 23.63 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.241 1.017 . . . . 0.0 108.934 176.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 11.1 t -155.06 44.68 0.49 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.596 0.759 . . . . 0.0 109.816 -179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 38.8 p -61.87 159.91 13.06 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.157 0.983 . . . . 0.0 110.904 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.37 95.89 0.33 Allowed 'General case' 0 C--N 1.341 0.225 0 C-N-CA 122.793 0.437 . . . . 0.0 111.371 -174.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.4 p -127.46 -175.77 3.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.436 1.494 . . . . 0.0 109.785 -176.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 46.4 t -172.0 160.55 5.4 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.642 1.977 . . . . 0.0 107.329 171.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -108.44 -77.01 0.6 Allowed 'General case' 0 CA--C 1.528 0.121 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 171.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -88.52 111.49 21.9 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.8 p -118.14 67.08 6.34 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 124.749 1.22 . . . . 0.0 111.377 -177.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.93 145.67 56.85 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.624 2.216 . . . . 0.0 110.453 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.1 m -132.46 159.06 40.43 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.049 0.94 . . . . 0.0 110.933 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.0 p -90.04 157.85 17.61 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.648 1.179 . . . . 0.0 108.932 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.5 mtm105 -108.47 35.92 3.01 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.914 0.886 . . . . 0.0 109.515 176.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 76.1 p -89.15 -176.67 5.2 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.902 1.281 . . . . 0.0 110.264 175.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.5 mm -129.71 113.08 17.72 Favored Pre-proline 0 CA--C 1.536 0.41 0 C-N-CA 124.75 1.22 . . . . 0.0 108.842 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.44 151.63 90.79 Favored 'Cis proline' 0 CA--C 1.538 0.679 0 N-CA-C 109.131 -1.142 . . . . 0.0 109.131 -9.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -75.25 132.54 15.21 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.209 2.606 . . . . 0.0 109.417 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.9 137.17 43.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 173.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 54.0 m -107.74 149.85 27.67 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.227 1.411 . . . . 0.0 108.744 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -135.71 172.19 13.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.134 1.374 . . . . 0.0 108.432 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 18.5 m -127.47 134.42 49.83 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 172.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 67.5 p -115.68 24.97 11.12 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.439 1.096 . . . . 0.0 109.953 174.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -70.82 150.38 45.89 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 123.514 0.726 . . . . 0.0 109.696 172.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 69.2 t -136.51 126.04 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 126.231 1.812 . . . . 0.0 106.244 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.06 -156.37 0.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 -165.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -78.67 -137.89 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.934 1.294 . . . . 0.0 108.438 175.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -63.38 161.82 13.47 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.12 0.873 . . . . 0.0 111.758 -176.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 m -76.11 152.26 36.81 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.368 1.467 . . . . 0.0 108.893 -175.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -76.83 165.82 24.18 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.6 t -49.41 -40.17 35.35 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 126.083 1.753 . . . . 0.0 111.851 -179.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.29 32.21 4.82 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 124.267 1.027 . . . . 0.0 111.742 -177.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 20.4 t -99.69 126.46 45.73 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.637 0.775 . . . . 0.0 109.196 176.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.9 tttm -106.55 -45.36 4.26 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.017 0.927 . . . . 0.0 110.75 -174.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 t -105.28 126.06 51.67 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 172.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.2 t -147.78 142.1 26.27 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 124.531 1.133 . . . . 0.0 108.172 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.3 tp -148.2 151.77 36.08 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 8.0 m -126.27 166.18 17.59 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.917 0.887 . . . . 0.0 110.837 -172.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.7 p -83.47 153.52 24.41 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.287 0.635 . . . . 0.0 109.59 171.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -87.55 15.14 7.05 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.675 0.79 . . . . 0.0 111.859 172.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 80.0 p -76.97 -176.45 3.96 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.337 1.055 . . . . 0.0 111.6 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -134.93 114.67 11.92 Favored Pre-proline 0 N--CA 1.451 -0.411 0 C-N-CA 125.007 1.323 . . . . 0.0 108.86 174.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.06 142.46 72.94 Favored 'Cis proline' 0 N--CA 1.457 -0.659 0 CA-C-N 119.655 0.912 . . . . 0.0 110.033 -1.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.26 125.56 11.48 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.925 2.417 . . . . 0.0 109.097 177.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 30.8 mm100 -106.28 129.85 54.23 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 62.4 m -106.21 149.38 26.9 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.827 0.851 . . . . 0.0 109.325 -175.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.2 mtm105 -142.56 120.79 12.25 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 -160.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 48.4 t -83.8 124.96 31.47 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -178.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -117.97 26.57 9.57 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.266 1.426 . . . . 0.0 111.386 -179.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -57.71 147.2 28.51 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.572 0.749 . . . . 0.0 110.164 -178.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.3 mm -102.32 130.91 51.45 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 106.198 -1.779 . . . . 0.0 106.198 178.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 35.5 p -139.81 -171.56 3.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.99 1.316 . . . . 0.0 108.15 -170.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -128.66 15.53 6.47 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.493 1.117 . . . . 0.0 109.922 172.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -159.02 176.91 11.71 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.031 1.333 . . . . 0.0 110.394 -165.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.0 t -123.42 144.81 49.25 Favored 'General case' 0 CA--C 1.528 0.116 0 C-N-CA 125.269 1.427 . . . . 0.0 109.63 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -92.51 157.41 40.21 Favored Pre-proline 0 N--CA 1.451 -0.389 0 C-N-CA 125.444 1.498 . . . . 0.0 109.367 175.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -64.37 162.73 29.3 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.967 2.445 . . . . 0.0 110.789 174.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.08 138.64 58.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 123.825 0.85 . . . . 0.0 112.128 -172.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -81.41 174.97 10.96 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.624 0.77 . . . . 0.0 111.359 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 52.6 m . . . . . 0 C--O 1.25 1.104 0 C-N-CA 125.826 1.65 . . . . 0.0 109.327 173.465 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.6 tptm -75.6 85.8 2.67 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 168.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.7 m -151.6 173.69 14.35 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.326 1.05 . . . . 0.0 109.47 -172.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.2 t -59.6 135.92 57.82 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.1 0.56 . . . . 0.0 110.843 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.2 t -120.99 74.67 1.1 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.276 1.43 . . . . 0.0 108.823 -177.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 64.8 p -65.0 171.03 3.82 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.406 1.083 . . . . 0.0 111.488 178.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.68 101.66 0.09 Allowed 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 124.075 0.95 . . . . 0.0 110.724 174.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.1 p -119.89 -179.2 3.84 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 122.099 0.952 . . . . 0.0 111.023 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.5 t -176.4 175.29 1.81 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 128.17 2.588 . . . . 0.0 105.516 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -142.84 -62.99 0.42 Allowed 'General case' 0 CA--C 1.527 0.083 0 CA-C-N 119.446 1.021 . . . . 0.0 108.833 164.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -90.86 104.78 17.33 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.3 p -118.04 75.01 10.61 Favored Pre-proline 0 CA--C 1.532 0.271 0 C-N-CA 124.852 1.261 . . . . 0.0 111.694 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.42 156.58 65.56 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.707 2.272 . . . . 0.0 110.662 170.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.5 m -142.67 166.2 25.3 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.059 0.944 . . . . 0.0 111.164 -172.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.9 p -82.74 162.0 21.89 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.163 0.985 . . . . 0.0 109.243 166.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -108.24 36.86 2.65 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.884 0.874 . . . . 0.0 109.59 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.7 p -85.15 -177.15 6.45 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.416 1.086 . . . . 0.0 111.018 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.3 tp -123.57 96.65 43.21 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 125.828 1.651 . . . . 0.0 109.474 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.02 163.47 89.38 Favored 'Cis proline' 0 CA--C 1.535 0.558 0 CA-C-N 119.747 0.945 . . . . 0.0 110.549 -3.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -76.89 149.17 28.96 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 123.371 2.714 . . . . 0.0 110.165 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -125.14 133.77 52.69 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.283 1.433 . . . . 0.0 108.413 175.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 77.7 m -109.89 152.73 25.43 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.308 1.443 . . . . 0.0 110.278 176.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -139.42 152.61 47.21 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 124.136 0.975 . . . . 0.0 108.894 172.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 23.4 m -103.45 118.0 35.74 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 125.03 1.332 . . . . 0.0 107.664 -176.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 50.5 p -107.89 15.95 23.97 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.46 1.104 . . . . 0.0 111.829 -164.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -65.31 152.59 43.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.022 0.439 . . . . 0.0 109.919 167.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.5 t -132.73 119.09 36.63 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.114 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 -176.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.1 mmm-85 -158.79 -162.93 1.16 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.597 1.159 . . . . 0.0 108.857 -162.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -71.99 -144.92 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.041 0.936 . . . . 0.0 109.082 170.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -61.85 154.62 25.49 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 121.299 -0.876 . . . . 0.0 110.755 -174.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 96.4 m -78.22 168.8 19.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 123.982 0.913 . . . . 0.0 110.621 -174.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.0 p80 -86.27 171.75 11.0 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.679 0.752 . . . . 0.0 112.818 -175.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.6 t -57.55 -34.42 69.15 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.52 1.528 . . . . 0.0 112.697 -176.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -105.96 44.59 1.03 Allowed 'General case' 0 C--N 1.338 0.096 0 C-N-CA 124.068 0.947 . . . . 0.0 109.723 -175.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 15.9 t -147.57 114.89 6.26 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -104.6 -36.63 7.42 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.756 1.223 . . . . 0.0 110.549 -162.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.9 t -102.66 108.89 20.31 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 171.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 44.3 t -118.27 129.19 55.32 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.647 1.979 . . . . 0.0 106.833 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -135.02 147.97 49.81 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 125.074 1.349 . . . . 0.0 108.056 -171.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 m -135.44 157.53 46.66 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.371 0.668 . . . . 0.0 110.832 -173.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -84.74 154.37 22.46 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.173 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -90.31 10.74 23.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.693 1.197 . . . . 0.0 111.971 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -70.78 -179.35 2.17 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.681 1.192 . . . . 0.0 111.058 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -120.55 115.17 32.57 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.463 1.105 . . . . 0.0 108.22 171.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -71.97 151.64 96.02 Favored 'Cis proline' 0 N--CA 1.456 -0.681 0 CA-C-N 119.627 0.902 . . . . 0.0 110.04 -2.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -72.25 137.29 28.3 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.458 2.105 . . . . 0.0 107.923 167.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -149.83 145.43 26.57 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -171.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 72.5 m -111.46 162.76 14.75 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.627 0.771 . . . . 0.0 112.658 -161.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 ttp85 -152.44 154.7 36.06 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 127.199 2.2 . . . . 0.0 108.292 -167.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 8.8 m -89.05 125.73 35.13 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.026 0.93 . . . . 0.0 110.23 173.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -105.91 20.33 19.11 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.885 1.274 . . . . 0.0 109.439 169.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -84.25 149.81 25.86 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.702 1.201 . . . . 0.0 109.755 -177.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.9 mm -108.74 135.51 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.202 0 C-N-CA 124.86 1.264 . . . . 0.0 108.488 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.9 p -139.37 151.21 46.15 Favored 'General case' 0 C--O 1.225 -0.189 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 165.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -64.37 -37.25 86.86 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.635 0.374 . . . . 0.0 110.737 170.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 24.0 p90 -102.43 -172.94 2.22 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.179 1.792 . . . . 0.0 111.142 -172.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 35.2 t -142.35 149.92 40.05 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.451 1.9 . . . . 0.0 108.763 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -91.65 155.9 43.4 Favored Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 124.914 1.285 . . . . 0.0 109.582 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -63.33 159.69 38.57 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.629 2.219 . . . . 0.0 110.578 175.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.1 m -62.31 143.77 56.52 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 121.252 0.549 . . . . 0.0 111.995 -171.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.7 t -88.04 169.65 11.77 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.956 1.303 . . . . 0.0 110.673 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.251 1.163 0 CA-C-O 117.4 -1.286 . . . . 0.0 108.014 168.592 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 65.7 p . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 120.73 0.3 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -159.9 152.29 20.95 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.761 1.224 . . . . 0.0 108.351 177.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 40.3 m -151.35 153.67 35.21 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.566 1.146 . . . . 0.0 108.822 173.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.1 t -162.74 165.29 25.72 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.346 1.058 . . . . 0.0 109.378 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 t -78.34 80.85 4.72 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.258 1.023 . . . . 0.0 109.433 173.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 46.3 p -58.79 151.35 21.51 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.736 1.214 . . . . 0.0 111.609 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.25 118.12 6.47 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.793 0.837 . . . . 0.0 110.284 177.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.0 p -135.49 162.99 31.1 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.264 1.026 . . . . 0.0 111.255 178.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.4 t -171.35 142.02 1.64 Allowed 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 125.939 1.696 . . . . 0.0 108.544 -174.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -103.61 -73.02 0.68 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.195 0.998 . . . . 0.0 108.567 -174.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -77.05 108.05 9.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 25.0 p -132.94 62.65 63.34 Favored Pre-proline 0 N--CA 1.452 -0.339 0 C-N-CA 124.488 1.115 . . . . 0.0 111.497 -173.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.72 159.38 52.98 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.708 2.272 . . . . 0.0 111.031 178.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 24.1 m -131.3 153.98 49.01 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.839 0.856 . . . . 0.0 110.004 177.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.1 p -82.15 164.12 21.49 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.139 1.375 . . . . 0.0 109.691 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -106.81 25.54 11.15 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.188 0.995 . . . . 0.0 110.744 -177.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.5 p -81.97 -179.68 7.49 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.715 1.206 . . . . 0.0 110.432 176.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -126.84 106.38 22.71 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 124.797 1.239 . . . . 0.0 108.188 179.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.26 159.31 96.06 Favored 'Cis proline' 0 N--CA 1.458 -0.602 0 CA-C-N 119.373 0.812 . . . . 0.0 110.094 -4.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.0 138.23 22.75 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.869 2.38 . . . . 0.0 109.368 173.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -106.52 135.19 48.47 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 173.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.8 m -107.1 143.54 35.09 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.283 1.033 . . . . 0.0 108.876 175.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -146.15 159.26 43.55 Favored 'General case' 0 N--CA 1.457 -0.095 0 C-N-CA 124.175 0.99 . . . . 0.0 108.964 -173.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.0 m -106.26 137.47 44.16 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.851 0.86 . . . . 0.0 109.614 -178.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.1 p -120.57 -12.91 8.84 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.429 1.092 . . . . 0.0 112.041 -174.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -65.36 150.38 48.39 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.481 0.582 . . . . 0.0 110.804 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.7 t -118.02 118.16 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 125.186 1.394 . . . . 0.0 107.907 -170.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -141.67 -166.76 2.28 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.781 1.633 . . . . 0.0 108.676 -171.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -77.26 -132.86 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 167.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -60.94 150.54 32.96 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.917 1.235 . . . . 0.0 111.31 -173.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.1 p -87.77 151.8 22.61 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 126.357 1.863 . . . . 0.0 109.831 -176.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.3 p80 -72.9 168.24 19.35 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -159.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.2 t -51.32 -38.09 51.16 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 126.232 1.813 . . . . 0.0 112.188 -178.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.54 31.3 4.77 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.295 1.038 . . . . 0.0 111.513 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 18.2 t -104.48 128.06 52.32 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.153 0.981 . . . . 0.0 108.806 175.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -107.73 -46.68 3.76 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.473 1.109 . . . . 0.0 110.704 -173.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 t -104.97 131.01 53.02 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 172.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 44.8 t -154.75 145.73 22.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.669 1.188 . . . . 0.0 108.434 -174.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 7.4 tt -148.77 150.22 32.71 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.7 m -127.75 159.17 35.61 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.4 1.08 . . . . 0.0 110.211 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 69.0 p -81.56 155.58 25.65 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.569 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.6 ptt85 -93.47 26.01 3.19 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.304 1.441 . . . . 0.0 110.09 170.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.4 m -87.74 178.81 6.63 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.243 1.417 . . . . 0.0 110.66 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -129.19 105.08 17.93 Favored Pre-proline 0 N--CA 1.441 -0.895 0 C-N-CA 126.751 2.021 . . . . 0.0 108.122 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -72.55 155.4 99.01 Favored 'Cis proline' 0 CA--C 1.537 0.653 0 CA-C-N 119.802 0.965 . . . . 0.0 111.054 -1.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -75.84 130.43 12.44 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.604 2.869 . . . . 0.0 109.459 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 31.3 mm100 -121.66 136.64 54.94 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.019 1.328 . . . . 0.0 109.038 -176.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 66.6 m -108.79 156.46 19.6 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 124.42 1.088 . . . . 0.0 111.556 -172.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -152.85 143.64 22.86 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 124.327 1.051 . . . . 0.0 109.768 -179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 33.0 t -92.53 121.15 33.69 Favored 'General case' 0 C--N 1.333 -0.142 0 C-N-CA 124.928 1.291 . . . . 0.0 109.363 -177.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.07 20.84 18.45 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.874 1.269 . . . . 0.0 111.14 -174.01 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -62.7 150.33 41.39 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.658 0.783 . . . . 0.0 110.964 -175.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.1 mm -105.77 126.41 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 N-CA-C 106.989 -1.485 . . . . 0.0 106.989 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 70.4 p -136.34 -169.37 2.43 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.01 1.324 . . . . 0.0 108.714 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -128.83 9.03 5.8 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.392 1.477 . . . . 0.0 110.983 173.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -148.9 -176.11 5.21 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 126.008 1.723 . . . . 0.0 109.811 -169.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.4 t -132.11 144.4 50.69 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.714 1.206 . . . . 0.0 109.207 174.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -88.58 160.27 44.98 Favored Pre-proline 0 CA--C 1.534 0.348 0 C-N-CA 125.14 1.376 . . . . 0.0 109.089 174.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -61.23 162.52 19.74 Favored 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 122.185 1.924 . . . . 0.0 111.198 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.61 138.79 33.7 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.929 1.291 . . . . 0.0 112.076 -177.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.31 175.63 5.99 Favored 'General case' 0 C--O 1.23 0.071 0 C-N-CA 124.406 1.082 . . . . 0.0 110.347 178.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.7 t . . . . . 0 C--O 1.251 1.165 0 C-N-CA 125.247 1.419 . . . . 0.0 108.763 -178.328 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -77.5 -170.32 1.75 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.826 1.25 . . . . 0.0 109.875 172.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.2 m -55.46 155.64 5.19 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.718 1.207 . . . . 0.0 112.391 -177.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.2 t -65.8 163.5 16.62 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.916 0.886 . . . . 0.0 111.991 -174.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.6 t -77.32 85.09 3.75 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.265 1.026 . . . . 0.0 108.896 172.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 71.2 p -59.85 173.7 0.56 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.783 1.233 . . . . 0.0 110.935 172.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -48.39 109.15 0.21 Allowed 'General case' 0 C--N 1.339 0.149 0 C-N-CA 124.313 1.045 . . . . 0.0 110.987 178.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.6 p -129.73 -176.17 3.83 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 124.844 1.258 . . . . 0.0 109.329 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 49.6 t -171.98 158.22 4.65 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 126.16 1.784 . . . . 0.0 107.447 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -105.67 -60.91 1.56 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -179.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -114.8 115.31 26.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.799 1.239 . . . . 0.0 108.54 -177.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 11.0 p -131.81 78.88 69.29 Favored Pre-proline 0 N--CA 1.453 -0.322 0 C-N-CA 125.037 1.335 . . . . 0.0 112.063 -173.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -71.09 161.89 44.47 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 122.628 2.219 . . . . 0.0 110.919 173.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.0 m -133.03 156.99 46.34 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.382 1.073 . . . . 0.0 109.462 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.1 p -84.5 164.96 18.48 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.098 1.359 . . . . 0.0 110.31 -177.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.7 ptt-85 -108.52 5.49 25.22 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.881 1.272 . . . . 0.0 112.463 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.3 p -73.19 175.99 6.29 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.047 1.339 . . . . 0.0 110.857 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 tp -124.74 115.38 26.65 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 125.001 1.32 . . . . 0.0 108.943 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -70.48 152.23 93.97 Favored 'Cis proline' 0 N--CA 1.458 -0.589 0 CA-C-N 119.798 0.964 . . . . 0.0 109.869 -6.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -79.48 136.77 12.64 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.018 2.478 . . . . 0.0 109.779 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -108.43 149.93 28.08 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.454 1.501 . . . . 0.0 109.715 170.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 96.6 m -112.47 148.69 33.88 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.515 1.526 . . . . 0.0 109.287 170.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -156.1 169.68 23.94 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.63 1.172 . . . . 0.0 108.981 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 92.3 m -106.87 141.64 37.78 Favored 'General case' 0 CA--C 1.521 -0.173 0 C-N-CA 123.135 0.574 . . . . 0.0 110.916 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.2 t -108.52 -26.17 10.56 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.97 1.308 . . . . 0.0 110.668 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -58.67 142.36 49.88 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-O 121.561 0.696 . . . . 0.0 111.198 -177.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.6 t -113.25 133.96 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 C-N-CA 125.8 1.64 . . . . 0.0 107.471 -172.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.7 tpp180 -160.84 -150.47 0.21 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -174.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -80.05 -150.48 0.06 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.668 0.787 . . . . 0.0 108.93 173.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -60.17 158.12 11.98 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.476 0.655 . . . . 0.0 110.912 -177.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 65.1 m -80.45 163.12 24.04 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.127 -170.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -80.04 172.67 13.47 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.513 0.673 . . . . 0.0 112.242 -174.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.2 t -55.12 -28.93 56.24 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.466 1.507 . . . . 0.0 113.003 -176.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.86 48.59 0.84 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.441 1.096 . . . . 0.0 110.161 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 84.5 m -128.92 133.69 47.97 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 164.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -103.96 -42.19 5.64 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.167 1.387 . . . . 0.0 108.925 -177.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.9 t -105.95 130.04 53.97 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 171.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.8 t -138.91 132.92 31.17 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 125.707 1.603 . . . . 0.0 107.023 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -138.23 148.36 44.69 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 124.205 1.002 . . . . 0.0 109.06 -170.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.0 m -136.41 158.86 43.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.716 0.806 . . . . 0.0 110.318 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.2 t -87.36 155.38 20.06 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 123.516 0.51 . . . . 0.0 110.118 175.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -90.15 8.89 30.61 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.879 1.271 . . . . 0.0 111.578 174.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.6 m -65.55 177.19 1.24 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.244 1.018 . . . . 0.0 110.934 174.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -122.93 113.4 30.02 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 174.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.55 147.37 89.01 Favored 'Cis proline' 0 CA--C 1.538 0.698 0 CA-C-N 119.788 0.96 . . . . 0.0 111.13 0.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.03 106.02 2.19 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.493 2.795 . . . . 0.0 108.772 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -107.9 147.98 30.24 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.051 0.94 . . . . 0.0 109.516 -173.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 91.8 m -116.62 159.68 21.81 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.322 1.049 . . . . 0.0 112.043 -166.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.7 ttp-105 -155.56 149.4 25.37 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 125.05 1.34 . . . . 0.0 109.722 -174.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 44.6 t -82.66 136.59 34.73 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.906 1.282 . . . . 0.0 109.882 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -122.36 18.0 10.59 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.171 1.389 . . . . 0.0 110.917 -178.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -79.25 149.1 31.96 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.036 0.934 . . . . 0.0 110.114 179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 52.1 mm -108.73 133.73 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 C-N-CA 124.693 1.197 . . . . 0.0 108.763 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 67.4 p -138.9 -169.87 2.73 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.065 1.346 . . . . 0.0 108.233 175.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -117.66 5.71 12.37 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.05 1.34 . . . . 0.0 111.393 171.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -142.33 -178.0 5.53 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.233 1.413 . . . . 0.0 110.39 -171.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 41.5 t -140.54 145.5 36.87 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.546 1.138 . . . . 0.0 109.223 174.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -79.67 157.6 74.31 Favored Pre-proline 0 N--CA 1.451 -0.382 0 C-N-CA 125.097 1.359 . . . . 0.0 109.793 176.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -60.85 154.35 56.55 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.651 2.234 . . . . 0.0 110.823 177.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.2 138.04 57.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.594 0.758 . . . . 0.0 112.49 -168.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.26 -176.66 5.74 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.035 176.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.7 p . . . . . 0 C--O 1.251 1.15 0 CA-C-O 117.197 -1.382 . . . . 0.0 109.915 167.475 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 48.8 p . . . . . 0 N--CA 1.473 0.702 0 CA-C-O 119.48 -0.295 . . . . 0.0 110.701 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -138.98 144.94 39.17 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 124.252 1.021 . . . . 0.0 109.148 175.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.7 m -159.8 163.07 34.83 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.36 1.464 . . . . 0.0 108.909 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 66.2 p -72.27 169.18 16.75 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.927 0.891 . . . . 0.0 110.642 175.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.1 t -77.5 68.31 3.57 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.536 1.135 . . . . 0.0 110.902 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 69.9 p -65.64 166.16 11.2 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.469 1.108 . . . . 0.0 110.568 175.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.46 86.24 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.705 0.802 . . . . 0.0 110.423 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.7 p -120.17 -168.12 1.57 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 125.765 1.626 . . . . 0.0 109.875 -176.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.8 t -163.05 -178.87 6.31 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.442 1.497 . . . . 0.0 107.296 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -140.34 -56.61 0.53 Allowed 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 164.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 14.4 m-30 -93.43 112.66 24.63 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 176.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.1 m -113.2 68.38 1.2 Allowed Pre-proline 0 CA--C 1.537 0.443 0 C-N-CA 125.723 1.609 . . . . 0.0 111.303 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -79.85 165.15 22.4 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 121.631 1.554 . . . . 0.0 109.854 171.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.6 t -156.69 163.58 39.13 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.957 -178.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 70.6 p -72.96 175.98 6.13 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.981 171.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -106.48 4.93 28.81 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.317 1.047 . . . . 0.0 111.569 170.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 55.8 p -81.2 179.69 7.74 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 124.7 1.2 . . . . 0.0 112.043 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.5 tp -132.68 107.25 12.94 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 126.337 1.855 . . . . 0.0 108.194 -174.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -70.05 158.75 91.57 Favored 'Cis proline' 0 N--CA 1.457 -0.67 0 CA-C-N 119.808 0.967 . . . . 0.0 111.783 -1.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -78.74 135.95 13.16 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 124.067 3.178 . . . . 0.0 110.315 178.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -106.35 101.82 11.26 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 176.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 38.7 m -108.13 143.25 37.15 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.301 1.04 . . . . 0.0 108.783 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -139.46 177.24 8.07 Favored 'General case' 0 C--N 1.339 0.136 0 O-C-N 123.686 0.616 . . . . 0.0 111.294 -171.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 53.3 m -106.71 131.67 53.58 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 163.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 53.5 p -120.92 -1.71 9.86 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -67.01 137.77 56.73 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 118.507 0.594 . . . . 0.0 110.342 174.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.7 t -112.54 120.78 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 -170.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.1 mmm-85 -150.53 -161.11 1.27 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.225 1.41 . . . . 0.0 108.293 -164.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -68.38 -153.6 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 165.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -56.77 150.74 15.53 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -170.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.6 p -64.02 145.7 55.42 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 113.92 -1.491 . . . . 0.0 110.954 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.1 p80 -71.92 176.04 5.34 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -164.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.5 t -75.05 26.42 0.09 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.857 1.263 . . . . 0.0 113.18 -175.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -157.03 62.79 0.5 Allowed 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.622 0.769 . . . . 0.0 109.693 171.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.2 m -127.07 130.93 50.87 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.935 0.894 . . . . 0.0 109.82 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -105.48 -45.33 4.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.494 1.518 . . . . 0.0 107.572 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.2 t -107.88 139.64 42.17 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 166.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 18.8 t -156.28 147.54 22.4 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.536 1.534 . . . . 0.0 107.914 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.4 tp -156.53 157.05 34.71 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 176.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.4 m -126.41 160.69 29.77 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.029 0.932 . . . . 0.0 109.807 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 60.3 p -77.18 155.14 32.47 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.509 0.723 . . . . 0.0 110.596 -175.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -91.25 10.65 26.34 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.918 0.887 . . . . 0.0 111.932 173.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 p -73.31 176.55 5.87 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.965 0.906 . . . . 0.0 111.071 176.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -128.16 112.23 19.94 Favored Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 124.645 1.178 . . . . 0.0 108.008 174.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.32 150.25 91.27 Favored 'Cis proline' 0 N--CA 1.456 -0.707 0 CA-C-N 119.517 0.863 . . . . 0.0 110.392 -1.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.06 154.6 47.44 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.31 2.673 . . . . 0.0 109.1 172.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -149.92 137.85 20.23 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.121 0.568 . . . . 0.0 109.487 -172.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.3 m -108.22 154.75 21.31 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 123.638 0.775 . . . . 0.0 112.542 -164.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? -152.24 148.16 27.24 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.399 1.08 . . . . 0.0 109.526 -176.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 36.2 t -99.71 118.94 37.29 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 125.95 1.7 . . . . 0.0 109.157 -176.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -107.49 26.41 10.27 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.945 0.898 . . . . 0.0 111.704 -171.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -62.11 138.82 58.45 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.526 0.73 . . . . 0.0 110.4 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 19.3 mm -105.4 111.62 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.3 p -138.05 161.15 37.49 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.775 0.83 . . . . 0.0 109.767 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -74.73 -20.7 59.72 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.21 0.604 . . . . 0.0 111.774 173.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 36.0 p90 -115.3 -172.54 2.16 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 125.936 1.694 . . . . 0.0 109.982 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.5 t -145.74 155.45 42.96 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.37 1.068 . . . . 0.0 109.066 171.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -82.64 157.22 67.47 Favored Pre-proline 0 N--CA 1.451 -0.391 0 C-N-CA 124.252 1.021 . . . . 0.0 109.642 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.38 176.23 8.27 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.064 2.509 . . . . 0.0 111.442 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.9 p -63.3 141.72 58.66 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.948 0.899 . . . . 0.0 112.123 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -82.39 -170.21 2.82 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.539 1.136 . . . . 0.0 111.238 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.6 t . . . . . 0 C--O 1.255 1.39 0 C-N-CA 125.05 1.34 . . . . 0.0 108.621 166.858 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 35.9 p . . . . . 0 N--CA 1.475 0.81 0 CA-C-O 120.754 0.311 . . . . 0.0 111.451 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -164.29 -57.1 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.837 0.855 . . . . 0.0 109.405 176.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 26.5 m -61.26 135.89 57.88 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.031 0.932 . . . . 0.0 110.366 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.1 m -52.64 121.41 7.08 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.798 1.239 . . . . 0.0 111.391 -176.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 42.6 p 1.52 79.06 0.0 OUTLIER 'General case' 0 C--N 1.345 0.402 0 C-N-CA 129.544 3.138 . . . . 0.0 114.559 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 65.1 p -69.22 159.01 33.84 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.058 0.543 . . . . 0.0 110.771 -176.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -72.23 93.28 1.45 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 174.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.0 p -143.15 169.32 17.82 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 122.1 0.952 . . . . 0.0 111.505 178.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.8 t -158.32 153.13 24.96 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 126.234 1.814 . . . . 0.0 107.113 -168.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -107.26 -70.79 0.78 Allowed 'General case' 0 C--N 1.339 0.109 0 C-N-CA 123.406 0.682 . . . . 0.0 109.751 -170.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -89.89 111.68 22.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 173.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 4.8 t -126.68 69.1 70.47 Favored Pre-proline 0 CA--C 1.533 0.302 0 O-C-N 123.853 0.721 . . . . 0.0 112.461 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.1 158.99 55.69 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.8 2.333 . . . . 0.0 110.924 174.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.1 m -136.75 158.09 45.26 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.972 0.909 . . . . 0.0 110.926 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.3 p -79.2 163.83 24.69 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.618 0.767 . . . . 0.0 109.082 172.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 68.9 mtp85 -113.36 33.39 5.14 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.827 0.851 . . . . 0.0 109.862 172.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.3 p -78.71 176.91 9.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.507 1.123 . . . . 0.0 109.687 168.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.6 mm -127.76 111.72 20.56 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.577 1.151 . . . . 0.0 108.203 176.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.1 157.67 89.93 Favored 'Cis proline' 0 CA--C 1.537 0.668 0 CA-C-N 119.206 0.752 . . . . 0.0 110.218 -5.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -82.46 146.87 13.91 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.866 3.044 . . . . 0.0 110.734 175.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -120.64 130.14 54.02 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 125.673 1.589 . . . . 0.0 108.106 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 80.1 m -106.93 144.39 33.64 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.979 1.311 . . . . 0.0 109.164 174.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -140.74 160.34 40.26 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.103 1.361 . . . . 0.0 109.652 -176.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.6 m -107.29 125.96 51.82 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 124.271 1.028 . . . . 0.0 109.535 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 41.1 p -108.95 -17.8 13.83 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.475 1.11 . . . . 0.0 112.157 -172.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -62.34 142.84 57.59 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.127 0.571 . . . . 0.0 111.191 176.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.8 t -114.16 137.32 47.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 125.342 1.457 . . . . 0.0 107.838 -175.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.9 ttm105 -160.07 -153.63 0.35 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 -174.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -76.72 -153.83 0.05 Allowed 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.834 0.854 . . . . 0.0 108.887 167.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 158.44 7.75 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.368 0.667 . . . . 0.0 112.017 -171.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.2 m -72.51 164.83 25.78 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 123.997 0.919 . . . . 0.0 111.424 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 22.7 p80 -78.07 168.76 19.37 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.79 0.805 . . . . 0.0 112.689 -171.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.7 t -58.62 -23.14 58.34 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 114.055 -1.43 . . . . 0.0 113.401 -172.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -119.74 29.57 7.5 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.373 1.069 . . . . 0.0 112.11 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.9 t -88.16 139.16 30.79 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 172.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -104.31 -51.9 3.02 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.649 1.18 . . . . 0.0 109.92 -175.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.3 t -107.22 119.67 40.03 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 173.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 48.8 t -126.81 138.92 53.42 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 125.441 1.497 . . . . 0.0 108.107 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.6 tp -144.29 153.31 41.89 Favored 'General case' 0 N--CA 1.461 0.123 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.7 m -130.41 156.28 45.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.053 0.941 . . . . 0.0 109.666 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -90.31 152.55 20.98 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 123.446 0.467 . . . . 0.0 110.002 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -88.54 15.3 8.21 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.222 1.009 . . . . 0.0 111.887 174.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 m -67.24 172.87 4.3 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.883 0.873 . . . . 0.0 110.545 173.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -125.93 113.14 24.44 Favored Pre-proline 0 CA--C 1.532 0.264 0 C-N-CA 124.018 0.927 . . . . 0.0 109.075 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.03 154.02 93.86 Favored 'Cis proline' 0 CA--C 1.54 0.783 0 CA-C-N 119.56 0.879 . . . . 0.0 110.92 -2.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -84.43 126.38 3.6 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.221 3.281 . . . . 0.0 109.987 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -113.83 158.44 21.02 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.555 1.142 . . . . 0.0 109.237 174.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 98.6 m -113.64 159.53 19.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.871 1.269 . . . . 0.0 110.52 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -156.19 144.8 20.12 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.699 1.2 . . . . 0.0 108.786 -174.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 53.1 t -91.64 122.36 34.14 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.655 -175.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -103.68 5.15 36.14 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.459 1.504 . . . . 0.0 111.286 -174.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -59.93 127.91 34.26 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.669 0.788 . . . . 0.0 109.787 177.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 35.8 mm -106.72 129.68 59.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 p -142.99 153.83 43.39 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 123.163 0.585 . . . . 0.0 109.648 178.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -62.83 -39.77 95.37 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.154 0.581 . . . . 0.0 110.67 172.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -88.89 -176.65 5.27 Favored 'General case' 0 N--CA 1.458 -0.071 0 C-N-CA 124.36 1.064 . . . . 0.0 110.045 173.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 10.6 t -151.78 153.16 33.73 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.464 0.706 . . . . 0.0 110.112 165.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -73.95 153.32 88.88 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 124.58 1.152 . . . . 0.0 109.464 175.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -72.75 179.9 4.82 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.097 2.531 . . . . 0.0 111.291 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.96 136.63 51.75 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.613 1.165 . . . . 0.0 112.132 -176.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -87.03 171.83 10.44 Favored 'General case' 0 N--CA 1.457 -0.097 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.78 177.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 C--O 1.249 1.057 0 C-N-CA 129.996 3.319 . . . . 0.0 107.677 -174.44 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 47.6 p . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 110.807 -0.072 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -73.51 96.74 2.46 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.701 0.801 . . . . 0.0 110.325 -176.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 71.6 p -114.2 75.48 0.93 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.812 1.245 . . . . 0.0 109.736 -176.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.2 t -155.82 169.78 23.61 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.255 1.022 . . . . 0.0 109.437 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 76.9 p -1.14 84.64 0.0 OUTLIER 'General case' 0 C--N 1.347 0.468 0 C-N-CA 129.403 3.081 . . . . 0.0 113.72 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.2 p -78.99 148.76 32.45 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.527 0.731 . . . . 0.0 110.699 -173.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.08 135.99 56.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.453 0.701 . . . . 0.0 109.67 171.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.6 p -156.7 166.1 34.36 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.897 0.856 . . . . 0.0 111.932 170.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 t -168.08 156.48 8.9 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.496 1.918 . . . . 0.0 108.122 -176.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -104.22 -68.2 0.86 Allowed 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -84.63 99.23 10.65 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.7 t -117.14 77.49 9.38 Favored Pre-proline 0 CA--C 1.531 0.227 0 C-N-CA 124.233 1.013 . . . . 0.0 111.292 178.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -74.44 159.64 42.88 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.02 1.813 . . . . 0.0 110.242 170.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.5 m -134.39 156.85 47.79 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.669 1.188 . . . . 0.0 108.638 173.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.4 p -77.84 170.13 17.11 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.501 0.721 . . . . 0.0 109.984 178.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -108.28 10.09 27.8 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.813 1.245 . . . . 0.0 112.309 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.4 p -73.17 179.78 3.7 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.559 1.544 . . . . 0.0 111.868 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 tp -128.4 101.42 21.61 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 125.858 1.663 . . . . 0.0 108.966 -176.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -75.12 155.31 99.83 Favored 'Cis proline' 0 CA--C 1.536 0.61 0 CA-C-N 119.788 0.96 . . . . 0.0 110.492 -2.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -81.64 140.5 11.81 Favored 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 123.245 2.63 . . . . 0.0 109.712 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.46 141.13 40.79 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.27 1.428 . . . . 0.0 108.004 174.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 93.0 m -107.54 144.69 34.18 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.879 1.272 . . . . 0.0 109.333 176.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -144.27 -179.84 6.78 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.641 1.576 . . . . 0.0 108.576 -173.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 8.2 m -135.05 146.58 49.1 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 120.97 0.414 . . . . 0.0 111.352 175.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 80.7 p -121.64 17.51 11.18 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.271 1.428 . . . . 0.0 110.518 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -75.13 150.9 38.64 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.987 0.915 . . . . 0.0 108.98 174.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.406 HG13 ' HG2' ' A' ' 49' ' ' ARG . 59.8 t -141.46 112.35 3.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 C-N-CA 125.029 1.332 . . . . 0.0 108.536 -170.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.1 mtp-105 -144.07 -153.3 0.46 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.833 0.853 . . . . 0.0 108.8 -171.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -76.2 -131.03 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 169.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -63.7 162.82 12.53 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 119.46 1.027 . . . . 0.0 112.098 -174.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.7 m -88.11 151.01 23.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 125.374 1.469 . . . . 0.0 109.347 -172.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.0 p80 -84.03 174.72 10.06 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 121.934 0.873 . . . . 0.0 113.131 -172.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.7 t -59.11 -34.99 72.66 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.568 1.547 . . . . 0.0 112.873 -173.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.59 46.23 0.98 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.122 0.969 . . . . 0.0 110.164 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 11.2 t -144.13 103.3 3.99 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 175.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -102.77 -35.2 8.73 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 125.801 1.64 . . . . 0.0 109.255 -166.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.0 t -102.81 125.33 49.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 170.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 11.0 t -154.87 144.29 21.27 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.57 1.148 . . . . 0.0 107.953 -172.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.5 tp -146.95 141.39 26.43 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -176.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.1 m -113.0 153.94 27.26 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 124.215 1.006 . . . . 0.0 110.488 -174.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.7 t -89.75 154.76 19.67 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.364 -175.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -90.13 16.33 8.65 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.76 1.224 . . . . 0.0 111.572 174.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 m -75.44 178.47 5.89 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.209 1.004 . . . . 0.0 110.547 174.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -126.88 115.65 22.26 Favored Pre-proline 0 CA--C 1.535 0.388 0 C-N-CA 124.441 1.096 . . . . 0.0 108.47 174.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.0 146.57 87.04 Favored 'Cis proline' 0 N--CA 1.456 -0.708 0 CA-C-N 119.772 0.954 . . . . 0.0 110.509 0.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -76.73 121.53 5.96 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 123.05 2.5 . . . . 0.0 109.485 176.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -120.78 156.89 30.91 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 125.265 1.426 . . . . 0.0 109.401 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.9 m -108.08 142.48 38.2 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 123.508 0.723 . . . . 0.0 110.608 -176.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.406 ' HG2' HG13 ' A' ' 27' ' ' VAL . 16.4 mtm-85 -126.71 131.63 51.32 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 126.782 2.033 . . . . 0.0 106.783 -167.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 5.8 m -76.36 136.1 39.52 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.171 0.441 . . . . 0.0 110.023 179.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -118.34 15.46 13.91 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.64 1.576 . . . . 0.0 109.866 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -82.01 152.25 26.76 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.529 1.132 . . . . 0.0 111.299 -169.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 45.6 mm -116.5 132.65 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 124.963 1.305 . . . . 0.0 108.202 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.9 p -134.95 177.89 7.45 Favored 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 159.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -78.64 -20.56 50.04 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.974 -0.454 . . . . 0.0 111.145 172.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -123.47 174.36 7.43 Favored 'General case' 0 C--N 1.34 0.164 0 C-N-CA 126.045 1.738 . . . . 0.0 111.721 -169.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 7.6 m -107.55 157.13 18.29 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.314 1.446 . . . . 0.0 110.33 176.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -100.27 156.9 34.73 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 126.67 1.988 . . . . 0.0 108.086 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -69.19 174.33 9.16 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.04 2.493 . . . . 0.0 112.073 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.7 p -63.11 145.14 56.11 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.92 0.888 . . . . 0.0 112.105 -177.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -113.23 -179.05 3.53 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 125.115 1.366 . . . . 0.0 111.903 -173.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.251 1.178 0 C-N-CA 125.347 1.459 . . . . 0.0 110.302 179.166 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.474 0.753 0 CA-C-O 119.845 -0.121 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -167.27 117.59 0.86 Allowed 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.424 1.09 . . . . 0.0 108.123 177.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.5 m -149.77 124.82 10.01 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 12.9 t -164.19 179.85 6.6 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.319 1.048 . . . . 0.0 109.232 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.0 t -150.25 67.41 0.97 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.843 1.257 . . . . 0.0 108.539 177.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.1 p -71.43 -179.45 2.5 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.653 1.181 . . . . 0.0 111.526 -178.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -52.33 118.95 3.91 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.95 0.9 . . . . 0.0 110.488 172.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.9 p -146.25 -179.97 7.1 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.582 1.153 . . . . 0.0 109.705 -174.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 44.5 t -170.68 156.97 5.48 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.176 1.79 . . . . 0.0 107.2 174.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -105.57 -64.63 1.12 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.379 0.671 . . . . 0.0 109.552 -176.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -101.46 112.1 24.53 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 172.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 9.1 t -130.29 75.75 78.75 Favored Pre-proline 0 CA--C 1.531 0.227 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -177.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.84 158.29 53.28 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 122.605 2.203 . . . . 0.0 111.149 174.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.6 m -136.97 156.95 47.79 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.27 1.028 . . . . 0.0 110.61 -178.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 74.7 p -82.54 159.45 22.81 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 168.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.8 mtm180 -106.65 31.21 5.41 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.506 0.722 . . . . 0.0 109.929 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.8 p -75.21 176.96 6.85 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.034 1.334 . . . . 0.0 110.167 173.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 34.4 mm -125.4 106.41 27.42 Favored Pre-proline 0 CA--C 1.533 0.292 0 C-N-CA 124.525 1.13 . . . . 0.0 108.384 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -72.8 161.38 93.55 Favored 'Cis proline' 0 CA--C 1.539 0.742 0 N-CA-C 109.856 -0.863 . . . . 0.0 109.856 -5.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -74.93 151.6 40.11 Favored 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 123.393 2.729 . . . . 0.0 110.418 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -122.32 119.26 30.58 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.941 1.296 . . . . 0.0 108.171 176.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 75.5 m -106.93 141.52 38.02 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.055 1.342 . . . . 0.0 109.492 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.19 162.41 36.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.919 1.288 . . . . 0.0 110.579 -178.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.3 m -104.29 131.28 51.79 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.977 1.311 . . . . 0.0 109.385 -176.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 47.4 p -107.55 -26.36 10.94 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 124.293 1.037 . . . . 0.0 111.124 -178.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -61.67 144.01 55.22 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.076 0.465 . . . . 0.0 109.82 176.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.5 t -118.73 142.34 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -158.23 -150.84 0.27 Allowed 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -170.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -74.75 -149.57 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 162.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -64.14 160.19 18.85 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.951 0.881 . . . . 0.0 112.267 -170.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 7.4 p -67.22 162.12 23.32 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.193 1.797 . . . . 0.0 111.626 176.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -82.0 173.11 12.51 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.032 0.933 . . . . 0.0 113.123 -172.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.8 t -57.75 -33.09 68.11 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.551 1.541 . . . . 0.0 112.943 -173.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.57 42.8 1.27 Allowed 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 124.064 0.946 . . . . 0.0 110.574 -177.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.6 t -117.59 128.95 55.45 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.03 0.932 . . . . 0.0 108.936 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.0 tttp -104.78 -47.31 4.08 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 124.064 0.945 . . . . 0.0 110.113 -171.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.0 p -103.61 125.85 50.38 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 125.639 1.576 . . . . 0.0 106.993 172.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 38.5 t -148.95 140.22 23.19 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.474 1.11 . . . . 0.0 108.244 -166.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.88 156.82 46.03 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 124.178 0.991 . . . . 0.0 109.673 -167.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 34.1 m -138.59 161.69 36.45 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.069 0.948 . . . . 0.0 109.815 174.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 44.9 p -87.28 150.78 23.65 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.046 0.938 . . . . 0.0 110.082 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -85.55 10.36 13.34 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.784 0.833 . . . . 0.0 112.411 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.0 p -71.28 176.41 4.59 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.859 1.264 . . . . 0.0 111.145 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -129.68 114.72 18.0 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.625 171.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.09 145.43 82.28 Favored 'Cis proline' 0 CA--C 1.54 0.806 0 CA-C-N 119.596 0.891 . . . . 0.0 110.743 -0.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.33 125.18 8.94 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.372 2.714 . . . . 0.0 109.43 177.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -109.36 143.0 39.49 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 124.635 1.174 . . . . 0.0 109.269 -178.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 64.1 m -113.5 160.81 18.09 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.043 0.937 . . . . 0.0 111.754 -169.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -159.5 163.68 35.05 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.75 1.22 . . . . 0.0 110.142 -170.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 52.8 t -99.28 142.6 30.56 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.746 1.218 . . . . 0.0 109.441 175.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -111.91 -12.17 13.8 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.441 1.097 . . . . 0.0 111.635 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -60.31 142.72 54.34 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.335 1.054 . . . . 0.0 112.708 -174.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.0 mm -105.96 133.27 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 125.748 1.619 . . . . 0.0 107.597 -172.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.8 p -131.88 158.23 41.9 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.088 0.47 . . . . 0.0 111.137 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -74.42 -44.08 53.46 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.023 1.329 . . . . 0.0 110.627 172.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 3.9 p90 -93.06 -167.95 1.83 Allowed 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 124.96 1.304 . . . . 0.0 108.294 170.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 7.8 t -147.61 154.96 41.31 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 157.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -72.27 153.4 92.28 Favored Pre-proline 0 N--CA 1.451 -0.424 0 C-N-CA 124.693 1.197 . . . . 0.0 109.817 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -72.7 174.83 11.14 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.277 2.652 . . . . 0.0 111.472 -176.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.38 132.06 43.38 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.491 1.116 . . . . 0.0 111.88 -176.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.6 t -86.35 169.09 13.26 Favored 'General case' 0 N--CA 1.457 -0.092 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.02 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.25 1.093 0 CA-C-O 117.349 -1.31 . . . . 0.0 108.38 168.043 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 43.6 p . . . . . 0 N--CA 1.475 0.776 0 CA-C-O 119.644 -0.217 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -163.54 127.03 2.71 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.292 1.037 . . . . 0.0 108.51 178.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 69.4 p -83.09 69.71 9.91 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.933 0.893 . . . . 0.0 110.703 -176.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 19.8 p -136.22 147.27 47.52 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 125.741 1.617 . . . . 0.0 108.249 177.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 12.3 t -155.31 -154.12 0.48 Allowed 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -177.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.3 p -75.47 -176.18 3.09 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.359 1.864 . . . . 0.0 110.737 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -44.88 121.37 2.73 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.671 1.189 . . . . 0.0 110.246 167.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.1 p -141.29 -179.59 6.21 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 124.08 0.952 . . . . 0.0 110.197 -175.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 29.5 t -173.68 150.63 1.75 Allowed 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.459 1.904 . . . . 0.0 106.582 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -106.0 -70.9 0.77 Allowed 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -174.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -85.04 109.33 18.13 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 174.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.4 t -126.2 73.16 72.05 Favored Pre-proline 0 CA--C 1.528 0.134 0 C-N-CA 122.721 0.408 . . . . 0.0 111.453 174.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -69.27 162.11 43.15 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.284 1.989 . . . . 0.0 110.504 172.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 21.3 m -136.12 158.68 43.83 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.944 0.898 . . . . 0.0 109.803 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.9 p -80.86 163.51 23.35 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.71 0.804 . . . . 0.0 109.324 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 85.4 mtm180 -108.73 32.26 5.01 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.782 0.833 . . . . 0.0 110.665 175.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 29.9 p -87.6 -177.54 5.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.576 1.151 . . . . 0.0 110.92 179.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.2 tp -127.1 100.6 26.8 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 125.519 1.528 . . . . 0.0 109.568 -178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.62 159.14 97.93 Favored 'Cis proline' 0 N--CA 1.458 -0.575 0 CA-C-N 119.684 0.923 . . . . 0.0 110.357 -3.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -80.12 147.85 18.86 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.162 2.575 . . . . 0.0 109.775 171.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.64 137.68 52.48 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.342 1.457 . . . . 0.0 107.985 172.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 71.6 m -108.23 144.77 35.24 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.992 1.317 . . . . 0.0 108.724 173.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -150.63 155.91 40.31 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 124.989 1.316 . . . . 0.0 108.47 -171.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.8 m -104.63 128.44 52.66 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.344 0.657 . . . . 0.0 109.671 -174.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 46.3 p -108.78 1.86 21.31 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.934 0.894 . . . . 0.0 111.802 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -71.17 154.03 42.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.39 0.614 . . . . 0.0 109.949 170.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.422 HG13 ' HG3' ' A' ' 49' ' ' ARG . 95.8 t -142.42 131.8 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 125.276 1.43 . . . . 0.0 107.409 -175.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.4 ttp85 -156.43 -145.76 0.16 Allowed 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 -173.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -69.05 -92.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.098 1.759 . . . . 0.0 109.96 -176.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.4 mtmp? -105.05 168.69 8.89 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.334 1.453 . . . . 0.0 109.136 168.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.2 p -82.51 169.61 16.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.654 1.582 . . . . 0.0 110.804 170.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -84.51 175.17 9.47 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.91 0.884 . . . . 0.0 111.687 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.8 t -61.71 -30.85 71.03 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.684 1.194 . . . . 0.0 112.832 -176.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.79 45.78 0.96 Allowed 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.048 0.939 . . . . 0.0 110.196 -174.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.2 m -130.69 124.31 31.28 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.134 1.374 . . . . 0.0 108.844 170.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -106.27 -32.06 8.35 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 125.943 1.697 . . . . 0.0 110.133 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.1 p -99.55 57.61 1.03 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.283 1.433 . . . . 0.0 107.843 -175.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.3 t -106.97 131.49 53.98 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.1 -1.864 . . . . 0.0 108.717 -172.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.3 tp -155.48 141.92 18.64 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -172.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 m -120.08 151.57 38.84 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.251 1.02 . . . . 0.0 110.472 -173.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.7 t -85.19 154.18 22.16 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 -176.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.7 mtm105 -91.59 11.83 22.97 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.449 1.1 . . . . 0.0 111.498 176.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -72.5 178.94 3.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.586 1.154 . . . . 0.0 109.919 175.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -123.99 118.71 26.8 Favored Pre-proline 0 CA--C 1.532 0.27 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -75.03 143.58 78.24 Favored 'Cis proline' 0 CA--C 1.539 0.739 0 CA-C-N 119.664 0.916 . . . . 0.0 110.932 2.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -77.09 106.45 2.25 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.453 2.768 . . . . 0.0 109.122 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -110.74 150.42 29.1 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.926 1.29 . . . . 0.0 109.758 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -108.83 147.76 31.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -177.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.422 ' HG3' HG13 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -128.92 167.32 17.57 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.334 1.854 . . . . 0.0 109.13 -178.667 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 44.7 t -135.84 135.37 39.75 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.506 1.122 . . . . 0.0 110.449 174.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -112.97 42.25 1.92 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.621 1.568 . . . . 0.0 110.624 -173.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -62.75 158.24 19.14 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -174.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 30.3 mm -133.65 104.05 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 176.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.5 p -138.23 152.13 48.3 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 123.082 0.553 . . . . 0.0 109.879 175.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -66.65 -41.11 88.73 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 122.934 0.494 . . . . 0.0 110.242 172.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -88.8 -173.46 4.12 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.532 1.133 . . . . 0.0 109.447 172.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 6.6 t -156.58 159.65 38.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.768 0.827 . . . . 0.0 109.468 165.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -74.85 148.81 85.16 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 123.61 0.764 . . . . 0.0 109.527 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -71.28 171.32 16.29 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.133 2.556 . . . . 0.0 111.229 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.26 131.86 46.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.467 1.107 . . . . 0.0 111.737 -177.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -81.01 177.91 8.76 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.108 174.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.1 p . . . . . 0 C--O 1.252 1.191 0 CA-C-O 117.278 -1.344 . . . . 0.0 108.704 168.307 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 70.1 p . . . . . 0 N--CA 1.475 0.822 0 CA-C-O 119.655 -0.212 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -73.1 96.32 2.18 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 175.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.6 t -158.27 143.87 16.83 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.067 0.947 . . . . 0.0 109.306 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.0 t -165.3 143.09 6.01 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.516 1.126 . . . . 0.0 109.327 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 11.6 t -165.96 43.36 0.07 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.712 1.205 . . . . 0.0 109.326 176.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.3 p -70.05 148.86 48.29 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.753 0.821 . . . . 0.0 111.146 -174.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.52 97.78 3.13 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 124.272 1.029 . . . . 0.0 110.175 178.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.2 p -135.12 -176.21 4.18 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.09 0.956 . . . . 0.0 110.542 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 39.1 t -166.33 167.07 16.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.37 1.868 . . . . 0.0 107.313 175.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -113.98 -66.24 1.11 Allowed 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 168.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -80.33 110.42 15.76 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.292 1.037 . . . . 0.0 109.959 178.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.1 m -117.35 69.74 5.79 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 124.869 1.267 . . . . 0.0 111.055 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -76.81 162.4 32.5 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.083 1.856 . . . . 0.0 110.634 171.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 43.8 t -154.28 157.58 38.89 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.113 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.4 p -90.37 157.0 17.84 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.221 1.009 . . . . 0.0 109.066 178.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.9 mtm105 -106.88 42.59 1.27 Allowed 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.913 0.885 . . . . 0.0 109.823 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 p -96.6 179.77 4.88 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 126.066 1.746 . . . . 0.0 110.153 177.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -131.58 101.68 15.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 124.927 1.291 . . . . 0.0 107.989 -178.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -71.82 156.96 97.34 Favored 'Cis proline' 0 CA--C 1.537 0.642 0 CA-C-N 119.407 0.824 . . . . 0.0 110.615 -1.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -74.66 141.92 28.35 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 123.476 2.784 . . . . 0.0 110.542 174.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -104.77 109.6 21.61 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 171.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 68.4 m -107.21 148.1 29.33 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 125.009 1.324 . . . . 0.0 109.297 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -153.55 163.0 40.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.484 -167.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.1 t -107.77 128.46 54.6 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.651 1.18 . . . . 0.0 108.537 174.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 77.2 p -122.56 6.96 9.48 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.426 0.691 . . . . 0.0 112.385 -172.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -67.05 143.31 56.8 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 119.029 0.831 . . . . 0.0 111.345 179.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.9 t -108.69 126.35 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 125.947 1.699 . . . . 0.0 106.733 -178.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -165.8 -160.52 0.45 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -166.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -72.53 -153.07 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.594 0.758 . . . . 0.0 109.017 168.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -58.85 151.2 22.07 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.514 0.674 . . . . 0.0 112.051 -169.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 p -71.92 148.91 45.59 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.228 1.411 . . . . 0.0 111.037 -178.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.2 p80 -75.02 170.75 15.39 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.459 -0.791 . . . . 0.0 113.097 -169.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.5 t -60.45 -31.83 70.81 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.774 1.23 . . . . 0.0 112.355 -174.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.39 36.59 2.55 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.993 0.917 . . . . 0.0 111.118 -177.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 48.7 t -114.56 136.2 53.29 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 125.409 1.483 . . . . 0.0 107.832 174.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -105.84 -54.91 2.4 Favored 'General case' 0 CA--C 1.522 -0.097 0 C-N-CA 124.116 0.966 . . . . 0.0 109.684 -168.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.3 t -105.35 137.1 43.69 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 107.381 -1.341 . . . . 0.0 107.381 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 43.6 t -154.42 143.71 21.29 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.167 0.987 . . . . 0.0 109.164 -168.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 64.6 tp -152.41 151.75 31.18 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 124.458 1.103 . . . . 0.0 108.874 -175.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.2 m -130.28 163.95 25.65 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.874 0.87 . . . . 0.0 110.866 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 72.8 p -84.25 156.99 21.73 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.84 0.856 . . . . 0.0 110.39 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.5 ptt180 -93.46 12.82 23.69 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.342 1.057 . . . . 0.0 111.753 174.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.3 p -77.35 -179.96 6.05 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 124.467 1.107 . . . . 0.0 111.687 -177.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -130.24 106.71 16.21 Favored Pre-proline 0 CA--C 1.534 0.334 0 C-N-CA 124.784 1.234 . . . . 0.0 108.391 174.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.66 152.84 96.76 Favored 'Cis proline' 0 N--CA 1.456 -0.7 0 CA-C-N 119.513 0.862 . . . . 0.0 110.862 1.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.16 153.83 46.45 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.184 2.589 . . . . 0.0 108.713 170.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -148.58 135.81 20.24 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -174.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 74.8 m -107.3 157.45 17.92 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.067 0.947 . . . . 0.0 111.32 -168.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 19.8 ttp-105 -154.23 153.13 31.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.916 1.286 . . . . 0.0 108.879 -171.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.7 m -89.43 152.41 21.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.584 1.154 . . . . 0.0 110.754 173.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 22.3 t80 -130.41 21.93 5.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.109 1.764 . . . . 0.0 109.384 170.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -67.48 124.75 24.06 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.022 1.329 . . . . 0.0 109.796 -177.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 32.3 mm -107.84 122.05 61.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.9 p -139.41 179.46 6.53 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.264 1.426 . . . . 0.0 108.662 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -78.57 -9.64 59.43 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.967 -0.458 . . . . 0.0 111.431 172.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -138.02 -170.22 2.74 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.94 1.696 . . . . 0.0 110.34 -170.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 35.4 t -154.51 153.11 30.94 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.353 1.461 . . . . 0.0 108.506 171.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -78.9 151.59 76.5 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.975 0.91 . . . . 0.0 110.44 -176.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -70.13 173.47 11.25 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.053 2.502 . . . . 0.0 112.062 -173.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.1 p -59.28 133.59 56.24 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.115 0.966 . . . . 0.0 112.413 -174.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.84 176.29 8.18 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.341 -1.299 . . . . 0.0 110.903 178.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 59.2 p . . . . . 0 C--O 1.251 1.141 0 CA-C-O 117.15 -1.405 . . . . 0.0 108.961 168.641 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 76.1 p . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 119.944 -0.074 . . . . 0.0 110.806 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -67.77 169.83 8.96 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 171.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 72.7 p -59.5 -175.67 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.706 1.202 . . . . 0.0 111.176 164.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.8 p -76.73 -149.93 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.227 1.011 . . . . 0.0 109.994 177.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.0 t -78.85 55.68 1.77 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.582 1.153 . . . . 0.0 111.258 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 65.5 p -71.6 175.58 5.49 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.002 1.321 . . . . 0.0 110.393 174.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.91 115.4 2.37 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.773 0.829 . . . . 0.0 110.109 174.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.0 p -149.65 -171.34 3.87 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 123.779 0.831 . . . . 0.0 110.07 -170.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 t -169.96 -177.34 2.57 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 126.101 1.76 . . . . 0.0 106.906 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.422 ' H ' ' HB2' ' A' ' 26' ' ' ASP . 9.3 t70 -108.42 -52.65 2.74 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 171.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -147.89 146.64 29.13 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.302 1.041 . . . . 0.0 108.601 162.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -136.03 96.34 12.98 Favored Pre-proline 0 N--CA 1.448 -0.541 0 C-N-CA 124.916 1.286 . . . . 0.0 111.139 -175.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -75.01 166.68 28.68 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.578 2.185 . . . . 0.0 110.819 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.4 m -128.71 153.44 47.33 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.213 1.005 . . . . 0.0 110.215 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.4 p -84.31 158.78 21.08 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 125.834 1.653 . . . . 0.0 108.998 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 42.1 mtm105 -106.13 36.71 2.48 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.083 0.953 . . . . 0.0 109.825 -177.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -90.83 178.04 6.15 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 125.786 1.634 . . . . 0.0 110.124 175.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.9 tp -131.18 98.68 18.46 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 125.481 1.513 . . . . 0.0 108.849 -175.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -73.95 154.96 99.87 Favored 'Cis proline' 0 CA--C 1.536 0.622 0 CA-C-N 119.693 0.926 . . . . 0.0 111.126 0.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -78.82 140.25 16.17 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 123.54 2.826 . . . . 0.0 109.924 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -107.24 159.15 16.56 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.696 1.198 . . . . 0.0 108.833 173.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 72.8 m -132.12 142.53 49.53 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.9 1.28 . . . . 0.0 109.132 179.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -143.8 174.25 10.98 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.211 1.004 . . . . 0.0 108.605 -173.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.1 m -102.68 150.89 22.99 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 174.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.6 t -104.68 -9.52 18.14 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.366 163.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.422 ' HB2' ' H ' ' A' ' 10' ' ' ASP . 21.9 t0 -55.92 149.7 14.64 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.986 1.314 . . . . 0.0 112.313 173.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.535 HG13 ' HG2' ' A' ' 49' ' ' ARG . 53.6 t -144.23 147.15 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 C-N-CA 127.763 2.425 . . . . 0.0 105.914 174.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -155.19 -152.41 0.4 Allowed 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 -173.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -78.9 -116.3 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 106.059 -1.83 . . . . 0.0 106.059 155.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -68.53 158.27 34.22 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.894 1.225 . . . . 0.0 111.855 -178.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 4.1 p -82.59 163.3 21.55 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 126.49 1.916 . . . . 0.0 110.754 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 33.5 p80 -71.22 168.05 18.1 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -167.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.4 t -52.02 -37.85 54.87 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.871 1.668 . . . . 0.0 112.634 -173.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.35 24.77 12.34 Favored 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 124.367 1.067 . . . . 0.0 112.513 -175.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 33.9 t -91.21 127.46 36.65 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 175.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 tttp -104.85 -45.25 4.62 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.573 0.749 . . . . 0.0 110.452 -172.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.5 t -104.67 129.55 52.82 Favored 'General case' 0 CA--C 1.523 -0.085 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 172.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.6 t -150.38 140.66 22.26 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.006 0.922 . . . . 0.0 108.634 -168.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 22.4 tp -153.38 158.97 42.27 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.875 0.87 . . . . 0.0 109.436 -169.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 24.6 m -123.74 165.98 16.35 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 123.344 0.657 . . . . 0.0 111.102 -175.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -93.18 150.67 20.33 Favored 'General case' 0 C--N 1.341 0.221 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 169.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -91.69 15.24 13.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.54 1.136 . . . . 0.0 111.922 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -67.2 172.36 4.79 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 123.86 0.864 . . . . 0.0 110.593 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -121.07 110.32 34.75 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 172.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -74.21 152.7 98.56 Favored 'Cis proline' 0 CA--C 1.54 0.816 0 CA-C-N 119.592 0.89 . . . . 0.0 110.775 -0.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -82.01 131.76 7.07 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 124.148 3.232 . . . . 0.0 109.942 173.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -113.4 152.01 30.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.611 1.565 . . . . 0.0 108.063 174.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 92.1 m -113.53 154.4 27.17 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.606 0.762 . . . . 0.0 110.931 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.535 ' HG2' HG13 ' A' ' 27' ' ' VAL . 14.4 mtm105 -147.79 147.26 29.67 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.305 1.042 . . . . 0.0 109.448 -155.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 43.2 t -84.67 136.72 33.62 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 172.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -106.62 -23.59 12.4 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.109 1.364 . . . . 0.0 110.585 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -47.66 143.69 3.69 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 126.045 1.738 . . . . 0.0 113.26 -172.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.0 mm -106.37 127.92 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 C-N-CA 125.122 1.369 . . . . 0.0 107.327 -176.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.1 p -126.99 173.1 9.91 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.538 0.735 . . . . 0.0 109.476 173.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -88.99 -9.6 50.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.633 0.773 . . . . 0.0 111.328 174.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 38.7 p90 -133.75 173.28 11.7 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 125.43 1.492 . . . . 0.0 110.95 -174.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.1 t -110.12 137.06 48.38 Favored 'General case' 0 N--CA 1.458 -0.07 0 C-N-CA 125.853 1.661 . . . . 0.0 108.86 174.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -75.29 157.97 84.31 Favored Pre-proline 0 N--CA 1.449 -0.49 0 C-N-CA 126.635 1.974 . . . . 0.0 109.881 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -67.59 158.11 58.67 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 122.071 1.847 . . . . 0.0 109.817 170.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.0 p -67.41 149.27 50.49 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 120.937 0.399 . . . . 0.0 111.21 -179.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.33 -170.12 2.03 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.548 1.139 . . . . 0.0 110.6 -178.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.9 m . . . . . 0 C--O 1.25 1.111 0 CA-C-O 116.72 -1.61 . . . . 0.0 109.833 165.725 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.0 t . . . . . 0 N--CA 1.474 0.755 0 CA-C-O 121.196 0.522 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -162.13 160.74 27.64 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.457 1.103 . . . . 0.0 109.148 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 80.6 p -122.31 172.01 8.62 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.002 1.321 . . . . 0.0 109.81 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.3 t -150.2 137.91 19.96 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.665 0.786 . . . . 0.0 109.342 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.3 t -163.74 46.89 0.12 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.607 1.563 . . . . 0.0 107.929 177.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 82.8 p -82.34 174.21 11.34 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.106 0.962 . . . . 0.0 111.591 -168.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.95 119.48 5.09 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.898 0.879 . . . . 0.0 109.323 168.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 19.7 p -143.63 164.86 29.21 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.439 0.638 . . . . 0.0 112.001 -177.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 53.3 t -174.32 143.53 0.87 Allowed 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.869 -166.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -104.8 -65.99 1.0 Allowed 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.743 0.817 . . . . 0.0 108.915 -174.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -85.81 107.79 17.81 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 26.5 p -124.26 61.11 25.83 Favored Pre-proline 0 CA--C 1.535 0.396 0 C-N-CA 124.914 1.286 . . . . 0.0 111.292 -178.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -71.56 159.73 50.39 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.561 2.174 . . . . 0.0 111.042 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 24.9 m -129.19 157.4 41.92 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.035 0.934 . . . . 0.0 110.263 178.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.6 p -73.82 173.03 10.46 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.488 0.715 . . . . 0.0 110.289 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -106.05 10.67 32.09 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.663 1.185 . . . . 0.0 111.61 176.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.4 p -73.58 172.72 10.84 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 124.264 1.026 . . . . 0.0 111.681 179.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.8 tp -128.79 100.09 21.87 Favored Pre-proline 0 CA--C 1.536 0.432 0 C-N-CA 126.012 1.725 . . . . 0.0 108.727 -177.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.92 158.48 96.35 Favored 'Cis proline' 0 CA--C 1.534 0.51 0 CA-C-N 119.68 0.921 . . . . 0.0 111.616 0.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.79 145.99 14.6 Favored 'Trans proline' 0 N--CA 1.451 -0.978 0 C-N-CA 123.305 2.67 . . . . 0.0 110.236 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -113.71 131.54 56.14 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.029 1.731 . . . . 0.0 106.739 175.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 88.7 m -105.5 144.2 32.6 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 123.724 0.81 . . . . 0.0 108.866 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -143.58 159.71 41.95 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.137 0.975 . . . . 0.0 108.763 -171.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 18.2 m -107.35 121.24 44.17 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.671 0.788 . . . . 0.0 109.317 178.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 70.8 p -107.9 22.85 15.36 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.419 1.087 . . . . 0.0 109.948 175.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -76.13 148.61 37.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 170.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.2 t -143.1 127.4 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 125.102 1.361 . . . . 0.0 107.787 -173.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -165.25 -156.06 0.27 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.227 0.611 . . . . 0.0 109.48 -173.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -57.69 -81.01 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.109 0.964 . . . . 0.0 110.664 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -116.12 169.86 8.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.297 1.439 . . . . 0.0 111.712 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 p -96.54 159.31 15.0 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.838 2.055 . . . . 0.0 111.424 177.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 16.8 p80 -88.47 172.29 9.46 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.021 0.928 . . . . 0.0 113.47 -170.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.4 t -51.93 -39.51 59.29 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.975 1.71 . . . . 0.0 112.797 -177.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.81 42.79 1.34 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.176 0.991 . . . . 0.0 110.871 -174.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 51.1 t -123.26 119.8 31.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 173.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -102.51 -40.76 6.53 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.837 1.255 . . . . 0.0 110.188 -165.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.9 t -104.11 118.72 37.33 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 170.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.3 t -144.98 133.06 21.42 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.903 1.681 . . . . 0.0 107.322 -175.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.2 tt -153.68 140.44 19.05 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -172.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.4 m -118.87 159.67 23.33 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 124.437 1.095 . . . . 0.0 111.311 -169.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.6 t -78.83 148.15 32.97 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 29.6 ptt-85 -93.81 41.06 1.08 Allowed 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.881 1.272 . . . . 0.0 110.447 -175.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.6 t -163.23 -160.8 0.63 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.334 0.654 . . . . 0.0 110.056 -174.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -107.79 131.62 21.6 Favored Pre-proline 0 N--CA 1.442 -0.867 0 C-N-CA 127.124 2.169 . . . . 0.0 108.648 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -73.53 145.96 85.55 Favored 'Cis proline' 0 N--CA 1.456 -0.71 0 N-CA-C 109.283 -1.084 . . . . 0.0 109.283 -4.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -77.71 84.36 1.99 Allowed 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 123.115 2.543 . . . . 0.0 108.953 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -107.2 145.99 31.94 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.485 1.514 . . . . 0.0 108.547 -177.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -116.13 148.19 40.57 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.422 0.629 . . . . 0.0 112.486 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 27.8 mtm-85 -119.67 156.64 30.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.956 1.702 . . . . 0.0 109.16 -175.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 1.7 m -100.11 160.23 14.48 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.989 0.916 . . . . 0.0 109.328 165.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -154.04 27.53 0.47 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.292 1.037 . . . . 0.0 109.688 175.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -73.26 153.07 40.76 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 123.813 0.845 . . . . 0.0 110.544 -176.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.0 mm -106.47 132.48 53.57 Favored 'Isoleucine or valine' 0 C--N 1.34 0.18 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -176.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 56.4 p -144.1 -165.19 2.06 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.443 1.497 . . . . 0.0 108.238 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -134.87 18.58 3.5 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.245 1.018 . . . . 0.0 110.609 172.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -156.5 178.61 10.12 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.365 1.466 . . . . 0.0 110.215 -173.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.0 t -111.21 148.2 33.33 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.843 1.257 . . . . 0.0 109.97 178.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -97.75 151.99 37.88 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.394 1.478 . . . . 0.0 108.79 172.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -64.59 163.67 26.47 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.222 2.615 . . . . 0.0 111.714 -176.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.2 p -57.33 139.14 53.77 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.038 0.935 . . . . 0.0 112.555 -175.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.96 -177.63 3.69 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 124.453 1.101 . . . . 0.0 112.085 -173.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 71.1 p . . . . . 0 C--O 1.25 1.086 0 CA-C-O 116.962 -1.494 . . . . 0.0 110.91 176.204 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 39.3 p . . . . . 0 N--CA 1.473 0.719 0 CA-C-O 120.247 0.07 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.6 tpmt? -80.51 63.67 5.04 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.443 1.097 . . . . 0.0 108.162 174.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.9 m -133.35 61.96 1.67 Allowed 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.457 1.103 . . . . 0.0 109.219 -174.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.9 t -156.18 159.2 38.76 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.305 1.042 . . . . 0.0 108.987 177.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.0 t 1.41 77.46 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 129.149 2.979 . . . . 0.0 114.39 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 48.0 p -70.66 156.77 39.04 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.965 0.906 . . . . 0.0 110.205 -178.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.52 121.84 13.73 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.922 0.489 . . . . 0.0 110.721 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.3 p -149.21 173.15 13.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.679 0.752 . . . . 0.0 111.768 -175.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 16.7 t -170.23 152.41 4.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 126.323 1.849 . . . . 0.0 108.219 -174.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -105.14 -66.86 0.95 Allowed 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 -177.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -93.19 104.24 16.44 Favored 'General case' 0 C--N 1.344 0.337 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 178.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 21.4 p -119.93 64.32 9.26 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 126.916 2.086 . . . . 0.0 110.764 -174.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -67.3 156.65 65.32 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.517 2.144 . . . . 0.0 111.817 -177.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 63.4 m -130.33 159.32 37.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.471 1.108 . . . . 0.0 109.99 178.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 81.9 p -89.27 172.17 9.24 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.421 1.489 . . . . 0.0 110.245 -178.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 33.0 ptt-85 -107.47 -1.59 21.26 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.132 1.373 . . . . 0.0 112.436 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.7 p -71.36 179.37 2.96 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 125.516 1.526 . . . . 0.0 111.315 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.0 mm -128.46 117.57 20.01 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 124.973 1.309 . . . . 0.0 108.548 -177.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -69.91 146.57 82.88 Favored 'Cis proline' 0 N--CA 1.456 -0.689 0 N-CA-C 109.525 -0.991 . . . . 0.0 109.525 -5.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -72.16 125.97 11.33 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.703 2.269 . . . . 0.0 109.024 178.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.33 151.36 24.26 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.233 1.013 . . . . 0.0 109.224 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 81.7 m -127.66 145.84 50.75 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.466 1.507 . . . . 0.0 109.809 -177.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -150.52 163.96 37.16 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.545 1.538 . . . . 0.0 108.287 -171.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 68.7 m -107.68 141.68 38.82 Favored 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.548 0.739 . . . . 0.0 110.097 171.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.0 t -107.53 -12.03 15.36 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.462 -172.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.67 146.91 51.03 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 123.812 0.845 . . . . 0.0 110.452 -176.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 85.0 t -110.35 126.04 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 174.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.75 -166.25 2.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.922 0.889 . . . . 0.0 111.515 -171.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -71.69 -136.94 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 165.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -63.03 157.17 22.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 120.633 -1.292 . . . . 0.0 112.347 -178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.1 m -75.45 166.55 23.42 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.147 175.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -88.3 171.18 10.36 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.704 0.802 . . . . 0.0 112.916 -173.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 16.6 t -63.52 -24.39 67.8 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.073 1.349 . . . . 0.0 113.102 -175.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -103.7 34.59 2.93 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.225 1.01 . . . . 0.0 110.781 178.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.8 t -119.59 126.59 51.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.563 1.145 . . . . 0.0 108.309 175.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -105.84 -38.93 6.2 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.753 1.221 . . . . 0.0 109.923 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.1 t -106.38 113.82 27.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 174.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.8 t -128.9 137.96 51.73 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 126.293 1.837 . . . . 0.0 107.249 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.403 HD23 ' H ' ' A' ' 40' ' ' CYS . 0.5 OUTLIER -143.02 152.16 41.61 Favored 'General case' 0 N--CA 1.46 0.069 0 C-N-CA 124.328 1.051 . . . . 0.0 108.634 -174.624 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.403 ' H ' HD23 ' A' ' 39' ' ' LEU . 6.8 m -137.75 157.08 47.2 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.802 0.841 . . . . 0.0 110.459 -173.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.8 t -91.87 151.87 20.35 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 123.406 0.441 . . . . 0.0 109.886 178.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.4 ptt-85 -97.32 19.04 13.81 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.709 1.204 . . . . 0.0 111.557 177.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -69.05 178.33 2.3 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 124.275 1.03 . . . . 0.0 110.563 170.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -123.56 117.09 27.82 Favored Pre-proline 0 CA--C 1.533 0.313 0 C-N-CA 124.071 0.948 . . . . 0.0 109.222 175.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -71.78 151.12 95.28 Favored 'Cis proline' 0 CA--C 1.54 0.804 0 CA-C-N 119.587 0.888 . . . . 0.0 110.287 -5.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -83.29 127.11 4.43 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.95 3.1 . . . . 0.0 110.244 175.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -115.95 161.48 18.77 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.761 1.224 . . . . 0.0 108.93 174.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 99.5 m -112.56 169.52 8.83 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.46 1.104 . . . . 0.0 110.618 -179.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.1 ttp85 -159.53 146.83 16.91 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 125.192 1.397 . . . . 0.0 108.54 -174.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 49.9 t -89.97 124.0 34.36 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.742 0.817 . . . . 0.0 109.25 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.67 10.37 29.0 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.903 1.681 . . . . 0.0 110.571 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -67.72 145.63 54.57 Favored 'General case' 0 C--N 1.341 0.217 0 O-C-N 121.707 -0.62 . . . . 0.0 110.635 -175.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 49.0 mm -107.45 133.85 50.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 124.497 1.119 . . . . 0.0 108.97 -169.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.2 p -141.99 -178.14 5.55 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.722 1.209 . . . . 0.0 109.551 -177.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -107.86 -5.33 17.29 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.95 1.3 . . . . 0.0 110.985 169.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -133.42 -173.19 3.15 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 125.982 1.713 . . . . 0.0 110.364 -168.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.7 t -121.33 146.3 47.0 Favored 'General case' 0 CA--C 1.527 0.061 0 C-N-CA 125.628 1.571 . . . . 0.0 109.207 177.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -78.57 160.58 72.08 Favored Pre-proline 0 N--CA 1.452 -0.349 0 C-N-CA 124.476 1.11 . . . . 0.0 108.953 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -60.0 159.7 24.76 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.392 2.061 . . . . 0.0 110.651 174.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.3 p -62.44 138.18 58.41 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 122.796 0.438 . . . . 0.0 111.017 -177.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.11 -172.82 2.35 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 124.529 1.131 . . . . 0.0 109.592 177.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.449 -1.262 . . . . 0.0 110.093 177.004 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 72.7 p . . . . . 0 N--CA 1.474 0.772 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -61.04 107.06 0.67 Allowed 'General case' 0 C--N 1.343 0.294 0 C-N-CA 123.483 0.713 . . . . 0.0 109.858 -178.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 80.9 p -86.57 -175.87 5.61 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.825 1.25 . . . . 0.0 110.832 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.1 t -66.31 171.06 5.15 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.627 161.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.3 t 3.49 83.51 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 128.662 2.785 . . . . 0.0 114.189 -170.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 76.7 p -69.43 178.06 2.61 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.959 1.304 . . . . 0.0 110.961 -177.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.27 114.39 2.88 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.827 178.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.7 p -140.26 -170.39 2.97 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.459 1.104 . . . . 0.0 109.219 -170.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.1 t -173.58 170.99 3.97 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.387 1.875 . . . . 0.0 106.434 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 57.8 t0 -108.22 -60.74 1.68 Allowed 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 166.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -119.2 109.74 16.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.265 1.026 . . . . 0.0 109.046 -177.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.86 89.21 47.96 Favored Pre-proline 0 N--CA 1.452 -0.366 0 C-N-CA 124.596 1.158 . . . . 0.0 111.979 176.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.31 171.57 14.81 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.122 1.881 . . . . 0.0 110.859 169.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.8 m -133.17 156.54 47.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.379 1.072 . . . . 0.0 109.692 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 36.8 p -88.08 162.94 16.5 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.742 1.217 . . . . 0.0 109.611 178.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -106.47 35.24 3.03 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.31 1.044 . . . . 0.0 110.045 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 p -90.21 179.27 5.95 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.592 1.557 . . . . 0.0 110.327 175.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.37 106.21 17.55 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.954 1.302 . . . . 0.0 108.33 -178.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.37 156.78 96.62 Favored 'Cis proline' 0 CA--C 1.535 0.531 0 CA-C-N 119.618 0.899 . . . . 0.0 109.835 -4.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.05 139.95 19.64 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.657 2.238 . . . . 0.0 110.072 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -107.78 132.9 52.9 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.817 1.247 . . . . 0.0 108.107 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 79.2 m -108.07 143.97 36.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.452 1.101 . . . . 0.0 109.423 172.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -157.01 170.22 23.04 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 124.006 0.922 . . . . 0.0 109.365 -173.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 89.3 m -104.27 143.96 32.26 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.694 0.798 . . . . 0.0 109.877 -177.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 11.3 t -115.32 -16.69 11.44 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.682 1.193 . . . . 0.0 111.212 177.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.08 155.45 31.33 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 121.289 0.566 . . . . 0.0 111.158 -178.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.7 t -122.64 143.03 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 125.994 1.717 . . . . 0.0 107.92 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.6 tpp180 -161.67 -145.2 0.11 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.958 1.303 . . . . 0.0 107.902 -174.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -91.79 -130.84 0.11 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 125.021 1.329 . . . . 0.0 108.301 167.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -65.63 171.85 3.85 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.594 1.158 . . . . 0.0 114.086 -165.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -71.18 151.1 44.7 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.01 1.324 . . . . 0.0 109.69 179.38 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.3 p80 -81.9 -178.84 7.16 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 121.495 0.664 . . . . 0.0 112.073 173.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.5 t -78.44 23.95 0.29 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.311 1.045 . . . . 0.0 113.167 -172.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -160.38 69.35 0.38 Allowed 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.599 0.636 . . . . 0.0 109.866 172.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 94.1 m -124.89 124.77 42.78 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.852 0.861 . . . . 0.0 110.044 -176.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 tmtp? -105.7 -30.68 9.3 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.882 1.673 . . . . 0.0 108.75 176.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.4 t -118.86 131.46 56.07 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.438 1.495 . . . . 0.0 108.279 169.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 42.3 t -154.99 143.52 20.53 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 125.078 1.351 . . . . 0.0 108.376 177.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.1 tp -152.47 170.21 20.69 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 122.986 0.515 . . . . 0.0 110.069 -172.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 65.4 m -134.37 163.76 28.95 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.128 0.971 . . . . 0.0 110.598 172.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.8 p -79.68 148.94 31.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.12 0.968 . . . . 0.0 110.186 178.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.3 ptt85 -98.32 52.44 1.03 Allowed 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.234 1.414 . . . . 0.0 109.122 176.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.3 t -153.39 -163.93 1.79 Allowed 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.448 1.099 . . . . 0.0 109.476 177.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -129.63 129.49 23.15 Favored Pre-proline 0 CA--C 1.533 0.312 0 C-N-CA 125.416 1.486 . . . . 0.0 108.73 -178.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -70.87 147.8 87.82 Favored 'Cis proline' 0 N--CA 1.456 -0.727 0 CA-C-N 119.682 0.922 . . . . 0.0 110.592 -0.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -74.45 98.91 1.16 Allowed 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 123.502 2.801 . . . . 0.0 108.721 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -106.55 140.73 38.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.184 1.394 . . . . 0.0 108.49 -173.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 79.1 m -126.11 153.79 44.03 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.472 0.709 . . . . 0.0 111.024 -168.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.73 162.14 36.24 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.419 1.088 . . . . 0.0 110.544 -176.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 12.9 t -118.68 126.4 51.84 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 125.389 1.475 . . . . 0.0 107.491 172.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -119.78 37.92 4.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.41 1.084 . . . . 0.0 110.194 -168.282 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -62.59 152.12 35.94 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.735 1.214 . . . . 0.0 112.07 -174.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 46.4 mm -108.05 101.96 13.29 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 C-N-CA 124.414 1.086 . . . . 0.0 108.233 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.3 p -113.45 -175.93 2.78 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.893 1.277 . . . . 0.0 108.63 171.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -110.49 11.3 23.11 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.937 0.895 . . . . 0.0 110.631 173.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -148.56 170.1 18.82 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.882 1.673 . . . . 0.0 110.244 -174.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 19.8 t -118.75 138.72 52.47 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 126.003 1.721 . . . . 0.0 108.556 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -82.73 154.94 68.39 Favored Pre-proline 0 N--CA 1.45 -0.466 0 C-N-CA 125.576 1.55 . . . . 0.0 109.79 -177.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -67.13 163.91 32.28 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.622 2.214 . . . . 0.0 110.473 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.3 133.25 53.86 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 123.413 0.685 . . . . 0.0 112.129 -172.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -79.05 -174.89 4.29 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.714 1.206 . . . . 0.0 110.425 176.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.4 t . . . . . 0 C--O 1.251 1.171 0 CA-C-O 117.105 -1.426 . . . . 0.0 108.598 168.01 . . . . . . . . 0 0 . 1 stop_ save_