data_5u87_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 5u87 _Structure_validation_residue.Date_analyzed 2017-03-07 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 ' 3' ' ' CYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 66.7 m . . . . . 0 N--CA 1.427 -1.603 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 51.8 p -83.38 154.71 23.88 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.85 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -85.86 69.58 10.58 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.5 m -158.6 168.23 27.45 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 81.5 mt -128.22 123.16 22.38 Favored Pre-proline 0 C--N 1.309 -1.192 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -71.53 142.76 74.42 Favored 'Cis proline' 0 C--O 1.244 0.809 0 C-N-CA 123.642 -1.399 . . . . 0.0 112.61 0.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.88 142.49 39.15 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 122.353 2.035 . . . . 0.0 110.857 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.495 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 44.8 mm -101.68 107.72 22.13 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.262 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.5 m . . . . . 0 C--N 1.301 -1.521 0 CA-C-O 121.899 0.856 . . . . 0.0 111.618 -178.479 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.431 -1.39 0 CA-C-O 120.952 0.406 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -101.73 112.46 25.06 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 122.092 0.948 . . . . 0.0 109.994 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.404 HG23 ' CB ' ' A' ' 74' ' ' ALA . 3.0 mp -120.08 131.22 73.02 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.284 0 N-CA-C 105.637 -1.986 . . . . 0.0 105.637 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.477 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 24.4 ptt-85 -73.03 123.52 23.69 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 121.099 0.476 . . . . 0.0 109.744 -176.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.75 -16.65 21.38 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -174.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.439 ' CD ' ' HB2' ' A' ' 25' ' ' ARG . 17.8 pm0 -75.77 -18.31 59.57 Favored 'General case' 0 N--CA 1.421 -1.915 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.973 -178.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 6.3 pt20 -83.83 -19.53 34.8 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -91.75 3.26 55.52 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.624 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -59.11 -34.47 72.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 123.762 0.664 . . . . 0.0 109.317 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -69.73 -50.35 44.35 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.057 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.81 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.5 OUTLIER -58.11 -48.73 79.31 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 120.772 0.32 . . . . 0.0 110.338 178.408 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -52.52 -52.15 56.05 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 123.44 0.696 . . . . 0.0 111.651 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.4 ptm -70.64 -38.41 73.86 Favored 'General case' 0 C--O 1.205 -1.288 0 C-N-CA 120.676 -0.41 . . . . 0.0 111.062 -177.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.81 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 1.4 p80 -70.83 -23.36 62.34 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.371 -0.532 . . . . 0.0 111.926 -176.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 99' ' ' MET . 91.5 mt -88.86 -39.08 14.09 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.218 174.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 41.1 p -83.61 -22.79 32.13 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 118.21 -1.396 . . . . 0.0 112.31 -175.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 t -92.5 121.74 34.25 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.903 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 . . . . . 0 C--N 1.296 -1.719 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 169.619 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.446 -0.647 0 CA-C-O 121.365 0.602 . . . . 0.0 111.344 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -83.13 -41.6 18.34 Favored 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.8 m -56.67 -31.52 64.51 Favored 'General case' 0 C--O 1.212 -0.882 0 O-C-N 123.708 0.63 . . . . 0.0 110.121 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.8 mt -82.99 -48.06 11.06 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.232 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.2 t -65.94 -50.07 65.72 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -178.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.536 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.7 t -59.31 -30.8 68.61 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.101 0.56 . . . . 0.0 110.29 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.477 ' HA ' ' NE2' ' A' ' 64' ' ' GLN . 27.5 t-20 -78.7 -25.04 44.69 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.43 0.633 . . . . 0.0 111.471 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -84.9 -42.9 14.58 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.198 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.536 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.7 pp -68.49 -31.99 71.65 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.647 -177.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.477 ' NE2' ' HA ' ' A' ' 61' ' ' ASN . 9.3 pt20 -71.2 -10.36 59.63 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -177.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -86.11 -12.43 50.04 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 121.816 0.817 . . . . 0.0 109.424 176.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 15.6 t -83.46 163.28 2.97 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.24 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 174.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.432 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 1.6 mp0 -48.2 142.23 5.58 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 124.187 0.995 . . . . 0.0 111.738 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -53.65 -35.58 61.15 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 124.767 1.227 . . . . 0.0 112.915 -174.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -87.49 -20.81 26.02 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.221 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 59.5 m -95.17 -8.84 35.16 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.681 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.444 ' HB3' HD21 ' A' ' 112' ' ' LEU . 23.0 mt-30 -57.33 -43.12 83.1 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.87 176.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 6.5 p -80.87 -24.21 38.49 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.163 0.506 . . . . 0.0 111.177 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -67.92 -33.18 74.19 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.483 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.449 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.72 -31.29 68.15 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.459 177.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.422 HD12 HD21 ' A' ' 63' ' ' LEU . 21.1 mm -73.18 -27.57 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.238 0 CA-C-N 115.095 -0.957 . . . . 0.0 109.94 -177.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -74.54 -39.81 62.11 Favored 'General case' 0 CA--C 1.484 -1.589 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 -175.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -56.22 -40.42 74.04 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 112.626 -2.079 . . . . 0.0 109.215 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 74' ' ' ALA . 25.9 t -60.64 -47.9 90.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.929 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 42.3 t -61.6 -48.71 87.51 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.198 -174.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -61.75 -41.53 97.79 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.655 -175.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -79.97 -28.82 39.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.634 0.254 . . . . 0.0 111.163 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.98 -41.12 60.15 Favored 'General case' 0 C--N 1.311 -1.077 0 O-C-N 122.19 -0.319 . . . . 0.0 111.314 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -69.48 -35.63 75.78 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.126 -178.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.458 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -72.01 -36.23 69.66 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.178 -178.388 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.458 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 5.8 pt20 -72.8 -34.51 66.94 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.355 -174.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.459 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 2.4 mm? -76.79 -36.62 56.85 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.62 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -66.39 -40.35 89.62 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.623 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -75.12 -17.46 60.42 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.367 0.604 . . . . 0.0 110.157 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -83.08 -65.52 1.59 Allowed Glycine 0 N--CA 1.421 -2.357 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -158.43 -26.2 0.08 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -175.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.459 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 146.38 -114.97 0.77 Allowed Glycine 0 CA--C 1.492 -1.397 0 N-CA-C 108.476 -1.85 . . . . 0.0 108.476 -174.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.23 -32.17 2.3 Favored Glycine 0 C--O 1.196 -2.252 0 CA-C-O 118.909 -0.94 . . . . 0.0 114.488 172.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -48.1 -32.66 7.11 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.921 0.888 . . . . 0.0 113.396 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -72.87 -38.12 67.11 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.964 0.412 . . . . 0.0 111.429 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.448 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 20.0 pt20 -85.43 -44.19 12.96 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 121.475 0.655 . . . . 0.0 109.662 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 92.0 t -61.19 -22.53 27.55 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 C-N-CA 125.412 1.485 . . . . 0.0 110.933 176.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -46.44 -46.23 18.63 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.448 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 20.1 pt20 -63.55 -18.5 63.92 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -178.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.444 ' O ' HD23 ' A' ' 36' ' ' LEU . 4.7 tpt -100.43 -46.83 5.11 Favored 'General case' 0 N--CA 1.438 -1.072 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -177.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.9 p -62.08 -26.17 39.38 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-O 120.834 0.35 . . . . 0.0 111.771 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -23.42 67.34 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.805 -0.559 . . . . 0.0 111.345 177.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -65.93 -25.59 67.21 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.024 178.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.22 -28.82 69.04 Favored 'General case' 0 C--O 1.203 -1.385 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.332 176.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.17 -24.52 62.26 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.265 1.031 . . . . 0.0 109.083 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 49.0 mtm -92.37 -13.02 30.78 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.528 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.464 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.1 OUTLIER -54.0 -46.75 98.52 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.226 0.61 . . . . 0.0 111.06 -177.965 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.579 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 20.3 Cg_endo -60.72 -26.89 83.88 Favored 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 121.382 1.388 . . . . 0.0 112.666 175.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -77.97 -46.98 19.62 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -64.64 -47.96 76.61 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.305 -0.862 . . . . 0.0 112.44 -177.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 10.2 t -84.08 -3.32 57.99 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.2 0.524 . . . . 0.0 109.701 -175.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.2 t30 58.17 64.23 1.55 Allowed 'General case' 0 C--O 1.247 0.944 0 CA-C-O 123.072 1.415 . . . . 0.0 110.717 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.444 HD21 ' HB3' ' A' ' 71' ' ' GLN . 31.6 mt -101.63 158.52 16.03 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 112.992 -1.913 . . . . 0.0 109.015 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -72.92 44.68 0.14 Allowed 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 124.368 1.067 . . . . 0.0 112.988 -176.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.579 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 67.0 m -160.47 152.14 19.75 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -175.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.8 m -151.33 114.92 4.87 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 6.3 pt . . . . . 0 N--CA 1.428 -1.547 0 CA-C-O 118.459 -0.781 . . . . 0.0 112.546 -177.448 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 72.6 m . . . . . 0 N--CA 1.434 -1.256 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.4 p -75.65 142.43 42.58 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 176.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.66 68.88 10.55 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.825 0.821 . . . . 0.0 109.976 178.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.1 t -150.5 170.96 17.86 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 105.936 -1.875 . . . . 0.0 105.936 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.3 mp -127.39 125.35 23.91 Favored Pre-proline 0 C--N 1.298 -1.635 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.29 143.26 76.7 Favored 'Cis proline' 0 C--O 1.243 0.76 0 C-N-CA 123.722 -1.366 . . . . 0.0 111.985 -1.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.77 129.76 21.72 Favored 'Trans proline' 0 C--O 1.254 1.282 0 C-N-CA 122.122 1.882 . . . . 0.0 111.43 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 37.6 mm -92.41 111.69 24.75 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 75.9 m . . . . . 0 C--N 1.29 -2.003 0 CA-C-O 121.449 0.642 . . . . 0.0 111.305 -175.325 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 60.0 m . . . . . 0 N--CA 1.409 -2.494 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -107.6 117.07 33.12 Favored 'General case' 0 N--CA 1.416 -2.137 0 CA-C-O 121.871 0.843 . . . . 0.0 108.948 172.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.405 ' N ' HD11 ' A' ' 24' ' ' ILE . 3.3 mp -111.69 143.34 21.69 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.64 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 -177.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.514 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.2 ptt180 -69.72 116.27 9.92 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 118.399 0.545 . . . . 0.0 110.382 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 pp -63.66 -14.8 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.395 0.617 . . . . 0.0 112.393 -175.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -73.43 -22.9 60.09 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.698 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.0 pt20 -83.73 -18.5 37.67 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -94.87 -0.7 53.8 Favored 'General case' 0 CA--C 1.48 -1.715 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.441 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -59.14 -30.97 68.53 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 123.751 0.657 . . . . 0.0 111.273 -178.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -71.08 -52.56 18.68 Favored 'General case' 0 C--O 1.216 -0.662 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.832 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 1.6 t -56.47 -46.79 80.22 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 124.173 0.989 . . . . 0.0 109.032 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -53.11 -56.02 19.48 Favored 'General case' 0 N--CA 1.425 -1.692 0 C-N-CA 124.926 1.291 . . . . 0.0 111.349 174.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.7 ptm -70.29 -33.66 71.82 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.397 -173.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.832 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -69.89 -23.42 63.25 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.631 -178.72 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.9 mt -88.54 -36.14 16.54 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.862 175.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 72.4 p -80.15 -19.78 46.41 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 119.161 -1.016 . . . . 0.0 112.809 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 66.4 p -89.57 135.43 33.61 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -178.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 . . . . . 0 C--N 1.305 -1.344 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 172.489 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.417 ' HB2' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER . . . . . 0 N--CA 1.443 -0.81 0 CA-C-O 121.736 0.779 . . . . 0.0 110.252 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.92 -38.73 61.74 Favored 'General case' 0 CA--C 1.495 -1.166 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.082 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 m -56.97 -35.59 69.33 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 42.4 mt -73.41 -51.67 16.45 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.247 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.6 t -60.78 -50.5 73.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 122.776 0.43 . . . . 0.0 111.277 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.543 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.4 t -59.44 -33.63 71.51 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 124.168 0.987 . . . . 0.0 110.161 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.411 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 16.9 t-20 -79.22 -23.21 43.93 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.517 0.675 . . . . 0.0 110.411 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -82.26 -48.26 11.44 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.857 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.543 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.6 pp -67.41 -33.36 75.02 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.431 -177.299 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -69.59 -12.77 61.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.982 -176.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 68.6 mm-40 -89.39 -11.01 44.43 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.464 0.649 . . . . 0.0 109.569 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -80.84 164.45 3.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 174.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -45.6 136.5 5.81 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.828 0.451 . . . . 0.0 110.9 173.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.454 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 17.2 ptpt -57.9 -33.99 69.33 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -174.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.413 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 24.5 pt20 -76.11 -20.46 57.62 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.835 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.413 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 58.8 m -102.29 -9.38 20.44 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.776 -174.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.454 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 29.6 mt-30 -59.45 -42.62 92.38 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 121.17 0.509 . . . . 0.0 110.773 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.2 p -78.82 -24.22 44.62 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.279 0.562 . . . . 0.0 111.406 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -71.43 -32.54 68.49 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.442 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.493 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.84 -29.85 69.75 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.766 176.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.453 ' O ' HG23 ' A' ' 79' ' ' VAL . 28.2 mm -68.9 -35.64 70.27 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.654 -178.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -63.48 -44.62 93.88 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -176.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.415 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 4.6 mt-30 -61.65 -41.92 98.18 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 113.322 -1.763 . . . . 0.0 110.32 -177.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 74' ' ' ALA . 38.2 t -53.31 -47.56 57.23 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.082 0 O-C-N 124.413 1.07 . . . . 0.0 109.359 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 75' ' ' ILE . 41.4 t -67.76 -45.83 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.091 0 CA-C-N 115.476 -0.783 . . . . 0.0 108.939 -174.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -56.94 -51.61 68.48 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.208 -178.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 20.3 pt20 -72.61 -31.74 65.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.648 -177.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.18 -38.46 66.15 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.871 0.367 . . . . 0.0 111.37 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -75.72 -34.75 60.37 Favored 'General case' 0 C--N 1.312 -1.043 0 C-N-CA 120.014 -0.674 . . . . 0.0 110.144 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.82 -31.7 65.0 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.14 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -71.32 -33.33 69.57 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.579 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.567 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 4.1 mm? -78.66 -37.04 42.87 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.009 175.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -58.03 -41.73 83.85 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.924 0.89 . . . . 0.0 110.732 179.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -79.28 -14.41 59.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.777 -176.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -96.75 -105.88 2.3 Favored Glycine 0 N--CA 1.425 -2.04 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.988 -176.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -102.92 -17.35 15.53 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.145 0.498 . . . . 0.0 111.649 -175.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.567 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 128.08 -93.12 0.36 Allowed Glycine 0 N--CA 1.428 -1.889 0 N-CA-C 108.601 -1.8 . . . . 0.0 108.601 -173.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.436 ' HA3' HD11 ' A' ' 86' ' ' LEU . . . 72.25 -37.37 0.67 Allowed Glycine 0 C--O 1.193 -2.46 0 N-CA-C 115.77 1.068 . . . . 0.0 115.77 172.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -49.63 -27.7 4.93 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 118.538 1.169 . . . . 0.0 113.111 -178.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.453 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 4.5 pt20 -67.3 -45.0 77.84 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 120.67 0.271 . . . . 0.0 110.477 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.459 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 19.2 pt20 -86.51 -42.64 13.37 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 121.521 0.677 . . . . 0.0 111.075 -175.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.438 HG21 ' HG ' ' A' ' 86' ' ' LEU . 91.0 t -64.57 -22.95 32.33 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.191 0 C-N-CA 125.108 1.363 . . . . 0.0 111.766 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -48.1 -45.09 32.37 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.459 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 28.8 pt20 -61.3 -21.79 64.29 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 122.961 0.504 . . . . 0.0 112.322 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 3.3 tpt -100.42 -44.89 5.75 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -175.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.95 -24.13 34.88 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.516 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -23.66 67.38 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.755 -0.59 . . . . 0.0 110.578 176.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -63.26 -29.25 70.61 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.444 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -63.71 -29.88 71.05 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 121.191 0.52 . . . . 0.0 110.266 177.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -73.14 -17.23 61.41 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.792 0.806 . . . . 0.0 109.511 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 50.7 mtp -92.14 -20.61 21.06 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.331 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 5.0 mp -52.15 -45.51 93.84 Favored Pre-proline 0 N--CA 1.468 0.43 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -59.79 -22.5 68.3 Favored 'Trans proline' 0 C--N 1.369 1.624 0 C-N-CA 121.141 1.227 . . . . 0.0 112.862 176.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -89.45 -45.82 9.16 Favored 'General case' 0 N--CA 1.411 -2.39 0 CA-C-O 121.126 0.488 . . . . 0.0 109.971 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -68.31 -38.95 82.09 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.868 -176.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.458 ' SG ' HD22 ' A' ' 112' ' ' LEU . 16.7 t -87.3 -6.46 58.51 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -179.01 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.1 t30 57.74 64.4 1.57 Allowed 'General case' 0 CA--C 1.508 -0.638 0 C-N-CA 124.91 1.284 . . . . 0.0 110.082 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.458 HD22 ' SG ' ' A' ' 110' ' ' CYS . 47.5 mt -96.04 159.46 14.95 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 113.372 -1.74 . . . . 0.0 109.935 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -71.7 37.53 0.06 Allowed 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 123.612 0.765 . . . . 0.0 112.709 -177.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.402 ' H ' ' C ' ' A' ' 112' ' ' LEU . 74.4 m -157.15 154.58 29.55 Favored 'General case' 0 C--N 1.28 -2.416 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -175.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 12.0 p -149.74 134.14 17.42 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 43.0 mm . . . . . 0 C--N 1.307 -1.241 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -178.872 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 63.7 m . . . . . 0 N--CA 1.431 -1.414 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 77.5 p -86.96 157.74 19.41 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.865 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -91.98 76.81 5.46 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.305 0.574 . . . . 0.0 109.594 176.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.9 t -152.01 172.0 16.96 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.6 mp -128.33 117.77 20.22 Favored Pre-proline 0 N--CA 1.435 -1.206 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.34 147.74 90.18 Favored 'Cis proline' 0 C--O 1.246 0.908 0 C-N-CA 123.596 -1.418 . . . . 0.0 111.801 -0.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -69.92 139.57 39.98 Favored 'Trans proline' 0 C--O 1.247 0.952 0 C-N-CA 122.164 1.909 . . . . 0.0 111.094 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.531 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 44.3 mm -97.44 111.44 27.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.955 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 73.6 m . . . . . 0 C--N 1.288 -2.082 0 CA-C-O 121.491 0.662 . . . . 0.0 110.235 -179.548 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 67.8 m . . . . . 0 N--CA 1.418 -2.05 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -107.11 108.54 20.05 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-O 121.869 0.843 . . . . 0.0 108.893 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.449 ' N ' HD13 ' A' ' 24' ' ' ILE . 3.0 mp -102.49 141.3 18.84 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.691 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -175.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.486 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 20.6 ptt180 -67.11 114.14 5.63 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 121.672 0.749 . . . . 0.0 111.12 -177.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.23 -15.65 12.95 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -73.75 -23.19 59.7 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.835 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.3 pt20 -83.37 -33.31 25.83 Favored 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.721 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -82.15 -8.64 59.66 Favored 'General case' 0 CA--C 1.474 -1.971 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.021 -177.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -58.09 -30.27 66.11 Favored 'General case' 0 C--N 1.314 -0.937 0 O-C-N 124.17 0.919 . . . . 0.0 110.855 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -70.18 -54.66 11.9 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -54.08 -50.52 66.6 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.396 1.079 . . . . 0.0 108.524 -178.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -53.86 -61.15 2.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 125.504 1.522 . . . . 0.0 112.581 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -67.17 -34.87 78.46 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.831 0.348 . . . . 0.0 111.825 -172.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.424 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 8.9 t-80 -67.51 -33.13 74.46 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.804 -177.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 91.4 mt -84.64 -34.68 23.03 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.433 ' CG2' ' HB2' ' A' ' 82' ' ' ALA . 41.8 p -79.71 -21.01 45.14 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 118.83 -1.148 . . . . 0.0 113.165 -176.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 57.2 p -88.68 154.73 20.07 Favored 'General case' 0 N--CA 1.424 -1.727 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.829 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 . . . . . 0 C--N 1.297 -1.713 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 173.91 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.424 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER . . . . . 0 C--O 1.21 -0.998 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.3 tp -74.97 -52.27 11.57 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 175.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.7 m -55.31 -27.66 48.41 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.929 -178.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 50.1 mt -88.34 -51.37 5.78 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.958 178.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.44 -50.19 60.35 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.94 0.496 . . . . 0.0 112.129 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.54 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 10.1 t -59.37 -41.43 89.29 Favored 'General case' 0 CA--C 1.492 -1.274 0 C-N-CA 123.412 0.685 . . . . 0.0 109.664 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -72.08 -26.67 62.25 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.944 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.425 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 0.1 OUTLIER -78.27 -48.92 14.67 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.474 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.54 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.9 pp -67.61 -31.64 71.82 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.651 -177.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -74.23 -6.96 50.92 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.693 -178.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.7 -24.12 56.2 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 174.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.9 t -81.19 161.84 3.68 Favored 'Isoleucine or valine' 0 C--O 1.248 1.025 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.302 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.443 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 47.7 mt-10 -50.2 141.48 11.3 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.984 0.914 . . . . 0.0 112.263 176.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -62.57 -24.79 67.73 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -174.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.439 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 12.4 pt20 -82.55 -15.36 52.59 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.458 0.647 . . . . 0.0 110.533 178.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.439 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 64.2 m -107.81 -9.34 15.78 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.167 -174.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 76.9 mt-30 -59.33 -40.83 87.57 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 14.5 p -81.2 -24.54 37.4 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.488 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -67.74 -32.97 73.95 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.145 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.52 ' O ' HG21 ' A' ' 78' ' ' VAL . . . -61.57 -34.89 76.37 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.361 177.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.47 ' O ' HG23 ' A' ' 79' ' ' VAL . 30.8 mm -65.12 -37.18 79.57 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.787 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.274 -178.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -66.0 -43.18 88.45 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 -175.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.491 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.4 mt-30 -62.7 -41.22 99.01 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 113.47 -1.696 . . . . 0.0 109.402 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.52 HG21 ' O ' ' A' ' 74' ' ' ALA . 27.8 t -55.17 -46.82 77.87 Favored 'Isoleucine or valine' 0 C--N 1.356 0.859 0 O-C-N 123.769 0.668 . . . . 0.0 109.845 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 75' ' ' ILE . 21.2 t -70.07 -46.7 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.101 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -173.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -64.85 -35.25 80.53 Favored 'General case' 0 N--CA 1.424 -1.734 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.183 -174.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 3.8 pt20 -85.61 -26.35 26.13 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.979 0.419 . . . . 0.0 111.607 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.464 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -72.27 -44.94 62.07 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.105 0.478 . . . . 0.0 110.22 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -69.21 -29.55 67.54 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.4 tttt -65.04 -46.26 81.98 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 124.477 1.111 . . . . 0.0 111.332 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 2.7 pt20 -69.07 -23.29 64.01 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-O 121.339 0.59 . . . . 0.0 110.791 -175.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.423 ' HG ' HG23 ' A' ' 96' ' ' VAL . 4.4 mm? -86.13 -36.0 19.83 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.918 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -65.13 -37.4 87.32 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 123.327 0.651 . . . . 0.0 110.981 177.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -82.02 0.47 40.13 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.677 0.751 . . . . 0.0 111.069 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -96.68 -120.15 3.83 Favored Glycine 0 N--CA 1.424 -2.119 0 N-CA-C 108.986 -1.646 . . . . 0.0 108.986 175.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -116.45 -56.56 2.28 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-O 121.114 0.483 . . . . 0.0 109.961 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -155.62 -141.07 3.13 Favored Glycine 0 CA--C 1.493 -1.29 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 -178.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 95.09 -30.3 8.27 Favored Glycine 0 C--O 1.202 -1.886 0 CA-C-O 119.128 -0.818 . . . . 0.0 113.227 177.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -49.44 -34.62 17.06 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 123.513 0.725 . . . . 0.0 112.812 -175.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -78.8 -33.24 46.38 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -85.45 -39.24 17.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.854 0.835 . . . . 0.0 110.092 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.423 HG23 ' HG ' ' A' ' 86' ' ' LEU . 84.5 t -63.72 -22.67 31.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.328 -1.305 . . . . 0.0 110.501 174.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -46.15 -47.34 17.55 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 123.429 0.455 . . . . 0.0 112.128 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -59.46 -21.55 60.24 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.159 0.504 . . . . 0.0 112.028 -178.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.9 tpt -104.07 -45.22 4.79 Favored 'General case' 0 N--CA 1.423 -1.79 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.747 -173.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.26 -24.01 31.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 CA-C-O 121.077 0.465 . . . . 0.0 110.765 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -22.66 66.48 Favored 'General case' 0 C--N 1.333 -0.118 0 O-C-N 121.91 -0.494 . . . . 0.0 111.017 176.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -66.2 -28.24 68.61 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.37 177.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.517 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -62.85 -35.34 79.65 Favored 'General case' 0 C--O 1.201 -1.476 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 176.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -68.01 -18.87 64.84 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.565 0.698 . . . . 0.0 110.026 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 36.1 mtp -92.67 -13.97 28.73 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.317 -178.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.517 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 1.7 mm? -51.15 -44.97 88.82 Favored Pre-proline 0 N--CA 1.476 0.839 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.471 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 18.5 Cg_endo -60.67 -31.04 91.61 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 121.387 1.391 . . . . 0.0 112.417 176.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -77.26 -36.02 54.76 Favored 'General case' 0 N--CA 1.427 -1.608 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -178.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -75.11 -49.57 19.19 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.454 0.645 . . . . 0.0 111.254 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 38.8 t -82.19 -2.24 51.65 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.456 -173.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 66.46 42.93 2.74 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 122.765 1.269 . . . . 0.0 110.19 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 68.4 mt -82.4 157.67 23.61 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.057 -178.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -74.74 31.44 0.09 Allowed 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.587 1.155 . . . . 0.0 112.895 -175.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 99.3 m -154.5 160.04 41.32 Favored 'General case' 0 C--N 1.28 -2.419 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -173.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 27.1 p -146.4 144.57 29.82 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 70.8 mt . . . . . 0 C--N 1.301 -1.528 0 CA-C-O 118.243 -0.884 . . . . 0.0 109.076 -178.159 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 50.5 m . . . . . 0 N--CA 1.444 -0.743 0 CA-C-O 120.828 0.347 . . . . 0.0 111.631 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.4 p -79.01 161.33 26.69 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.438 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -85.37 69.71 10.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.438 0.637 . . . . 0.0 109.765 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.8 t -143.01 169.66 17.15 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 34.7 mm -129.15 112.61 18.39 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 178.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -76.92 146.48 84.0 Favored 'Cis proline' 0 C--O 1.246 0.891 0 C-N-CA 123.969 -1.263 . . . . 0.0 109.919 -2.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -64.46 142.51 78.69 Favored 'Trans proline' 0 C--N 1.328 -0.549 0 C-N-CA 122.56 2.173 . . . . 0.0 112.065 -176.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 42.0 mm -92.35 116.15 32.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.6 m . . . . . 0 C--N 1.285 -2.198 0 CA-C-O 121.609 0.718 . . . . 0.0 110.736 -177.667 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 68.1 m . . . . . 0 N--CA 1.421 -1.903 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -100.61 112.83 25.27 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-O 121.714 0.769 . . . . 0.0 109.216 175.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.9 mp -114.33 139.03 42.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.969 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 -175.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.449 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 21.4 ptt-85 -67.12 121.77 16.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.487 0.66 . . . . 0.0 111.616 -175.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.38 -18.91 19.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 115.536 -0.757 . . . . 0.0 112.717 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -74.0 -17.23 61.02 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.192 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.488 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 1.2 pt20 -91.85 -19.05 22.93 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.157 -177.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -96.45 2.33 52.45 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.306 178.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.549 ' O ' ' HG2' ' A' ' 34' ' ' MET . 43.5 t30 -52.05 -39.72 60.06 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 124.754 1.283 . . . . 0.0 111.488 -178.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -70.61 -52.77 19.2 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -175.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.458 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 1.2 m -55.26 -50.2 70.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 123.866 0.729 . . . . 0.0 110.32 178.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -54.01 -59.84 4.12 Favored 'General case' 0 N--CA 1.433 -1.286 0 C-N-CA 123.707 0.803 . . . . 0.0 112.319 176.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.549 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.4 ptm -65.39 -41.05 94.12 Favored 'General case' 0 C--O 1.204 -1.322 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -66.8 -26.23 66.84 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 120.904 0.383 . . . . 0.0 110.302 -176.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 91.7 mt -88.32 -26.5 22.22 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 69.8 p -88.51 -19.25 26.66 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.587 -1.245 . . . . 0.0 111.578 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 74.3 p -90.01 139.4 30.64 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 . . . . . 0 C--N 1.293 -1.865 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 172.411 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.438 -1.065 0 CA-C-O 120.455 0.169 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -75.08 -43.69 51.69 Favored 'General case' 0 C--O 1.209 -1.071 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.6 m -57.87 -30.64 65.98 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.31 0.576 . . . . 0.0 110.79 178.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.5 mt -84.77 -56.16 3.73 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.506 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.3 t -62.1 -48.98 77.77 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.637 1.175 . . . . 0.0 111.397 -176.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.496 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 43.5 t -59.27 -36.53 75.7 Favored 'General case' 0 C--O 1.215 -0.755 0 C-N-CA 122.397 0.279 . . . . 0.0 110.456 178.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.52 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 8.6 t30 -71.71 -36.56 70.57 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-O 121.217 0.532 . . . . 0.0 110.466 -178.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.488 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 8.2 tp-100 -71.72 -44.24 64.49 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.914 -179.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.496 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.3 pp -72.8 -30.7 64.28 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 121.178 0.513 . . . . 0.0 110.961 -177.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.523 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 11.9 pt20 -72.36 -14.33 61.7 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -176.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 61' ' ' ASN . 44.3 mt-10 -80.22 -16.41 54.83 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-O 121.758 0.79 . . . . 0.0 109.363 177.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 18.8 t -79.61 163.13 3.65 Favored 'Isoleucine or valine' 0 C--O 1.25 1.128 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 175.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -51.03 145.09 7.89 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 123.856 0.862 . . . . 0.0 111.334 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.594 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 8.9 ptpp? -58.9 -32.53 69.6 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -176.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.404 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 13.1 pt20 -80.05 -21.61 43.26 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.637 0.732 . . . . 0.0 109.785 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.404 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.8 m -97.66 -13.07 21.72 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.653 -173.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.594 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 50.6 mt-30 -57.29 -46.62 82.97 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 121.175 0.512 . . . . 0.0 110.363 175.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.452 ' HA ' HG12 ' A' ' 75' ' ' ILE . 14.9 p -79.35 -23.63 43.27 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.924 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.483 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 10.2 mm-40 -66.62 -35.59 80.55 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 175.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.453 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -60.83 -25.25 66.49 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 123.551 0.74 . . . . 0.0 110.526 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.452 HG12 ' HA ' ' A' ' 72' ' ' CYS . 30.0 mm -73.8 -27.02 22.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.945 -178.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -75.89 -38.91 57.33 Favored 'General case' 0 CA--C 1.486 -1.494 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -175.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.505 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 67.6 mm-40 -59.46 -44.15 93.05 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 111.56 -2.563 . . . . 0.0 109.711 -178.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 74' ' ' ALA . 21.4 t -57.79 -45.72 87.13 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.708 0 O-C-N 123.627 0.579 . . . . 0.0 109.996 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.445 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 25.9 t -68.05 -47.04 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.317 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -174.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -55.28 -57.34 12.19 Favored 'General case' 0 N--CA 1.428 -1.571 0 O-C-N 124.836 1.335 . . . . 0.0 110.081 -178.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 9.7 pt20 -68.63 -30.02 68.65 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.02 -39.68 60.96 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 120.917 0.389 . . . . 0.0 111.093 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 13.7 pt20 -77.58 -37.02 51.42 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.649 -178.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.481 ' CG ' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -70.83 -30.45 66.88 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.34 0.126 . . . . 0.0 111.34 -177.794 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 2.8 pt20 -69.03 -28.68 66.78 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.229 0.537 . . . . 0.0 109.749 -178.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.418 ' HG ' HG23 ' A' ' 96' ' ' VAL . 4.3 mm? -87.8 -44.03 11.42 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.935 174.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -66.26 -22.48 66.32 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.47 1.108 . . . . 0.0 113.404 -176.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -66.5 -12.52 57.89 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -179.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 138.48 67.14 0.05 OUTLIER Glycine 0 CA--C 1.48 -2.138 0 C-N-CA 119.676 -1.25 . . . . 0.0 112.171 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -145.96 -58.11 0.31 Allowed 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 129.83 -134.91 8.09 Favored Glycine 0 N--CA 1.427 -1.963 0 N-CA-C 106.152 -2.779 . . . . 0.0 106.152 -174.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.63 -34.82 1.6 Allowed Glycine 0 C--O 1.196 -2.278 0 N-CA-C 115.352 0.901 . . . . 0.0 115.352 171.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -48.06 -29.52 3.62 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.651 1.18 . . . . 0.0 114.118 -176.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.503 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 3.3 pt20 -80.88 -43.72 19.45 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.287 0.565 . . . . 0.0 111.054 177.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 25.8 pt20 -84.08 -44.27 14.24 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 121.254 0.55 . . . . 0.0 111.649 -173.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.418 HG23 ' HG ' ' A' ' 86' ' ' LEU . 64.3 t -64.53 -23.48 33.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 C-N-CA 124.86 1.264 . . . . 0.0 110.418 178.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -51.11 -47.41 61.96 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 19.4 pt20 -67.82 -16.92 64.33 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.351 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 7.3 tpt -100.1 -49.07 4.41 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.5 p -59.95 -28.12 40.23 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.673 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.416 ' HE3' ' O ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -58.7 -25.05 62.49 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 175.468 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -65.13 -28.94 69.78 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 122.64 0.376 . . . . 0.0 110.529 177.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.415 ' HB3' ' CD1' ' A' ' 36' ' ' LEU . . . -60.78 -28.73 68.97 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.465 0.65 . . . . 0.0 110.987 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -73.16 -15.76 61.45 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.561 0.696 . . . . 0.0 110.988 -177.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 46.1 mtt -91.69 -13.97 30.83 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.878 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.502 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 98.3 mt -50.67 -48.09 83.54 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.452 -177.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 19.7 Cg_endo -59.19 -26.95 83.62 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 122.105 1.87 . . . . 0.0 113.113 177.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -83.59 -44.41 14.63 Favored 'General case' 0 N--CA 1.41 -2.438 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -74.93 -24.87 58.56 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.303 -175.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.404 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 25.6 t -98.8 -7.49 27.4 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.915 -178.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.3 t30 58.75 64.82 1.35 Allowed 'General case' 0 C--O 1.239 0.534 0 CA-C-O 122.819 1.295 . . . . 0.0 110.732 -176.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 107' ' ' PRO . 60.8 mt -99.67 158.95 15.41 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 113.272 -1.786 . . . . 0.0 110.07 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -72.7 35.26 0.07 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.806 1.242 . . . . 0.0 112.608 -177.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 40.3 m -157.3 159.71 37.82 Favored 'General case' 0 C--N 1.276 -2.598 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 30.6 m -148.47 143.79 26.96 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 39.7 mm . . . . . 0 C--N 1.311 -1.091 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.316 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.498 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 5.4 m . . . . . 0 N--CA 1.421 -1.893 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.8 p -73.68 156.26 38.13 Favored 'General case' 0 C--O 1.253 1.267 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -84.1 70.21 10.48 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.9 t -153.14 163.34 40.04 Favored 'General case' 0 N--CA 1.419 -1.996 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -178.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 78.2 mt -129.15 119.01 19.51 Favored Pre-proline 0 C--N 1.301 -1.539 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.26 144.18 72.34 Favored 'Cis proline' 0 C--O 1.246 0.878 0 C-N-CA 123.921 -1.283 . . . . 0.0 112.417 -1.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -71.45 133.74 23.11 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.1 1.866 . . . . 0.0 111.459 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.3 mm -92.01 113.58 27.58 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 178.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.498 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.2 t . . . . . 0 N--CA 1.41 -2.442 0 C-N-CA 118.771 -1.171 . . . . 0.0 111.872 -172.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.9 m . . . . . 0 N--CA 1.415 -2.186 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -106.75 120.37 41.81 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.424 ' N ' HD11 ' A' ' 24' ' ' ILE . 3.3 mp -114.51 143.8 23.46 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.631 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 -178.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.497 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 39.1 ptt180 -66.79 116.54 7.79 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -67.51 -15.54 19.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.363 -173.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -84.5 -9.74 58.08 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.6 -177.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 7.7 pt20 -87.23 -20.68 26.58 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 118.963 -1.095 . . . . 0.0 108.157 176.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.25 -5.24 57.78 Favored 'General case' 0 CA--C 1.474 -1.959 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.203 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -53.31 -31.99 46.74 Favored 'General case' 0 C--O 1.209 -1.061 0 O-C-N 124.525 1.141 . . . . 0.0 111.101 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -67.23 -58.33 5.03 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.774 -0.371 . . . . 0.0 110.122 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -54.1 -49.98 67.9 Favored 'General case' 0 C--O 1.22 -0.451 0 O-C-N 123.752 0.657 . . . . 0.0 109.71 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -50.18 -58.66 5.09 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 124.579 1.151 . . . . 0.0 112.321 174.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -67.85 -43.46 79.42 Favored 'General case' 0 C--O 1.208 -1.118 0 O-C-N 121.992 -0.443 . . . . 0.0 112.136 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -66.21 -26.22 67.28 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.409 ' CD1' ' HB2' ' A' ' 103' ' ' ALA . 98.7 mt -88.58 -28.32 20.79 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 176.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.413 HG22 HG11 ' A' ' 96' ' ' VAL . 66.1 p -86.31 -11.69 51.49 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 119.305 -0.958 . . . . 0.0 111.341 178.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.5 p -89.08 121.88 31.85 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 . . . . . 0 N--CA 1.423 -1.796 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 168.898 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.435 -1.198 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -79.75 -43.6 22.27 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.2 m -57.64 -33.26 68.1 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 123.702 0.626 . . . . 0.0 110.562 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 51.0 mt -84.52 -50.77 7.43 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.734 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.4 t -62.56 -49.56 74.81 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 123.243 0.617 . . . . 0.0 111.574 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.473 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 33.0 t -58.3 -38.62 77.42 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 122.597 0.359 . . . . 0.0 110.115 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.552 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 7.5 t30 -73.35 -29.97 63.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.317 0.58 . . . . 0.0 110.686 -177.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -77.15 -43.61 33.33 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.277 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.473 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.5 pp -72.23 -34.18 68.12 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.514 -177.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -70.65 -12.97 61.89 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -176.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.552 ' HG3' ' O ' ' A' ' 61' ' ' ASN . 37.0 mt-10 -84.5 -8.95 58.76 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-O 121.643 0.735 . . . . 0.0 110.294 177.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 39.9 t -83.92 163.23 2.92 Favored 'Isoleucine or valine' 0 C--O 1.247 0.971 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 173.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.1 mt-10 -51.51 142.69 13.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.072 0.549 . . . . 0.0 111.36 177.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -56.91 -33.79 67.3 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -175.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.422 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 19.7 pt20 -78.96 -21.3 47.36 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 121.381 0.61 . . . . 0.0 110.42 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.422 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 49.7 m -100.4 -11.02 20.58 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.473 -174.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 74.2 mt-30 -59.21 -43.81 92.29 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 123.241 0.617 . . . . 0.0 110.881 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.409 ' HA ' HG12 ' A' ' 75' ' ' ILE . 10.9 p -78.32 -23.39 47.07 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 120.258 -0.577 . . . . 0.0 111.728 177.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -68.37 -34.08 75.41 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.472 0.653 . . . . 0.0 110.323 177.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.67 -27.83 66.74 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.367 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.409 HG12 ' HA ' ' A' ' 72' ' ' CYS . 28.9 mm -71.64 -34.96 54.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.973 -178.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -64.29 -44.73 90.76 Favored 'General case' 0 C--O 1.249 1.052 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.48 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.8 mt-30 -58.28 -45.52 87.75 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 112.682 -2.054 . . . . 0.0 110.914 -176.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 19.6 t -52.45 -44.87 45.08 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.954 0 O-C-N 124.103 0.877 . . . . 0.0 110.06 -178.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.19 -48.88 71.84 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -174.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.97 -39.26 94.15 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.632 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 20.2 pt20 -78.66 -32.65 47.29 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 120.751 0.31 . . . . 0.0 111.698 -179.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.6 -35.06 60.63 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.105 0.479 . . . . 0.0 111.642 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -76.03 -36.0 59.27 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.373 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.7 -32.2 65.57 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.059 -176.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 17.7 pt20 -69.4 -38.15 77.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.038 0.447 . . . . 0.0 110.176 -178.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.453 ' HG ' HG21 ' A' ' 96' ' ' VAL . 3.7 mm? -74.91 -33.34 61.99 Favored 'General case' 0 C--O 1.246 0.903 0 CA-C-O 121.074 0.464 . . . . 0.0 110.713 178.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.477 ' HA ' ' NE2' ' A' ' 93' ' ' GLN . 50.0 tt0 -60.0 -43.59 95.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.948 -1.023 . . . . 0.0 110.511 178.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -88.92 -2.45 58.6 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.773 -176.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -98.57 -82.09 1.64 Allowed Glycine 0 N--CA 1.425 -2.053 0 CA-C-N 115.424 -0.807 . . . . 0.0 113.041 -177.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -134.95 -23.4 1.54 Allowed 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -172.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.431 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 132.98 -127.89 4.92 Favored Glycine 0 CA--C 1.473 -2.556 0 N-CA-C 105.966 -2.854 . . . . 0.0 105.966 -170.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.476 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 78.86 -20.66 4.36 Favored Glycine 0 C--O 1.192 -2.487 0 CA-C-N 118.605 1.202 . . . . 0.0 114.151 174.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.477 ' NE2' ' HA ' ' A' ' 87' ' ' GLN . 46.3 mt-30 -50.73 -37.95 44.63 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 125.551 1.541 . . . . 0.0 110.71 -175.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -78.57 -37.6 42.27 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.843 -178.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.529 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 10.5 pt20 -81.02 -42.55 20.93 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.345 0.593 . . . . 0.0 110.025 -178.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.453 HG21 ' HG ' ' A' ' 86' ' ' LEU . 90.3 t -63.96 -24.57 36.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 CA-C-N 114.823 -1.081 . . . . 0.0 110.205 177.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -49.0 -44.5 41.28 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.05 0.54 . . . . 0.0 112.003 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 13.9 pt20 -69.4 -17.84 63.7 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -176.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 7.3 tpt -98.87 -47.18 5.38 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.6 p -62.76 -25.0 37.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.396 178.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -20.17 65.4 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.644 -0.66 . . . . 0.0 112.089 175.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -66.41 -28.59 68.74 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.452 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -64.25 -24.41 67.65 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-O 121.353 0.597 . . . . 0.0 110.562 178.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -75.17 -16.4 60.51 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.526 0.679 . . . . 0.0 110.38 -179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' MET . . . . . 0.454 ' O ' ' HG2' ' A' ' 109' ' ' GLN . 46.0 mtt -88.18 -14.91 37.42 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.423 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.452 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 93.4 mt -49.46 -49.96 68.35 Favored Pre-proline 0 C--N 1.322 -0.589 0 O-C-N 123.654 0.596 . . . . 0.0 112.537 -177.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.429 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 20.8 Cg_endo -62.22 -23.97 75.79 Favored 'Trans proline' 0 C--N 1.365 1.421 0 C-N-CA 121.734 1.623 . . . . 0.0 113.267 177.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -82.75 -45.67 14.09 Favored 'General case' 0 N--CA 1.417 -2.119 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . 0.454 ' HG2' ' O ' ' A' ' 105' ' ' MET . 10.6 mm100 -74.15 -39.15 63.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.958 -175.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 10.2 t -86.16 -3.62 59.0 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -177.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 58.33 61.79 2.18 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 124.701 1.2 . . . . 0.0 109.884 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.453 ' C ' ' H ' ' A' ' 114' ' ' CYS . 52.7 mt -94.59 160.16 14.76 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.591 -178.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -67.2 30.66 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.494 0 C-N-CA 124.935 1.294 . . . . 0.0 113.218 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.453 ' H ' ' C ' ' A' ' 112' ' ' LEU . 67.7 m -155.25 143.77 20.44 Favored 'General case' 0 C--N 1.274 -2.69 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -176.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 38.0 m -133.08 116.9 16.9 Favored 'General case' 0 C--N 1.286 -2.16 0 CA-C-O 120.873 0.368 . . . . 0.0 110.152 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.9 mm . . . . . 0 C--N 1.31 -1.126 0 N-CA-C 107.035 -1.469 . . . . 0.0 107.035 178.368 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.786 ' SG ' ' HB2' ' A' ' 9' ' ' PRO . 4.0 t . . . . . 0 N--CA 1.434 -1.231 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.5 p -85.47 157.2 20.52 Favored 'General case' 0 C--N 1.283 -2.312 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.304 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -87.74 76.58 8.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 177.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.7 m -147.41 160.26 42.76 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.153 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 69.4 mt -129.54 111.6 17.75 Favored Pre-proline 0 C--N 1.309 -1.156 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -73.65 143.83 79.08 Favored 'Cis proline' 0 C--O 1.241 0.648 0 C-N-CA 124.362 -1.099 . . . . 0.0 111.78 -0.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.786 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 74.5 Cg_endo -72.75 155.9 53.55 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.586 2.191 . . . . 0.0 112.681 -178.114 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.8 mm -110.96 112.0 38.65 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 64.6 m . . . . . 0 C--N 1.298 -1.653 0 C-N-CA 119.124 -1.03 . . . . 0.0 110.285 -174.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 N--CA 1.415 -2.188 0 CA-C-O 121.139 0.495 . . . . 0.0 110.487 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 -106.92 103.28 12.66 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.415 177.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.9 mp -108.54 132.34 56.7 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.557 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.457 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 18.9 ptt-85 -67.42 121.42 15.73 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 123.799 0.687 . . . . 0.0 110.607 -177.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -64.58 -15.81 18.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.408 ' HG2' ' HB2' ' A' ' 25' ' ' ARG . 20.9 pt20 -75.56 -8.89 57.91 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.523 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.575 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 1.4 pt20 -98.49 -18.2 18.33 Favored 'General case' 0 N--CA 1.42 -1.959 0 C-N-CA 118.861 -1.136 . . . . 0.0 109.989 178.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -99.33 -3.84 33.07 Favored 'General case' 0 CA--C 1.476 -1.874 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.68 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.478 ' O ' ' HG2' ' A' ' 34' ' ' MET . 26.7 p30 -54.24 -32.24 55.5 Favored 'General case' 0 C--N 1.311 -1.1 0 O-C-N 124.022 0.826 . . . . 0.0 112.938 -178.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -68.8 -56.82 6.8 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.2 m -55.35 -49.82 71.25 Favored 'General case' 0 C--O 1.213 -0.827 0 O-C-N 123.869 0.731 . . . . 0.0 110.172 178.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.43 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.0 tt0 -51.93 -57.2 10.13 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 123.489 0.716 . . . . 0.0 112.425 176.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 26.3 ptt? -68.31 -41.44 80.85 Favored 'General case' 0 CA--C 1.507 -0.709 0 C-N-CA 120.242 -0.583 . . . . 0.0 112.418 -174.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 59.2 m-70 -72.05 -24.41 61.52 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.434 ' O ' ' HB3' ' A' ' 99' ' ' MET . 99.3 mt -88.65 -21.76 23.79 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 119.916 -0.713 . . . . 0.0 111.988 177.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.412 ' CG2' ' HB2' ' A' ' 82' ' ' ALA . 32.1 p -85.73 -21.15 28.4 Favored 'General case' 0 C--N 1.298 -1.651 0 C-N-CA 118.177 -1.409 . . . . 0.0 111.548 176.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.8 m -89.8 122.97 33.38 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.648 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 . . . . . 0 N--CA 1.437 -1.108 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 171.349 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 . . . . . 0 N--CA 1.441 -0.922 0 CA-C-O 121.102 0.477 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.83 -44.12 56.63 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 176.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.0 m -56.43 -34.72 67.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.069 0.461 . . . . 0.0 110.317 177.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 45.9 mt -78.49 -51.55 9.83 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.233 0.54 . . . . 0.0 110.838 178.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.9 t -63.57 -49.75 72.19 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.417 1.087 . . . . 0.0 111.076 -176.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.479 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 12.8 t -58.02 -37.99 75.35 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.613 0.765 . . . . 0.0 110.479 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -75.31 -25.05 57.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.514 0.673 . . . . 0.0 110.789 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.575 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 8.2 tp-100 -83.22 -42.91 16.7 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.321 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.479 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 4.0 pp -68.92 -28.29 66.53 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.609 0.718 . . . . 0.0 110.572 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.43 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 12.0 pt20 -75.77 -6.83 52.51 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.265 -177.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -84.03 -11.75 56.26 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-O 121.721 0.772 . . . . 0.0 109.12 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 12.4 t -89.25 164.5 2.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 CA-C-N 114.902 -1.045 . . . . 0.0 108.767 177.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -46.79 144.49 2.35 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.628 0.771 . . . . 0.0 111.031 173.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.527 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -61.3 -33.47 73.64 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.017 1.118 . . . . 0.0 114.017 -176.348 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.434 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 28.4 pt20 -75.53 -25.12 56.92 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.764 0.792 . . . . 0.0 110.004 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.434 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 60.1 m -94.27 -13.63 26.32 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.099 -174.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.527 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 54.3 mt-30 -56.87 -43.86 81.63 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 121.211 0.529 . . . . 0.0 110.202 175.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.402 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.8 p -79.9 -23.81 41.57 Favored 'General case' 0 N--CA 1.435 -1.213 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.414 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -68.88 -32.0 71.34 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.251 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.442 ' O ' ' HB2' ' A' ' 77' ' ' GLN . . . -62.28 -26.17 68.25 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 123.59 0.756 . . . . 0.0 110.183 177.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.402 HG12 ' HA ' ' A' ' 72' ' ' CYS . 31.0 mm -72.63 -31.2 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.356 -178.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -72.66 -40.81 66.05 Favored 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -175.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.472 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 53.2 mm-40 -57.6 -42.33 83.02 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 112.256 -2.247 . . . . 0.0 110.927 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.421 HG22 ' O ' ' A' ' 74' ' ' ALA . 23.4 t -58.94 -46.49 91.39 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.79 0 O-C-N 123.833 0.708 . . . . 0.0 109.255 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.424 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 19.7 t -69.17 -42.24 81.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -58.88 -48.4 81.53 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.677 -178.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 9.1 pt20 -76.26 -35.55 58.89 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 123.122 0.264 . . . . 0.0 111.386 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.412 ' HB2' ' CG2' ' A' ' 37' ' ' THR . . . -69.97 -35.92 74.81 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.901 0.381 . . . . 0.0 111.681 -178.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 28.9 pt20 -79.06 -35.46 42.48 Favored 'General case' 0 C--N 1.308 -1.215 0 C-N-CA 118.798 -1.161 . . . . 0.0 110.537 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.43 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -69.39 -30.16 68.08 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.097 -177.314 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -71.35 -37.99 71.66 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 121.216 0.531 . . . . 0.0 109.621 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.478 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 2.6 mm? -78.44 -35.45 46.82 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.471 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -58.16 -43.39 87.38 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.222 0.609 . . . . 0.0 111.547 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.1 pt20 -81.85 -14.42 56.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.311 0.577 . . . . 0.0 110.141 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -84.87 -88.82 0.87 Allowed Glycine 0 N--CA 1.428 -1.848 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.262 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -125.79 -18.34 5.18 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.28 0.562 . . . . 0.0 111.873 -175.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.478 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 127.45 -104.2 0.68 Allowed Glycine 0 CA--C 1.476 -2.355 0 N-CA-C 106.713 -2.555 . . . . 0.0 106.713 -171.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.33 -32.21 1.15 Allowed Glycine 0 C--O 1.196 -2.247 0 N-CA-C 115.634 1.013 . . . . 0.0 115.634 170.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -47.36 -34.27 6.77 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.504 1.122 . . . . 0.0 112.291 -178.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.403 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 10.7 pt20 -68.91 -45.08 71.8 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.528 178.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.431 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 4.1 pt20 -82.93 -47.18 12.07 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 121.074 0.464 . . . . 0.0 110.171 -176.156 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.404 ' CG1' ' HA ' ' A' ' 37' ' ' THR . 91.5 t -59.41 -22.69 23.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 125.66 1.584 . . . . 0.0 110.224 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -43.02 -45.12 5.02 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.165 0.986 . . . . 0.0 112.67 178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.431 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 3.7 pt20 -68.63 -17.77 64.17 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.434 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 7.7 tpt -101.96 -47.34 4.6 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.8 p -65.05 -24.13 34.79 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 120.831 0.348 . . . . 0.0 111.354 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.471 ' HA ' HE21 ' A' ' 104' ' ' GLN . 15.2 ptpt -62.3 -24.82 67.52 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.748 -0.595 . . . . 0.0 110.956 174.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.419 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 26.3 mtpp -63.55 -30.9 71.95 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.475 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -59.9 -38.72 83.06 Favored 'General case' 0 C--O 1.204 -1.34 0 O-C-N 123.722 0.638 . . . . 0.0 109.861 176.09 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.471 HE21 ' HA ' ' A' ' 101' ' ' LYS . 38.6 mt-30 -72.79 -16.9 61.62 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.632 -177.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 43.4 mtt -82.23 -21.2 36.47 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.879 -0.513 . . . . 0.0 110.517 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 7.5 mp -47.43 -46.59 58.59 Favored Pre-proline 0 N--CA 1.481 1.076 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.3 -22.38 74.03 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 120.897 1.356 . . . . 0.0 112.871 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 61.7 m-80 -89.35 -42.79 11.35 Favored 'General case' 0 N--CA 1.403 -2.799 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -73.56 -36.74 65.64 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.831 -177.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.402 ' SG ' HD21 ' A' ' 112' ' ' LEU . 16.1 t -89.94 -3.8 57.84 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 60.3 t30 55.43 63.4 2.1 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 124.779 1.232 . . . . 0.0 110.276 -177.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.422 ' C ' ' H ' ' A' ' 114' ' ' CYS . 52.4 mt -93.28 159.75 15.13 Favored 'General case' 0 C--N 1.284 -2.276 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.305 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -70.43 35.03 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.392 1.077 . . . . 0.0 113.405 -175.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.422 ' H ' ' C ' ' A' ' 112' ' ' LEU . 57.4 m -158.02 156.4 31.05 Favored 'General case' 0 C--N 1.284 -2.249 0 C-N-CA 125.171 1.388 . . . . 0.0 107.284 -175.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 42.1 m -142.46 120.95 12.45 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 67.7 mt . . . . . 0 C--N 1.299 -1.619 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 177.36 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 N--CA 1.443 -0.82 0 CA-C-O 120.58 0.229 . . . . 0.0 110.46 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 43.2 p -90.29 158.06 17.36 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 175.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -87.26 72.0 9.93 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.0 p -145.73 159.42 43.19 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 75.3 mt -128.83 117.24 19.38 Favored Pre-proline 0 C--N 1.299 -1.598 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -71.49 146.35 85.12 Favored 'Cis proline' 0 C--O 1.242 0.694 0 C-N-CA 124.109 -1.205 . . . . 0.0 112.3 0.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -71.97 145.83 45.94 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.619 2.213 . . . . 0.0 113.083 -177.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.6 mm -96.2 108.78 21.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.7 m . . . . . 0 C--N 1.295 -1.79 0 CA-C-O 121.473 0.654 . . . . 0.0 112.271 -175.999 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.457 ' SG ' ' HG3' ' A' ' 73' ' ' GLU . 95.2 m . . . . . 0 N--CA 1.405 -2.694 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -106.2 113.06 26.36 Favored 'General case' 0 C--N 1.288 -2.099 0 CA-C-O 122.036 0.922 . . . . 0.0 108.82 173.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.449 ' N ' HD11 ' A' ' 24' ' ' ILE . 3.3 mp -106.94 146.08 13.72 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.504 0 CA-C-N 114.116 -1.402 . . . . 0.0 107.785 -174.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.458 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 34.2 ptt180 -65.64 120.16 12.44 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-O 121.551 0.691 . . . . 0.0 109.171 -178.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 pp -69.88 -15.98 19.84 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.466 -175.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -71.67 -23.21 61.62 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.488 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.473 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 6.9 pt20 -83.83 -18.8 36.37 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.587 -178.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -94.31 -4.06 49.36 Favored 'General case' 0 CA--C 1.48 -1.719 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.236 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.532 ' O ' ' HG2' ' A' ' 34' ' ' MET . 3.4 t-20 -57.15 -32.02 65.96 Favored 'General case' 0 C--N 1.317 -0.816 0 O-C-N 123.89 0.744 . . . . 0.0 110.646 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -69.53 -53.74 17.54 Favored 'General case' 0 C--O 1.221 -0.406 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -55.61 -51.69 66.3 Favored 'General case' 0 C--O 1.222 -0.393 0 O-C-N 123.605 0.566 . . . . 0.0 109.832 178.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.0 tt0 -51.77 -56.58 13.02 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 123.899 0.88 . . . . 0.0 112.468 176.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.532 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 26.6 ptm -69.92 -42.87 72.75 Favored 'General case' 0 CA--C 1.504 -0.81 0 C-N-CA 119.967 -0.693 . . . . 0.0 112.263 -174.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.413 ' CE1' ' HD1' ' A' ' 55' ' ' HIS . 2.0 t-80 -67.35 -27.12 66.86 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.916 -175.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 94.8 mt -88.63 -28.48 20.62 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 112.17 0.434 . . . . 0.0 112.17 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.405 ' HA ' HG11 ' A' ' 96' ' ' VAL . 35.2 p -84.64 -21.67 30.18 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 118.233 -1.387 . . . . 0.0 111.451 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.8 p -91.36 121.65 33.28 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 . . . . . 0 C--N 1.3 -1.584 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 166.889 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.413 ' HD1' ' CE1' ' A' ' 35' ' ' HIS . 1.8 p-80 . . . . . 0 N--CA 1.434 -1.228 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -70.3 -44.89 67.41 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 175.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 51.0 m -57.37 -36.3 71.06 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 123.563 0.54 . . . . 0.0 110.574 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.9 mt -80.85 -53.19 6.69 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.627 -178.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 19.6 t -66.2 -48.34 70.95 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.198 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.503 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 32.8 t -58.46 -34.23 70.63 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 117.868 0.304 . . . . 0.0 110.653 176.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -76.41 -24.68 54.02 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.626 0.727 . . . . 0.0 110.6 -178.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.473 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 6.1 tp-100 -85.58 -46.88 10.39 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.639 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.503 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.9 pp -64.27 -31.61 72.88 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.673 -177.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.413 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 7.3 pt20 -70.87 -10.28 59.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.641 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -75.87 -21.07 57.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 122.062 0.934 . . . . 0.0 108.841 176.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 8.9 t -82.26 163.61 3.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 176.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 31.9 mt-10 -54.84 144.07 23.8 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-O 119.268 -0.396 . . . . 0.0 110.695 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.433 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 18.1 ptpt -57.8 -31.78 66.9 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -77.18 -20.17 55.79 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.075 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.421 ' HA ' ' CG ' ' A' ' 73' ' ' GLU . 63.0 m -103.97 -10.67 17.94 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.866 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.582 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 29.2 mt-30 -62.82 -37.76 88.03 Favored 'General case' 0 C--O 1.217 -0.637 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.415 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.8 p -80.96 -24.51 38.03 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.549 176.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.457 ' HG3' ' SG ' ' A' ' 22' ' ' CYS . 8.4 mm-40 -67.22 -36.1 80.97 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 177.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.1 -28.5 69.13 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 123.577 0.751 . . . . 0.0 110.645 178.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.415 HG12 ' HA ' ' A' ' 72' ' ' CYS . 31.5 mm -69.68 -37.51 74.16 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.598 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -65.55 -41.11 93.36 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -177.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.8 mt-30 -61.03 -38.63 86.82 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 113.505 -1.68 . . . . 0.0 110.621 -178.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 20.8 t -61.11 -44.58 98.58 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.906 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 29.0 t -65.63 -47.77 84.99 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.894 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -174.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -58.68 -50.63 73.15 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.68 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 11.0 pt20 -71.82 -31.72 66.83 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.835 0.35 . . . . 0.0 111.886 -177.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.72 -38.23 54.67 Favored 'General case' 0 C--N 1.315 -0.908 0 O-C-N 122.131 -0.356 . . . . 0.0 111.307 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -72.95 -34.08 66.3 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.357 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.555 ' O ' ' HG2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -70.67 -38.12 73.74 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.46 -178.156 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.4 ' N ' ' HD3' ' A' ' 84' ' ' LYS . 3.3 pt20 -68.07 -37.97 81.87 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.136 -175.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.454 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.6 mm? -76.64 -33.73 58.33 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.872 178.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.411 ' HB2' ' NE2' ' A' ' 93' ' ' GLN . 10.0 tt0 -64.85 -37.3 87.16 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.252 0.549 . . . . 0.0 110.509 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 84' ' ' LYS . 4.6 pt20 -90.49 0.33 57.36 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.667 0.746 . . . . 0.0 110.422 178.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -99.29 -100.6 2.26 Favored Glycine 0 N--CA 1.421 -2.337 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.896 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -118.18 -5.88 10.89 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.008 0.432 . . . . 0.0 112.025 -174.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.454 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 116.57 -101.37 0.97 Allowed Glycine 0 CA--C 1.468 -2.867 0 N-CA-C 106.825 -2.51 . . . . 0.0 106.825 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 72.4 -34.81 0.67 Allowed Glycine 0 C--O 1.196 -2.229 0 N-CA-C 116.082 1.193 . . . . 0.0 116.082 170.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.411 ' NE2' ' HB2' ' A' ' 87' ' ' GLN . 90.8 mt-30 -46.53 -34.25 4.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 118.322 1.061 . . . . 0.0 112.866 -176.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -71.41 -42.19 68.63 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 120.982 0.42 . . . . 0.0 111.449 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -82.83 -47.88 11.39 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 -176.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.405 HG11 ' HA ' ' A' ' 37' ' ' THR . 80.7 t -59.04 -22.83 22.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 125.461 1.504 . . . . 0.0 110.725 178.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -44.48 -46.15 9.56 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 123.562 0.745 . . . . 0.0 112.502 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -67.57 -18.02 64.85 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -176.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.8 tpt -102.29 -48.24 4.25 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.0 p -63.72 -24.09 34.96 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 CA-C-O 121.06 0.457 . . . . 0.0 111.183 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.486 ' HA ' HE21 ' A' ' 104' ' ' GLN . 0.0 OUTLIER -65.49 -21.02 66.59 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.703 -0.623 . . . . 0.0 111.539 176.228 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -67.33 -27.89 67.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 176.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.449 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -62.99 -32.11 73.38 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 121.599 0.714 . . . . 0.0 109.807 175.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.486 HE21 ' HA ' ' A' ' 101' ' ' LYS . 43.8 mt-30 -74.4 -15.46 60.92 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.645 -178.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 61.2 mtp -90.33 -18.29 25.81 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.793 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.449 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 96.4 mt -50.25 -51.23 65.0 Favored Pre-proline 0 C--N 1.323 -0.544 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -176.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.401 ' HA ' ' CG ' ' A' ' 112' ' ' LEU . 18.0 Cg_endo -60.79 -24.92 80.13 Favored 'Trans proline' 0 C--N 1.362 1.282 0 C-N-CA 121.73 1.62 . . . . 0.0 113.169 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -84.47 -41.0 17.03 Favored 'General case' 0 N--CA 1.414 -2.251 0 CA-C-O 121.157 0.503 . . . . 0.0 109.822 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -80.37 -37.32 32.58 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.123 -176.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.403 ' SG ' HD23 ' A' ' 112' ' ' LEU . 24.2 t -84.38 -6.04 59.34 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.199 0.524 . . . . 0.0 109.693 -178.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 57.45 65.03 1.43 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 122.989 1.376 . . . . 0.0 110.784 -177.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.412 ' C ' ' H ' ' A' ' 114' ' ' CYS . 41.9 mt -93.67 159.41 15.23 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 113.272 -1.785 . . . . 0.0 109.363 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -75.88 35.79 0.13 Allowed 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 121.658 0.742 . . . . 0.0 112.094 -174.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.412 ' H ' ' C ' ' A' ' 112' ' ' LEU . 78.7 m -154.0 149.06 26.82 Favored 'General case' 0 C--N 1.285 -2.23 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 -176.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 25.7 p -136.1 132.38 36.04 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 118.114 0.416 . . . . 0.0 110.189 -176.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 26.6 mm . . . . . 0 C--N 1.308 -1.205 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 178.738 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 58.3 m . . . . . 0 N--CA 1.42 -1.972 0 CA-C-O 121.002 0.43 . . . . 0.0 110.288 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.9 p -71.27 151.11 44.55 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.773 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -79.12 72.0 5.65 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.359 0.6 . . . . 0.0 110.355 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.9 t -149.08 163.92 36.17 Favored 'General case' 0 N--CA 1.419 -2.02 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.3 mt -129.75 118.82 18.87 Favored Pre-proline 0 C--N 1.304 -1.391 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -75.32 140.93 69.67 Favored 'Cis proline' 0 C--O 1.243 0.727 0 C-N-CA 123.809 -1.329 . . . . 0.0 110.876 -1.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.08 152.01 80.76 Favored 'Trans proline' 0 C--O 1.244 0.79 0 C-N-CA 122.954 2.436 . . . . 0.0 113.21 -175.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.7 mm -102.81 118.26 49.45 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 75.8 m . . . . . 0 C--N 1.29 -1.983 0 CA-C-O 121.62 0.724 . . . . 0.0 111.625 -176.807 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.7 m . . . . . 0 N--CA 1.416 -2.153 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -99.95 91.74 4.95 Favored 'General case' 0 N--CA 1.422 -1.831 0 CA-C-O 122.439 1.114 . . . . 0.0 110.978 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.5 mp -94.14 138.39 20.67 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.818 0 N-CA-C 105.328 -2.101 . . . . 0.0 105.328 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.45 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.5 ptt-85 -71.66 120.54 17.39 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.057 0.456 . . . . 0.0 110.0 -176.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -63.53 -16.31 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-O 121.288 0.566 . . . . 0.0 112.236 -176.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -77.14 -17.74 58.4 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.62 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.6 pt20 -86.62 -29.2 22.74 Favored 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 119.401 -0.919 . . . . 0.0 108.544 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -85.11 -7.79 58.93 Favored 'General case' 0 CA--C 1.473 -2.004 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.491 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.43 ' O ' ' HG2' ' A' ' 34' ' ' MET . 8.6 t30 -54.12 -34.84 61.32 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 124.335 1.022 . . . . 0.0 110.889 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -69.06 -55.12 11.74 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -52.29 -53.74 40.27 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 125.114 1.366 . . . . 0.0 108.347 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -49.55 -61.34 2.16 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 126.101 1.76 . . . . 0.0 112.45 175.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.43 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.3 ptm -69.82 -28.69 65.91 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -173.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.613 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 3.0 t-80 -72.48 -25.72 61.53 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-O 121.139 0.495 . . . . 0.0 109.834 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.5 mt -88.52 -32.17 18.33 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.41 177.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 58.9 p -82.75 -22.14 34.45 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 118.622 -1.231 . . . . 0.0 111.785 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.8 t -90.94 127.73 36.51 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.256 0.551 . . . . 0.0 111.934 -178.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 . . . . . 0 N--CA 1.423 -1.791 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 171.16 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.613 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--O 1.212 -0.906 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.3 tp -72.22 -52.03 18.33 Favored 'General case' 0 CA--C 1.489 -1.403 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.0 m -59.23 -21.76 60.05 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.614 -176.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 41.1 mt -89.76 -57.66 2.79 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.014 175.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 52.2 t -64.39 -50.51 67.39 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.155 0.982 . . . . 0.0 112.372 -175.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.547 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 12.1 t -59.23 -39.68 83.52 Favored 'General case' 0 CA--C 1.495 -1.145 0 CA-C-O 121.613 0.721 . . . . 0.0 109.281 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.421 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 27.9 t-20 -70.77 -28.03 64.36 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.956 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -81.13 -42.56 20.73 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.325 0.583 . . . . 0.0 110.446 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.547 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.7 pp -72.25 -31.65 65.99 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.908 -176.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.421 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 17.6 pt20 -68.9 -15.16 63.42 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.711 -176.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -81.7 -22.67 37.28 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.7 t -70.75 161.65 4.54 Favored 'Isoleucine or valine' 0 C--O 1.249 1.026 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.431 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.3 mt-10 -50.09 140.63 12.29 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 123.417 0.687 . . . . 0.0 112.298 178.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -55.17 -33.31 62.86 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.111 0.564 . . . . 0.0 112.471 -177.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -81.9 -7.35 59.6 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.068 0.461 . . . . 0.0 110.576 -178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 61.3 m -117.5 -11.28 10.51 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -174.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 75.9 mt-30 -57.96 -48.54 79.64 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.258 0.623 . . . . 0.0 112.03 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 14.7 p -74.82 -23.12 58.42 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.804 -0.759 . . . . 0.0 112.145 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -68.3 -32.54 72.75 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.613 0.721 . . . . 0.0 109.614 178.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.464 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -59.43 -28.75 67.24 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.704 177.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.449 ' O ' HG22 ' A' ' 79' ' ' VAL . 27.8 mm -70.98 -32.95 50.03 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -176.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -66.46 -44.14 83.58 Favored 'General case' 0 CA--C 1.491 -1.32 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 -177.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.507 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.3 mt-30 -59.16 -46.22 88.95 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 113.103 -1.862 . . . . 0.0 110.349 -177.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.464 HG22 ' O ' ' A' ' 74' ' ' ALA . 19.6 t -53.42 -44.7 56.08 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 O-C-N 124.211 0.944 . . . . 0.0 110.138 -179.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 75' ' ' ILE . 26.1 t -70.12 -45.04 77.5 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -175.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -60.04 -52.58 64.75 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.678 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 20.7 pt20 -70.61 -31.76 68.86 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.855 -176.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.452 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -72.11 -41.46 67.21 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.76 0.314 . . . . 0.0 111.193 178.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.5 pt20 -72.1 -37.84 69.47 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 119.99 -0.684 . . . . 0.0 110.089 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.432 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -68.77 -32.34 72.01 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -178.097 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 1.7 pt20 -71.19 -28.84 64.51 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 121.683 0.754 . . . . 0.0 109.755 -177.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.515 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.7 mm? -86.29 -37.28 18.7 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.965 176.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -58.18 -36.45 73.07 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.925 1.29 . . . . 0.0 111.333 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -80.19 -9.89 59.74 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-O 121.018 0.437 . . . . 0.0 111.302 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -113.82 -115.57 3.21 Favored Glycine 0 N--CA 1.43 -1.732 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.017 -177.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -71.24 -43.26 67.62 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 124.198 0.999 . . . . 0.0 111.371 -174.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.515 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 142.68 -85.95 0.19 Allowed Glycine 0 CA--C 1.478 -2.224 0 N-CA-C 107.007 -2.437 . . . . 0.0 107.007 -171.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.457 ' HA3' HD11 ' A' ' 86' ' ' LEU . . . 74.18 -44.55 1.36 Allowed Glycine 0 C--O 1.199 -2.08 0 N-CA-C 115.531 0.972 . . . . 0.0 115.531 171.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.455 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 56.2 mt-30 -44.37 -30.94 0.92 Allowed 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 125.292 1.437 . . . . 0.0 113.677 -176.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -75.88 -41.3 52.54 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 120.819 0.342 . . . . 0.0 111.321 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -85.51 -43.88 13.17 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.62 0.724 . . . . 0.0 110.227 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 75.9 t -63.81 -22.72 31.62 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 C-N-CA 125.781 1.632 . . . . 0.0 110.547 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 64.5 tt0 -45.48 -45.65 13.22 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.478 0.711 . . . . 0.0 112.844 -178.135 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -67.25 -21.97 65.71 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -177.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.9 tpt -94.94 -49.55 5.51 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -176.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.9 p -61.51 -28.31 43.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.813 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -24.45 65.21 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 177.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -62.46 -38.03 88.22 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.41 ' HA ' HD13 ' A' ' 106' ' ' LEU . . . -52.07 -35.55 47.91 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.581 178.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -68.14 -17.25 64.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.134 0.492 . . . . 0.0 111.239 -178.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 40.8 mtt -91.81 -14.57 29.57 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.423 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 6.9 mp -53.16 -45.49 98.25 Favored Pre-proline 0 C--O 1.207 -1.182 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.423 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 19.6 Cg_endo -61.52 -26.49 80.88 Favored 'Trans proline' 0 C--N 1.358 1.07 0 CA-C-N 121.067 1.417 . . . . 0.0 112.125 176.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -83.51 -42.87 16.38 Favored 'General case' 0 N--CA 1.417 -2.124 0 CA-C-O 121.277 0.56 . . . . 0.0 110.277 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -79.92 -38.89 31.48 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -176.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 19.6 t -80.77 -5.73 57.55 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 45.4 t30 64.32 58.82 1.07 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 122.952 1.358 . . . . 0.0 109.873 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 49.5 mt -100.23 158.43 15.87 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-N 113.536 -1.666 . . . . 0.0 108.228 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -82.83 45.53 1.01 Allowed 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.62 0.724 . . . . 0.0 111.194 -174.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 48.7 m -157.35 160.55 38.59 Favored 'General case' 0 C--N 1.292 -1.893 0 C-N-CA 124.994 1.318 . . . . 0.0 107.889 -176.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.8 m -149.36 135.77 19.25 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 176.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 81.0 mt . . . . . 0 C--N 1.304 -1.402 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -178.673 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 62.7 m . . . . . 0 N--CA 1.432 -1.345 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.3 p -84.6 156.56 21.53 Favored 'General case' 0 C--N 1.296 -1.727 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -79.81 74.57 6.53 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 122.082 0.944 . . . . 0.0 109.595 174.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 47.5 t -136.92 157.72 46.1 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.101 -1.409 . . . . 0.0 107.286 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.6 mm -128.51 109.65 19.15 Favored Pre-proline 0 C--N 1.294 -1.819 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 176.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -73.97 150.81 96.17 Favored 'Cis proline' 0 C--O 1.253 1.271 0 C-N-CA 124.177 -1.176 . . . . 0.0 111.322 -3.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.18 150.84 66.2 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.722 2.281 . . . . 0.0 113.178 -175.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.405 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 46.9 mm -97.31 114.19 33.73 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 82.3 m . . . . . 0 C--N 1.288 -2.107 0 CA-C-O 121.277 0.56 . . . . 0.0 111.522 -176.967 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 29.9 m . . . . . 0 N--CA 1.421 -1.922 0 CA-C-O 121.036 0.446 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -106.54 109.83 21.87 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-O 121.819 0.819 . . . . 0.0 108.882 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.743 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 2.7 mp -115.02 143.72 24.14 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.107 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.558 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 18.6 ptt180 -71.61 122.12 19.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.81 -13.34 16.69 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.045 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -75.72 -18.88 59.43 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.9 -178.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.558 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.4 pt20 -81.13 -16.97 51.51 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.525 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.412 ' HB3' HG21 ' A' ' 78' ' ' VAL . 2.2 mm? -96.59 2.59 52.42 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.138 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.461 ' OD1' ' HE1' ' A' ' 34' ' ' MET . 28.6 t-20 -52.52 -39.27 61.17 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 124.343 1.027 . . . . 0.0 112.223 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -69.2 -54.78 13.07 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.2 m -55.13 -47.25 75.32 Favored 'General case' 0 C--O 1.221 -0.418 0 O-C-N 123.467 0.48 . . . . 0.0 110.652 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -54.55 -55.39 29.79 Favored 'General case' 0 N--CA 1.437 -1.095 0 C-N-CA 123.457 0.703 . . . . 0.0 112.335 176.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.461 ' HE1' ' OD1' ' A' ' 30' ' ' ASN . 14.2 ptp -68.43 -41.74 79.88 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -176.26 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -70.25 -25.41 63.36 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.057 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.444 ' O ' ' HB3' ' A' ' 99' ' ' MET . 86.9 mt -88.33 -25.13 22.92 Favored 'General case' 0 C--O 1.214 -0.816 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 177.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.452 ' CG2' ' HB2' ' A' ' 82' ' ' ALA . 29.9 p -87.78 -21.57 25.04 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 117.919 -1.512 . . . . 0.0 111.333 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.2 m -90.63 143.47 26.71 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.558 174.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.46 ' CZ ' ' HA ' ' A' ' 96' ' ' VAL . 48.8 m-85 . . . . . 0 C--N 1.299 -1.619 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 . . . . . 0 C--O 1.206 -1.19 0 CA-C-O 120.485 0.184 . . . . 0.0 111.267 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -78.5 -46.15 20.29 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -178.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.9 m -55.06 -33.37 62.68 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.471 0.653 . . . . 0.0 110.519 178.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.3 mt -82.95 -56.13 3.99 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.858 178.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.8 t -58.68 -49.42 77.61 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.196 0.999 . . . . 0.0 111.348 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.483 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 38.5 t -57.82 -37.08 73.18 Favored 'General case' 0 C--O 1.212 -0.903 0 C-N-CA 123.028 0.531 . . . . 0.0 110.839 178.162 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.42 ' HA ' HE21 ' A' ' 64' ' ' GLN . 12.5 t30 -76.42 -25.32 54.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.872 0.844 . . . . 0.0 110.816 -177.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.518 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 6.3 tp-100 -79.61 -48.61 13.49 Favored 'General case' 0 C--N 1.283 -2.311 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.369 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.483 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.9 pp -69.05 -31.7 70.66 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.866 -177.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.42 HE21 ' HA ' ' A' ' 61' ' ' ASN . 25.6 pt20 -71.92 -11.18 60.66 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -176.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.35 -10.23 57.77 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.929 0.871 . . . . 0.0 109.785 175.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -82.73 163.68 2.98 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 172.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.569 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 27.7 mm-40 -50.55 149.4 3.21 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-N 118.101 0.409 . . . . 0.0 112.023 174.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -62.51 -38.4 89.8 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.779 -171.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -76.3 -19.59 58.12 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-O 121.534 0.683 . . . . 0.0 110.158 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 57.2 m -98.83 -11.5 21.72 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.541 -176.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.569 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 29.2 mt-30 -62.19 -38.84 90.65 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-O 121.414 0.626 . . . . 0.0 109.365 176.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.6 p -80.31 -24.84 39.68 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.125 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -71.32 -29.89 65.56 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.597 178.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.71 -30.44 71.54 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.42 176.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 31.4 mm -69.45 -33.94 59.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.539 -179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -65.78 -41.11 92.41 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 -177.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.743 ' NE2' ' HB ' ' A' ' 24' ' ' ILE . 9.0 mt-30 -65.49 -33.13 75.2 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.743 -177.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.412 HG21 ' HB3' ' A' ' 29' ' ' LEU . 22.0 t -58.66 -46.7 90.26 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.03 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.485 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 42.7 t -64.46 -50.61 75.34 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.167 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 -176.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -50.5 -47.51 57.27 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.996 -1.457 . . . . 0.0 112.276 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.64 ' HA ' ' CD ' ' A' ' 84' ' ' LYS . 29.6 pt20 -83.1 -32.91 26.5 Favored 'General case' 0 N--CA 1.432 -1.342 0 C-N-CA 119.531 -0.868 . . . . 0.0 113.272 -176.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.452 ' HB2' ' CG2' ' A' ' 37' ' ' THR . . . -71.27 -32.8 69.13 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-O 121.057 0.456 . . . . 0.0 110.493 -178.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 4.4 pt20 -74.1 -43.24 58.37 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.167 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.64 ' CD ' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -72.78 -25.08 61.04 Favored 'General case' 0 CA--C 1.498 -1.047 0 C-N-CA 118.197 -1.401 . . . . 0.0 111.824 -175.333 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -71.03 -34.12 70.99 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 119.777 -0.769 . . . . 0.0 109.863 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.16 -31.47 25.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.802 177.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -63.18 -38.32 90.71 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 122.871 0.469 . . . . 0.0 111.903 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -87.94 4.08 46.18 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.433 0.635 . . . . 0.0 112.156 -174.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -101.72 -130.65 7.1 Favored Glycine 0 C--N 1.286 -2.249 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.433 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -93.81 -8.1 41.45 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.647 0.737 . . . . 0.0 110.435 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.62 -150.65 17.32 Favored Glycine 0 N--CA 1.422 -2.28 0 N-CA-C 108.716 -1.754 . . . . 0.0 108.716 -176.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 112.91 -19.91 20.4 Favored Glycine 0 C--O 1.189 -2.671 0 C-N-CA 119.723 -1.227 . . . . 0.0 111.079 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -51.38 -37.66 49.31 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 124.088 0.955 . . . . 0.0 111.252 -177.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -76.92 -33.25 57.76 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.014 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.409 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 29.8 pt20 -83.17 -44.51 14.97 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.349 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.46 ' HA ' ' CZ ' ' A' ' 39' ' ' PHE . 93.2 t -64.2 -22.54 31.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 C-N-CA 125.537 1.535 . . . . 0.0 110.687 177.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -45.95 -45.39 15.56 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.471 1.108 . . . . 0.0 112.285 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.8 pt20 -65.25 -18.75 65.56 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -178.214 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.444 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 3.6 tpt -98.87 -45.92 5.82 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.86 -25.02 36.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 120.891 0.376 . . . . 0.0 111.253 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -63.21 -22.66 67.01 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.374 -0.829 . . . . 0.0 111.831 174.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -66.45 -25.99 66.99 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 122.393 0.277 . . . . 0.0 110.444 175.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.471 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -60.97 -30.25 70.15 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 121.564 0.697 . . . . 0.0 110.487 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -70.51 -19.82 62.89 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.188 -178.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 56.0 mtp -92.4 -15.07 27.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.67 -178.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.516 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 97.5 mt -55.78 -45.93 99.81 Favored Pre-proline 0 C--N 1.317 -0.819 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.226 -178.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 14.5 Cg_endo -58.25 -25.01 70.28 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 122.222 1.948 . . . . 0.0 113.195 174.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.05 -47.71 13.19 Favored 'General case' 0 N--CA 1.419 -1.991 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -67.29 -38.45 85.04 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.595 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.437 ' SG ' HD22 ' A' ' 112' ' ' LEU . 15.9 t -90.33 -4.11 57.32 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-O 120.832 0.349 . . . . 0.0 110.336 -177.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 60.31 60.67 1.97 Allowed 'General case' 0 N--CA 1.477 0.916 0 CA-C-O 122.783 1.278 . . . . 0.0 109.67 -178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.464 ' C ' ' H ' ' A' ' 114' ' ' CYS . 38.5 mt -91.65 160.06 15.56 Favored 'General case' 0 C--N 1.286 -2.192 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.133 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -70.0 26.96 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.477 1.111 . . . . 0.0 112.753 -177.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.464 ' H ' ' C ' ' A' ' 112' ' ' LEU . 85.2 m -157.66 158.81 36.15 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 -173.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.7 p -150.99 130.41 12.9 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 48.5 mt . . . . . 0 C--N 1.309 -1.153 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -178.119 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 63.1 m . . . . . 0 N--CA 1.435 -1.205 0 CA-C-O 120.88 0.372 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.3 p -79.43 161.29 26.22 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.825 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -88.11 66.44 8.54 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.725 0.774 . . . . 0.0 109.312 177.285 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 64.8 p -138.57 160.16 40.29 Favored 'General case' 0 N--CA 1.42 -1.967 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.0 mm -128.77 112.85 18.98 Favored Pre-proline 0 C--N 1.302 -1.488 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 176.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -72.62 154.2 98.89 Favored 'Cis proline' 0 CA--C 1.547 1.139 0 C-N-CA 123.716 -1.368 . . . . 0.0 112.228 -0.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.88 150.85 30.76 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 122.264 1.976 . . . . 0.0 113.022 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -98.6 113.07 32.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 105.674 -1.972 . . . . 0.0 105.674 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 80.9 m . . . . . 0 C--N 1.3 -1.578 0 CA-C-O 121.592 0.711 . . . . 0.0 111.963 -177.042 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 32.8 m . . . . . 0 N--CA 1.423 -1.776 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -100.51 110.17 22.33 Favored 'General case' 0 N--CA 1.414 -2.271 0 C-N-CA 118.165 -1.414 . . . . 0.0 108.817 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 mp -111.92 137.58 44.06 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.899 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 178.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.473 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 13.9 ptp180 -67.25 116.55 8.15 Favored 'General case' 0 N--CA 1.417 -2.111 0 CA-C-O 121.783 0.802 . . . . 0.0 109.335 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.644 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -67.69 -13.75 17.28 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.958 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.257 -174.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -77.43 -16.55 58.74 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.637 -178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.1 pt20 -85.92 -20.31 29.19 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 119.116 -1.034 . . . . 0.0 109.29 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.437 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.5 mm? -91.54 -2.9 57.01 Favored 'General case' 0 CA--C 1.483 -1.607 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.52 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.451 ' HA ' HE21 ' A' ' 33' ' ' GLN . 36.2 t-20 -51.38 -35.4 38.6 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.58 -1.191 . . . . 0.0 110.959 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 t-160 -69.76 -54.42 13.77 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.433 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.7 OUTLIER -54.08 -52.21 61.67 Favored 'General case' 0 C--O 1.22 -0.487 0 O-C-N 123.737 0.648 . . . . 0.0 109.92 178.112 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.451 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.2 tt0 -50.31 -60.06 3.35 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.053 0.941 . . . . 0.0 112.44 177.208 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.9 ptt? -68.13 -39.54 82.68 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.682 -172.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -70.9 -26.26 63.14 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.282 -175.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 90.6 mt -87.62 -27.73 22.32 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.403 ' HA ' HG12 ' A' ' 96' ' ' VAL . 39.9 p -86.01 -22.02 27.5 Favored 'General case' 0 N--CA 1.422 -1.836 0 C-N-CA 118.032 -1.467 . . . . 0.0 111.787 179.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.9 p -90.89 148.07 22.72 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.414 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 . . . . . 0 N--CA 1.417 -2.119 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.927 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 . . . . . 0 C--O 1.209 -1.047 0 CA-C-O 120.651 0.262 . . . . 0.0 111.423 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -77.91 -43.07 31.13 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.4 m -56.84 -34.6 67.92 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 123.655 0.597 . . . . 0.0 110.123 177.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 50.5 mt -79.75 -56.14 4.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.191 177.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 22.7 t -58.97 -49.27 78.49 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 124.186 0.994 . . . . 0.0 111.846 -175.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.495 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.7 t -58.99 -34.39 71.78 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 122.838 0.455 . . . . 0.0 110.651 177.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -77.53 -23.49 50.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.603 0.716 . . . . 0.0 110.852 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -83.17 -47.88 11.12 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.514 178.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.495 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.7 pp -66.48 -31.57 72.4 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.425 0.631 . . . . 0.0 111.014 -177.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.53 -14.6 63.12 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.134 -177.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -77.25 -22.91 51.45 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.453 0.644 . . . . 0.0 109.312 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.2 t -74.78 161.73 4.72 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.088 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.576 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 38.3 mt-10 -53.46 144.01 17.98 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -55.54 -31.24 61.95 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.99 0.916 . . . . 0.0 112.087 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.561 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.9 pt20 -84.94 -5.08 59.35 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.744 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.561 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 61.5 m -125.61 -6.27 6.93 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.991 -175.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.576 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 99.0 mt-30 -61.97 -41.88 98.51 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.433 0.635 . . . . 0.0 109.93 177.108 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 6.0 p -78.28 -23.55 47.17 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.329 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -72.0 -30.96 65.76 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.269 177.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.509 ' HA ' ' HG3' ' A' ' 77' ' ' GLN . . . -60.77 -24.27 65.64 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.267 176.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.479 ' O ' HG23 ' A' ' 79' ' ' VAL . 32.6 mm -74.31 -29.97 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.683 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -71.54 -39.19 70.85 Favored 'General case' 0 CA--C 1.489 -1.383 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 -176.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.509 ' HG3' ' HA ' ' A' ' 74' ' ' ALA . 44.0 mm-40 -56.16 -46.75 79.19 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 112.286 -2.234 . . . . 0.0 109.075 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.437 HG22 ' HB3' ' A' ' 29' ' ' LEU . 12.2 t -57.89 -46.25 87.47 Favored 'Isoleucine or valine' 0 C--N 1.354 0.786 0 O-C-N 124.297 0.998 . . . . 0.0 109.667 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 75' ' ' ILE . 23.6 t -67.49 -41.3 85.84 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.813 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.898 -173.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -60.83 -52.83 63.42 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.107 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.644 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.1 pt20 -68.89 -37.27 78.9 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -176.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.62 -37.14 73.77 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 120.903 0.382 . . . . 0.0 111.508 -177.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -75.72 -38.43 58.55 Favored 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.233 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.472 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -67.34 -33.17 74.69 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 120.593 0.235 . . . . 0.0 111.07 -177.197 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.472 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 2.2 pt20 -72.2 -29.82 64.35 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.073 0.463 . . . . 0.0 110.769 -176.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -87.14 -33.11 19.53 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.534 0.683 . . . . 0.0 111.454 175.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -63.15 -36.5 83.82 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.256 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -81.99 -6.98 59.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.006 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -92.06 -133.08 5.97 Favored Glycine 0 N--CA 1.429 -1.827 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.161 -177.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -104.83 -18.95 14.05 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 120.891 0.377 . . . . 0.0 111.098 -176.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 154.61 -141.57 8.3 Favored Glycine 0 CA--C 1.477 -2.343 0 N-CA-C 109.159 -1.576 . . . . 0.0 109.159 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.06 -24.44 29.98 Favored Glycine 0 N--CA 1.424 -2.112 0 C-N-CA 120.358 -0.925 . . . . 0.0 113.267 176.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -54.05 -31.52 51.76 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -77.11 -35.17 56.57 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.327 179.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -83.99 -43.54 15.07 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.61 0.719 . . . . 0.0 109.68 -177.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.403 HG12 ' HA ' ' A' ' 37' ' ' THR . 95.4 t -63.04 -23.15 32.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.507 177.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -46.48 -43.73 16.94 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.675 0.79 . . . . 0.0 112.936 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -69.4 -17.94 63.71 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.098 0.475 . . . . 0.0 111.865 -177.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 5.9 tpt -102.06 -47.38 4.57 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.143 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.5 p -64.73 -24.03 34.7 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.692 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.469 ' HG3' ' N ' ' A' ' 102' ' ' LYS . 34.9 pttt -59.23 -26.96 65.32 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.778 -0.576 . . . . 0.0 110.711 173.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.469 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 26.0 mtpp -65.02 -28.71 69.68 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.412 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -61.43 -43.49 98.78 Favored 'General case' 0 C--O 1.197 -1.659 0 O-C-N 123.931 0.769 . . . . 0.0 108.959 174.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -70.67 -16.89 62.84 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.197 -178.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 27.3 mtm -91.39 -13.38 32.52 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.095 -0.378 . . . . 0.0 111.29 177.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.536 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 95.7 mt -50.64 -45.35 85.62 Favored Pre-proline 0 CA--C 1.543 0.698 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 16.0 Cg_endo -58.25 -24.54 67.96 Favored 'Trans proline' 0 C--N 1.367 1.53 0 C-N-CA 122.172 1.915 . . . . 0.0 112.86 176.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -85.62 -44.06 12.94 Favored 'General case' 0 N--CA 1.413 -2.307 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -73.21 -35.86 66.39 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.315 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 25.0 t -90.05 -3.83 57.73 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-O 121.331 0.586 . . . . 0.0 109.797 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 61.7 t30 62.37 50.86 3.57 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 122.736 1.255 . . . . 0.0 110.853 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 66.3 mt -89.54 158.61 17.59 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.712 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -80.3 43.79 0.65 Allowed 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 124.067 0.947 . . . . 0.0 112.06 -174.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 59.5 m -159.16 162.63 36.4 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.4 p -146.32 140.71 26.64 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 73.0 mt . . . . . 0 C--N 1.307 -1.262 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.48 -178.51 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 21.5 m . . . . . 0 N--CA 1.425 -1.677 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.4 p -78.58 146.16 34.36 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 175.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -87.82 69.82 9.54 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.676 0.75 . . . . 0.0 109.358 177.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.8 t -146.85 171.47 15.15 Favored 'General case' 0 N--CA 1.418 -2.074 0 N-CA-C 106.7 -1.592 . . . . 0.0 106.7 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 37.9 mm -128.84 119.83 20.21 Favored Pre-proline 0 C--N 1.305 -1.362 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -71.72 146.91 86.89 Favored 'Cis proline' 0 C--O 1.249 1.049 0 C-N-CA 123.751 -1.354 . . . . 0.0 111.645 -1.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -73.97 139.66 27.48 Favored 'Trans proline' 0 N--CA 1.445 -1.353 0 C-N-CA 122.252 1.968 . . . . 0.0 111.347 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.3 mm -106.18 115.54 48.05 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.8 t . . . . . 0 C--N 1.298 -1.644 0 C-N-CA 119.431 -0.908 . . . . 0.0 111.028 -176.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 64.0 m . . . . . 0 N--CA 1.417 -2.117 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -101.7 121.96 43.02 Favored 'General case' 0 N--CA 1.417 -2.124 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 173.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mp -122.26 134.41 65.58 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.395 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 -178.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.476 ' HG2' HE21 ' A' ' 28' ' ' GLN . 14.1 ptp180 -66.75 121.98 16.64 Favored 'General case' 0 N--CA 1.426 -1.655 0 O-C-N 123.913 0.758 . . . . 0.0 110.203 -173.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -64.13 -17.13 20.2 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.267 -175.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -75.94 -13.62 60.25 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.219 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.476 HE21 ' HG2' ' A' ' 25' ' ' ARG . 5.0 pt20 -96.46 -10.53 27.25 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.124 178.07 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -98.7 4.95 47.93 Favored 'General case' 0 CA--C 1.488 -1.42 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.18 176.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 34' ' ' MET . 7.8 t30 -50.57 -36.6 35.39 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.27 -1.332 . . . . 0.0 113.099 -179.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -72.23 -53.61 12.06 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -178.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -54.72 -51.36 65.84 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 124.493 1.121 . . . . 0.0 108.809 -178.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -52.25 -56.03 17.39 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 124.201 1.001 . . . . 0.0 112.792 176.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.498 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 15.6 ptp -67.88 -43.63 78.91 Favored 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 119.849 -0.74 . . . . 0.0 112.788 -175.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.429 ' HB3' ' HD1' ' A' ' 55' ' ' HIS . 4.1 m-70 -65.29 -25.34 67.59 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.472 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.406 ' O ' ' HB3' ' A' ' 99' ' ' MET . 93.1 mt -85.53 -32.54 22.13 Favored 'General case' 0 C--O 1.209 -1.076 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.809 175.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.475 ' CG2' ' HB1' ' A' ' 82' ' ' ALA . 40.7 p -86.43 -21.13 27.26 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 118.645 -1.222 . . . . 0.0 112.621 -177.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.5 m -89.6 121.11 31.48 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 113.037 0.755 . . . . 0.0 113.037 -177.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 . . . . . 0 C--N 1.29 -2.019 0 N-CA-C 103.436 -2.801 . . . . 0.0 103.436 165.907 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.429 ' HD1' ' HB3' ' A' ' 35' ' ' HIS . 0.8 OUTLIER . . . . . 0 C--O 1.204 -1.309 0 N-CA-C 111.433 0.16 . . . . 0.0 111.433 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -81.1 -44.94 17.21 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.1 m -56.99 -32.09 65.76 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 124.052 0.845 . . . . 0.0 109.671 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 54.7 mt -87.83 -49.52 7.05 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.213 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 52.5 t -61.09 -49.77 75.96 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.294 0.237 . . . . 0.0 111.383 -179.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.526 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 53.1 t -58.78 -32.27 69.16 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.581 0.352 . . . . 0.0 110.586 178.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -80.4 -26.04 38.74 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.489 0.661 . . . . 0.0 110.687 -177.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -82.85 -46.13 13.41 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.281 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.526 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.6 pp -67.36 -32.45 73.38 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.554 -177.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -70.85 -9.82 58.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.781 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -78.67 -17.69 55.56 Favored 'General case' 0 C--O 1.247 0.935 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 176.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 8.4 t -85.23 162.48 2.9 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 175.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.499 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 2.5 mm-40 -49.89 144.62 6.33 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 124.155 0.982 . . . . 0.0 112.405 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -58.63 -33.51 70.14 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.316 0.579 . . . . 0.0 111.599 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -79.61 -11.49 59.87 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.073 -178.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 62.6 m -116.47 -9.49 11.43 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.929 -175.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.499 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 71.7 mt-30 -57.45 -49.37 76.47 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.387 0.675 . . . . 0.0 112.229 178.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 25.4 p -76.57 -23.7 53.52 Favored 'General case' 0 CA--C 1.499 -1.012 0 C-N-CA 119.494 -0.882 . . . . 0.0 111.841 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -66.56 -35.2 79.64 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 178.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.505 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -60.49 -26.66 66.98 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.372 0.669 . . . . 0.0 111.185 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.459 ' O ' HG21 ' A' ' 79' ' ' VAL . 19.8 mm -72.94 -26.45 23.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.341 0.591 . . . . 0.0 109.537 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -75.88 -38.87 57.42 Favored 'General case' 0 CA--C 1.495 -1.152 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 -174.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -58.09 -44.61 87.72 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 112.335 -2.212 . . . . 0.0 108.996 178.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 74' ' ' ALA . 22.4 t -56.63 -46.38 82.76 Favored 'Isoleucine or valine' 0 C--N 1.359 0.987 0 O-C-N 124.428 1.08 . . . . 0.0 109.601 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.459 HG21 ' O ' ' A' ' 75' ' ' ILE . 41.7 t -65.9 -47.32 85.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -175.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.14 -40.62 86.07 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.297 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -82.02 -31.45 30.98 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.266 0.555 . . . . 0.0 111.275 -178.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.475 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -77.83 -31.23 51.51 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.021 0.439 . . . . 0.0 111.877 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -80.33 -33.75 37.19 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -33.5 63.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.382 -176.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.402 ' HG3' HD21 ' A' ' 86' ' ' LEU . 15.7 pt20 -67.4 -32.52 73.47 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.125 0.488 . . . . 0.0 110.416 -178.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.453 ' HG ' HG22 ' A' ' 96' ' ' VAL . 4.0 mm? -84.29 -29.21 26.58 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.993 177.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -66.91 -38.35 86.05 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.423 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -79.41 -4.64 52.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.447 0.641 . . . . 0.0 111.084 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -95.5 -133.96 7.59 Favored Glycine 0 N--CA 1.426 -2.021 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -92.13 -49.64 6.09 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.633 0.73 . . . . 0.0 109.726 -178.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.426 ' O ' HD11 ' A' ' 86' ' ' LEU . . . 178.11 -152.7 11.92 Favored Glycine 0 CA--C 1.484 -1.861 0 N-CA-C 107.348 -2.301 . . . . 0.0 107.348 -176.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 111.53 -23.69 17.25 Favored Glycine 0 C--O 1.201 -1.925 0 C-N-CA 119.975 -1.107 . . . . 0.0 111.872 178.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.4 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 48.1 mt-30 -49.96 -34.65 21.5 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 124.297 1.039 . . . . 0.0 112.376 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -75.46 -40.83 56.95 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.56 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 20.8 pt20 -80.08 -45.13 18.81 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-O 121.231 0.539 . . . . 0.0 109.67 -175.521 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.453 HG22 ' HG ' ' A' ' 86' ' ' LEU . 88.1 t -63.04 -22.76 31.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 C-N-CA 124.893 1.277 . . . . 0.0 110.759 177.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 28.6 tt0 -54.25 -35.18 62.22 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.23 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.56 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 10.2 pt20 -69.41 -17.45 63.66 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.033 0.444 . . . . 0.0 111.199 -178.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.406 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 2.9 tpt -103.2 -44.03 5.3 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -177.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.2 p -66.82 -23.71 31.48 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 CA-C-O 121.079 0.466 . . . . 0.0 110.972 177.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -21.57 66.6 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 121.867 -0.52 . . . . 0.0 111.278 175.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -67.12 -28.07 67.85 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -68.93 -25.42 64.57 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-O 121.457 0.646 . . . . 0.0 110.131 176.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -70.71 -25.17 62.83 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 122.014 0.912 . . . . 0.0 108.883 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 38.8 mtp -92.3 -14.67 28.47 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.491 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.451 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.2 OUTLIER -52.07 -48.46 88.5 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 124.491 1.116 . . . . 0.0 111.305 -177.553 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 18.6 Cg_endo -59.28 -23.18 68.65 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 121.581 1.521 . . . . 0.0 113.494 177.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -89.19 -40.31 12.96 Favored 'General case' 0 N--CA 1.416 -2.139 0 C-N-CA 119.861 -0.735 . . . . 0.0 110.489 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -66.56 -41.73 88.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.276 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.401 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 30.3 t -88.49 -6.02 57.87 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.283 -176.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 60.56 61.45 1.73 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 123.116 1.436 . . . . 0.0 110.616 -178.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.401 ' HG ' ' HB3' ' A' ' 110' ' ' CYS . 54.8 mt -102.34 158.46 16.18 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 113.472 -1.695 . . . . 0.0 109.536 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -78.87 49.79 0.95 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.002 0.921 . . . . 0.0 111.391 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 18.2 m -158.19 159.08 35.73 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 123.939 0.896 . . . . 0.0 109.99 -176.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.5 p -147.78 116.83 6.82 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 176.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 72.0 mt . . . . . 0 C--N 1.305 -1.33 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 -176.387 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 81.0 m . . . . . 0 N--CA 1.433 -1.307 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.4 p -74.37 160.85 30.48 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -94.3 71.91 3.85 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 120.112 -0.635 . . . . 0.0 110.707 -178.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.4 t -152.06 167.39 28.61 Favored 'General case' 0 N--CA 1.428 -1.53 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.5 mt -129.05 118.89 19.56 Favored Pre-proline 0 C--N 1.311 -1.104 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.95 148.41 90.73 Favored 'Cis proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.711 -1.37 . . . . 0.0 112.591 0.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -74.2 143.98 32.73 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.36 2.04 . . . . 0.0 112.555 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.6 mm -96.24 115.27 35.1 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 176.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 76.8 m . . . . . 0 C--N 1.291 -1.965 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -174.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.0 m . . . . . 0 N--CA 1.428 -1.562 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -106.75 114.38 28.44 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-O 122.196 0.998 . . . . 0.0 109.252 175.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 mp -113.45 128.87 70.07 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.551 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 -177.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.552 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.6 ptp180 -67.29 124.2 22.46 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-O 121.467 0.651 . . . . 0.0 111.609 -174.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.73 -19.74 21.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.539 -176.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -76.33 -11.71 59.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.314 -178.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.552 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 3.4 pt20 -98.63 -10.47 23.28 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 119.616 -0.834 . . . . 0.0 110.575 178.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -105.94 3.83 28.87 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.556 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.502 ' O ' ' HG2' ' A' ' 34' ' ' MET . 3.7 t-20 -57.4 -34.81 69.26 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.492 0.495 . . . . 0.0 111.528 -176.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -69.13 -53.83 18.12 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.17 -52.57 62.89 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.578 -1.192 . . . . 0.0 108.46 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -51.16 -60.77 2.75 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 125.022 1.329 . . . . 0.0 112.415 176.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.502 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.6 ptm -66.21 -39.61 89.74 Favored 'General case' 0 C--O 1.208 -1.108 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -173.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.407 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 2.5 t-80 -68.47 -27.08 65.84 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.543 -175.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.8 mt -82.97 -34.74 26.35 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.578 176.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 41.4 p -82.52 -21.68 35.32 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 118.447 -1.301 . . . . 0.0 112.007 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -90.15 121.73 32.46 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.682 -178.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 . . . . . 0 C--N 1.289 -2.061 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 168.414 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.407 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER . . . . . 0 C--O 1.216 -0.663 0 CA-C-O 120.988 0.423 . . . . 0.0 110.972 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -80.5 -41.86 23.53 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 179.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.4 m -57.83 -28.99 64.58 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.374 0.606 . . . . 0.0 110.312 176.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.1 mt -86.82 -55.73 3.72 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.801 178.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 51.9 t -59.57 -48.16 82.74 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.291 0.636 . . . . 0.0 111.827 -177.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.556 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 24.9 t -60.49 -33.64 72.89 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 122.835 0.454 . . . . 0.0 110.583 178.351 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.416 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 3.2 t-20 -78.31 -23.85 46.93 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.803 0.811 . . . . 0.0 110.035 -177.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -82.1 -47.93 11.97 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.774 178.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.556 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.8 pp -68.04 -30.71 69.99 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.508 -176.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.416 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 16.9 pt20 -69.05 -15.28 63.42 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.19 -176.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -82.42 -18.36 42.14 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.393 0.616 . . . . 0.0 110.306 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 12.0 t -76.76 163.27 3.97 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 175.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.466 ' HB2' ' SG ' ' A' ' 70' ' ' CYS . 46.0 mt-10 -47.73 147.48 1.88 Allowed 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 123.545 0.738 . . . . 0.0 112.295 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.456 ' HB2' HE22 ' A' ' 113' ' ' GLN . 22.0 ptmt -50.83 -38.62 50.02 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.068 0.947 . . . . 0.0 112.874 -176.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.504 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 4.1 pt20 -87.6 -19.55 27.64 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.504 0.669 . . . . 0.0 110.666 -177.372 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.504 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 44.6 m -96.97 -9.1 28.95 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.152 -171.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -57.11 -46.91 82.23 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-O 121.339 0.59 . . . . 0.0 109.844 175.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.5 p -76.87 -23.6 52.62 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.541 0.686 . . . . 0.0 111.546 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -72.87 -30.52 64.03 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.425 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.55 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -62.44 -27.42 69.1 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.398 176.415 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.497 ' O ' HG22 ' A' ' 79' ' ' VAL . 32.4 mm -70.21 -27.69 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.528 -179.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -74.78 -41.78 59.38 Favored 'General case' 0 CA--C 1.5 -0.963 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 -176.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.445 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 50.2 mm-40 -59.05 -42.33 90.04 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 112.227 -2.26 . . . . 0.0 110.374 -179.198 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 74' ' ' ALA . 30.5 t -60.39 -43.95 95.02 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.497 HG22 ' O ' ' A' ' 75' ' ' ILE . 48.0 t -64.4 -47.29 90.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.836 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -177.097 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.63 -59.46 4.81 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.505 -179.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 9.5 pt20 -66.41 -30.24 70.56 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 120.931 0.396 . . . . 0.0 112.024 -175.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.3 -40.45 62.25 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 121.019 -0.273 . . . . 0.0 110.905 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -76.67 -36.94 57.0 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 119.794 -0.762 . . . . 0.0 110.646 -177.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.25 -26.46 62.91 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.618 -0.265 . . . . 0.0 110.869 -177.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -77.63 -30.28 52.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.493 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.556 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.0 mm? -86.18 -40.81 15.24 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.809 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.44 -31.76 70.73 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.629 0.772 . . . . 0.0 112.12 -177.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -77.55 -12.9 60.01 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.782 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -129.09 -100.83 0.97 Allowed Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 119.766 -1.207 . . . . 0.0 113.894 -175.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -71.2 -22.46 62.02 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -173.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.556 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 106.45 -88.54 0.56 Allowed Glycine 0 CA--C 1.472 -2.62 0 N-CA-C 107.917 -2.073 . . . . 0.0 107.917 -174.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.416 ' HA3' HD11 ' A' ' 86' ' ' LEU . . . 79.03 -46.56 2.97 Favored Glycine 0 C--O 1.189 -2.712 0 CA-C-O 118.98 -0.9 . . . . 0.0 114.559 171.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.458 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 52.3 mt-30 -46.45 -27.62 1.14 Allowed 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 125.001 1.321 . . . . 0.0 114.399 -175.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 7.8 pt20 -71.98 -46.56 56.87 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.783 0.325 . . . . 0.0 111.019 176.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.462 ' N ' ' HG3' ' A' ' 94' ' ' GLN . 28.9 pt20 -85.63 -47.17 10.09 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.632 0.73 . . . . 0.0 110.265 -176.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 69.6 t -59.82 -22.56 24.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 C-N-CA 126.331 1.852 . . . . 0.0 110.679 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.458 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 8.6 tt0 -46.2 -44.73 16.34 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.085 0.554 . . . . 0.0 112.469 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -68.17 -18.74 64.69 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 3.9 tpt -100.33 -46.69 5.18 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -175.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.6 p -65.74 -25.85 37.44 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.194 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -24.54 67.93 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 121.93 -0.481 . . . . 0.0 111.335 176.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -65.46 -29.29 69.94 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 122.963 0.505 . . . . 0.0 110.447 178.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.405 ' HA ' HD12 ' A' ' 106' ' ' LEU . . . -58.26 -32.08 68.03 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-O 121.383 0.611 . . . . 0.0 110.556 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.546 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 37.1 mt-30 -68.78 -18.19 64.16 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.864 -178.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 42.9 mtp -91.56 -15.09 29.19 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.422 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 6.4 mp -53.44 -49.07 90.42 Favored Pre-proline 0 C--N 1.319 -0.728 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 25.5 Cg_endo -61.64 -22.31 74.14 Favored 'Trans proline' 0 C--N 1.364 1.39 0 C-N-CA 121.567 1.511 . . . . 0.0 113.077 177.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -85.09 -41.59 15.59 Favored 'General case' 0 N--CA 1.411 -2.385 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -75.88 -42.45 49.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.858 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.454 ' SG ' HD13 ' A' ' 63' ' ' LEU . 8.9 t -84.09 -2.08 56.08 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.649 -174.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 60.69 61.47 1.69 Allowed 'General case' 0 CA--C 1.508 -0.67 0 CA-C-O 122.991 1.377 . . . . 0.0 109.84 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.403 ' CG ' ' HA ' ' A' ' 107' ' ' PRO . 39.4 mt -96.86 158.03 15.62 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 114.106 -1.406 . . . . 0.0 109.53 178.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.456 HE22 ' HB2' ' A' ' 68' ' ' LYS . 70.7 mt-30 -81.37 43.74 0.75 Allowed 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 122.071 0.938 . . . . 0.0 111.57 -174.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 98.3 m -163.39 149.98 12.18 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 104.637 -2.357 . . . . 0.0 104.637 -177.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.7 m -142.38 139.48 31.73 Favored 'General case' 0 C--N 1.288 -2.072 0 CA-C-N 118.632 0.651 . . . . 0.0 109.602 178.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . 0.546 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 55.1 mt . . . . . 0 C--N 1.3 -1.55 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -178.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.426 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 72.2 m . . . . . 0 N--CA 1.442 -0.872 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.9 p -81.79 172.37 13.43 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 120.96 0.409 . . . . 0.0 110.151 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -97.6 81.99 3.01 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.614 0.721 . . . . 0.0 109.87 176.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.1 t -156.27 164.56 38.18 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.4 mm -129.18 116.62 18.83 Favored Pre-proline 0 C--N 1.305 -1.358 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 177.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -72.65 146.53 86.9 Favored 'Cis proline' 0 C--O 1.244 0.778 0 C-N-CA 124.024 -1.24 . . . . 0.0 111.33 -1.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.426 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 61.2 Cg_endo -70.57 153.25 65.31 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.498 2.132 . . . . 0.0 112.263 -177.241 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.1 mm -95.66 107.92 20.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 N-CA-C 106.46 -1.682 . . . . 0.0 106.46 176.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 80.9 m . . . . . 0 C--N 1.292 -1.899 0 CA-C-O 121.687 0.756 . . . . 0.0 112.144 -176.042 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 88.4 m . . . . . 0 N--CA 1.405 -2.678 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -106.43 94.07 4.94 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 122.11 0.957 . . . . 0.0 108.923 177.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.424 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.1 mp -98.05 130.62 46.55 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.606 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 -176.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.495 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 35.7 ptt180 -67.37 116.26 7.92 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-O 121.15 0.5 . . . . 0.0 111.402 -176.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.491 ' HB ' ' OE1' ' A' ' 81' ' ' GLN . 2.6 pp -60.82 -18.5 17.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.918 -176.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -73.67 -16.57 61.21 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.879 -178.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.9 pt20 -89.56 -15.86 31.95 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.439 ' HB3' HG23 ' A' ' 78' ' ' VAL . 2.7 mm? -97.67 6.37 48.07 Favored 'General case' 0 CA--C 1.485 -1.555 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.417 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -56.59 -34.15 66.89 Favored 'General case' 0 C--N 1.31 -1.136 0 O-C-N 124.068 0.855 . . . . 0.0 111.655 -178.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -70.58 -52.88 18.56 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.5 t -54.51 -50.57 67.52 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.759 -1.109 . . . . 0.0 108.166 -178.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -52.94 -58.49 6.77 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 124.401 1.08 . . . . 0.0 112.161 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -66.14 -39.04 89.55 Favored 'General case' 0 C--O 1.214 -0.788 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.607 -173.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.404 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 1.9 t-80 -73.05 -24.87 60.75 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.183 -175.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 99' ' ' MET . 95.7 mt -88.68 -23.44 23.0 Favored 'General case' 0 C--O 1.21 -0.979 0 C-N-CA 120.866 -0.333 . . . . 0.0 111.781 177.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.417 ' HA ' HG11 ' A' ' 96' ' ' VAL . 40.8 p -89.52 -21.61 22.83 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 118.382 -1.327 . . . . 0.0 111.338 178.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.5 m -90.29 152.96 20.81 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.846 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 . . . . . 0 C--N 1.302 -1.463 0 CA-C-O 121.806 0.812 . . . . 0.0 111.658 179.441 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.404 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 1.0 OUTLIER . . . . . 0 C--O 1.214 -0.778 0 CA-C-O 120.575 0.226 . . . . 0.0 111.433 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.0 tp -72.71 -54.27 9.42 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 174.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.5 m -57.94 -21.03 41.99 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.057 -179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.4 mt -90.19 -57.79 2.72 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.507 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 50.7 t -67.3 -50.4 60.42 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.119 0.568 . . . . 0.0 111.849 -176.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.595 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 43.4 t -61.71 -34.94 76.68 Favored 'General case' 0 CA--C 1.495 -1.14 0 CA-C-O 121.645 0.736 . . . . 0.0 109.262 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.416 ' O ' ' HG2' ' A' ' 64' ' ' GLN . 8.9 t30 -72.49 -35.93 68.28 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.631 178.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -76.06 -38.99 56.44 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-O 120.875 0.369 . . . . 0.0 111.376 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.595 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.9 pp -71.83 -30.96 66.03 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 121.05 0.452 . . . . 0.0 110.617 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 24.2 pt20 -73.36 -4.27 32.36 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.189 0.518 . . . . 0.0 110.883 -177.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 7.9 mm-40 -84.94 -17.92 36.21 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 122.017 0.913 . . . . 0.0 108.578 176.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 10.2 t -85.07 164.19 2.56 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.464 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 4.9 mp0 -54.21 141.83 28.05 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 124.362 1.065 . . . . 0.0 110.616 177.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -57.6 -33.02 67.76 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -174.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.46 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 16.7 pt20 -80.22 -9.6 59.73 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.597 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.46 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.3 m -112.29 -9.57 13.87 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.215 -174.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 29.1 mt-30 -61.52 -40.24 93.92 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 121.123 0.487 . . . . 0.0 110.774 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 1.9 p -79.47 -27.24 41.58 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.317 0.579 . . . . 0.0 111.295 177.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -69.35 -33.46 73.13 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.584 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.51 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -59.06 -30.75 68.28 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.003 177.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.46 ' O ' HG21 ' A' ' 79' ' ' VAL . 31.6 mm -66.94 -34.81 72.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.045 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -71.84 -40.07 69.3 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 -172.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -62.31 -37.12 84.35 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 112.579 -2.101 . . . . 0.0 109.439 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 74' ' ' ALA . 33.3 t -60.86 -48.48 88.71 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.46 HG21 ' O ' ' A' ' 75' ' ' ILE . 40.6 t -64.71 -46.82 91.09 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.724 -173.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -57.11 -49.67 75.19 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.614 -1.175 . . . . 0.0 112.129 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.491 ' OE1' ' HB ' ' A' ' 26' ' ' ILE . 28.8 pt20 -74.29 -30.33 62.04 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.359 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.41 ' HB3' ' CG2' ' A' ' 37' ' ' THR . . . -75.18 -40.0 59.78 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 120.95 0.405 . . . . 0.0 111.095 -178.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.428 ' HB2' HE22 ' A' ' 93' ' ' GLN . 13.8 pt20 -72.92 -30.3 63.79 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.244 -177.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -75.91 -31.07 59.0 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.484 -179.147 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -75.66 -28.37 58.7 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.202 0.525 . . . . 0.0 111.62 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.444 ' HG ' HG23 ' A' ' 96' ' ' VAL . 4.4 mm? -84.6 -35.04 23.0 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.802 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -67.09 -32.22 73.23 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.13 0.491 . . . . 0.0 110.526 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -77.81 -11.04 59.85 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.875 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -89.24 -134.27 5.15 Favored Glycine 0 N--CA 1.424 -2.112 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -103.92 -49.78 3.55 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 120.756 0.312 . . . . 0.0 110.67 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -157.02 -148.18 5.01 Favored Glycine 0 N--CA 1.446 -0.637 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 100.53 -31.95 7.94 Favored Glycine 0 C--O 1.205 -1.663 0 CA-C-O 118.918 -0.934 . . . . 0.0 114.185 176.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.428 HE22 ' HB2' ' A' ' 83' ' ' GLN . 14.8 mm100 -48.95 -33.88 11.81 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -177.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -77.26 -37.17 53.6 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.039 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.551 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 29.2 pt20 -82.58 -44.46 15.81 Favored 'General case' 0 CA--C 1.497 -1.072 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.243 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.444 HG23 ' HG ' ' A' ' 86' ' ' LEU . 95.8 t -58.55 -23.84 23.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.805 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -49.84 -44.11 49.3 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.912 178.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 3.7 pt20 -66.4 -18.24 65.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.854 0.359 . . . . 0.0 111.777 -177.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.421 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 6.4 tpt -101.37 -48.69 4.28 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -176.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.6 p -64.97 -24.21 35.05 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 CA-C-O 120.969 0.414 . . . . 0.0 111.499 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.444 ' HG3' ' N ' ' A' ' 102' ' ' LYS . 27.8 pttt -64.27 -23.77 67.42 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.918 -0.489 . . . . 0.0 110.578 176.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.444 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 24.6 mtpp -64.52 -32.71 74.46 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.56 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -64.0 -37.27 86.79 Favored 'General case' 0 C--O 1.196 -1.758 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.148 176.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -68.18 -18.62 64.65 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.226 0.536 . . . . 0.0 110.704 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 29.8 mtm -91.79 -14.8 29.24 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.56 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.6 OUTLIER -52.68 -44.32 95.09 Favored Pre-proline 0 N--CA 1.475 0.794 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -177.368 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.434 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 18.2 Cg_endo -60.34 -24.0 76.22 Favored 'Trans proline' 0 C--N 1.368 1.594 0 CA-C-N 120.935 1.37 . . . . 0.0 112.862 176.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -89.24 -37.67 14.8 Favored 'General case' 0 N--CA 1.408 -2.564 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.138 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -76.88 -34.09 57.79 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 12.4 t -91.97 -2.81 56.56 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 66.3 56.09 0.82 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 122.42 1.105 . . . . 0.0 109.696 178.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 36.8 mt -101.48 157.1 17.06 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.102 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -78.47 39.83 0.35 Allowed 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.876 0.87 . . . . 0.0 112.979 -173.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 86.3 m -154.8 158.48 39.51 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 -174.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 24.0 p -147.01 141.23 26.2 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 43.1 mm . . . . . 0 C--N 1.313 -1.012 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -179.898 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 60.6 m . . . . . 0 N--CA 1.408 -2.528 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.6 p -69.0 140.38 55.0 Favored 'General case' 0 N--CA 1.415 -2.214 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -84.86 69.13 10.71 Favored 'General case' 0 N--CA 1.421 -1.907 0 CA-C-O 121.602 0.715 . . . . 0.0 109.912 -175.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 t -148.5 171.79 15.53 Favored 'General case' 0 N--CA 1.417 -2.094 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 39.7 mm -128.45 118.21 20.17 Favored Pre-proline 0 C--N 1.303 -1.451 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -72.93 145.75 84.95 Favored 'Cis proline' 0 C--O 1.245 0.835 0 C-N-CA 123.877 -1.301 . . . . 0.0 112.668 1.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -77.66 136.86 15.72 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 122.401 2.067 . . . . 0.0 112.154 -178.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.471 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 42.9 mm -95.88 110.03 23.69 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.126 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 79.0 m . . . . . 0 C--N 1.308 -1.237 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -176.249 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 m . . . . . 0 N--CA 1.407 -2.615 0 CA-C-O 121.343 0.592 . . . . 0.0 109.907 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -107.39 98.91 8.48 Favored 'General case' 0 C--N 1.276 -2.599 0 CA-C-O 122.144 0.973 . . . . 0.0 110.05 178.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.469 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 3.3 mp -105.29 138.99 27.73 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.813 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.608 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 16.8 ptt180 -68.51 117.41 10.24 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-O 121.171 0.51 . . . . 0.0 110.734 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.474 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -64.06 -13.53 13.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -176.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -77.36 -20.12 55.26 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.953 -178.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.608 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 14.9 pt20 -86.68 -15.91 38.16 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 119.884 -0.726 . . . . 0.0 109.382 -178.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -98.69 1.77 46.49 Favored 'General case' 0 CA--C 1.483 -1.623 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.79 177.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.473 ' O ' ' HG2' ' A' ' 34' ' ' MET . 27.7 t-20 -56.18 -32.96 64.82 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.898 -178.248 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -71.98 -52.9 14.87 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -177.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.414 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -54.72 -53.73 51.12 Favored 'General case' 0 CA--C 1.516 -0.353 0 O-C-N 123.682 0.613 . . . . 0.0 109.863 177.717 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.444 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.5 tt0 -49.42 -58.45 5.12 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 123.88 0.872 . . . . 0.0 112.63 176.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.473 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 11.8 ptp -65.96 -43.02 89.15 Favored 'General case' 0 CA--C 1.498 -1.055 0 C-N-CA 119.95 -0.7 . . . . 0.0 111.72 -175.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.401 ' CG ' ' HD1' ' A' ' 55' ' ' HIS . 3.0 t-80 -67.7 -32.79 73.67 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 123.835 0.71 . . . . 0.0 110.825 -174.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 99' ' ' MET . 94.7 mt -78.46 -25.69 45.91 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-O 121.135 0.493 . . . . 0.0 111.171 178.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.469 HG23 HE21 ' A' ' 85' ' ' GLN . 68.0 p -91.69 -0.27 57.55 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.709 174.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.8 t -88.29 121.79 31.08 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.747 -175.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 . . . . . 0 N--CA 1.419 -2.017 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 169.099 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.401 ' HD1' ' CG ' ' A' ' 35' ' ' HIS . 0.8 OUTLIER . . . . . 0 N--CA 1.441 -0.878 0 N-CA-C 111.838 0.311 . . . . 0.0 111.838 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -74.3 -43.82 55.21 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 177.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.2 m -61.66 -26.7 68.18 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.172 0.511 . . . . 0.0 110.783 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.3 mt -84.45 -53.37 5.48 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.397 177.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.5 t -65.4 -48.03 74.25 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.11 0.964 . . . . 0.0 111.16 -175.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.519 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.7 t -59.4 -33.3 71.04 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 122.97 0.508 . . . . 0.0 110.53 177.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -81.45 -23.43 37.48 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.712 0.767 . . . . 0.0 110.373 -178.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -83.13 -40.02 20.32 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.326 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.519 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.9 pp -67.5 -32.57 73.47 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 121.229 0.538 . . . . 0.0 110.522 -178.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -71.73 -7.25 46.94 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.656 -179.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -78.44 -22.31 47.83 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.747 0.784 . . . . 0.0 109.15 175.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 7.3 t -82.15 163.95 2.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.224 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -50.79 144.02 8.97 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.06 0.544 . . . . 0.0 110.579 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -62.19 -31.02 71.49 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -174.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -79.27 -10.57 59.85 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.545 0.688 . . . . 0.0 109.94 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 59.8 m -108.44 -10.48 15.28 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.943 -176.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -59.3 -40.61 86.74 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 178.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.435 ' HA ' HG12 ' A' ' 75' ' ' ILE . 8.7 p -83.93 -23.76 31.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 120.024 -0.67 . . . . 0.0 112.625 177.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.03 -36.03 82.15 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.697 0.76 . . . . 0.0 109.534 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.403 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.05 -29.54 65.45 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.265 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.435 HG12 ' HA ' ' A' ' 72' ' ' CYS . 28.5 mm -67.39 -35.79 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.09 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.377 -177.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.487 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 14.3 mmmm -69.05 -41.78 77.16 Favored 'General case' 0 CA--C 1.489 -1.385 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 -176.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 6.7 mt-30 -59.58 -39.35 83.81 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 113.689 -1.596 . . . . 0.0 111.425 -177.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 74' ' ' ALA . 21.9 t -56.99 -44.6 82.96 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 O-C-N 123.743 0.652 . . . . 0.0 109.52 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 23.7 t -65.55 -48.55 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 CA-C-N 115.507 -0.769 . . . . 0.0 108.966 -176.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 43.1 mt-10 -55.71 -52.68 63.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.558 -1.201 . . . . 0.0 111.054 -177.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -71.29 -34.82 71.0 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -177.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.417 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -71.8 -37.64 70.36 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -177.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -76.95 -37.01 56.1 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.753 -179.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.412 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -69.38 -30.62 68.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.693 0.282 . . . . 0.0 111.309 -177.75 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.469 HE21 HG23 ' A' ' 37' ' ' THR . 24.4 pt20 -73.23 -31.47 64.16 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.141 0.496 . . . . 0.0 110.058 -177.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.444 ' HG ' HG22 ' A' ' 96' ' ' VAL . 4.1 mm? -82.7 -30.48 29.14 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.929 175.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -59.95 -40.1 87.86 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 123.36 0.664 . . . . 0.0 110.045 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -83.34 -5.75 59.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.701 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -94.58 -136.71 8.46 Favored Glycine 0 N--CA 1.418 -2.515 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.839 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -93.35 -19.02 21.74 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -175.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 148.17 -118.48 0.99 Allowed Glycine 0 CA--C 1.483 -1.924 0 N-CA-C 108.444 -1.863 . . . . 0.0 108.444 -175.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.56 -33.29 2.32 Favored Glycine 0 C--O 1.201 -1.93 0 CA-C-O 118.683 -1.065 . . . . 0.0 114.903 173.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -47.2 -33.08 4.97 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 -177.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -77.15 -37.0 54.83 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 120.797 0.332 . . . . 0.0 111.361 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.552 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 14.0 pt20 -85.59 -41.29 15.38 Favored 'General case' 0 C--O 1.212 -0.905 0 CA-C-O 121.452 0.644 . . . . 0.0 110.038 -177.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.444 HG22 ' HG ' ' A' ' 86' ' ' LEU . 73.2 t -62.32 -23.48 32.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 C-N-CA 124.9 1.28 . . . . 0.0 111.045 176.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -53.22 -37.32 61.94 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -177.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.552 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.6 pt20 -68.96 -18.6 64.1 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.89 0.376 . . . . 0.0 111.629 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.417 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 6.3 tpt -106.04 -45.13 4.42 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -174.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.72 -24.9 36.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.987 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -61.31 -22.97 65.37 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.862 -0.524 . . . . 0.0 111.173 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -67.58 -23.59 65.41 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 122.055 -0.403 . . . . 0.0 110.484 177.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.454 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -63.92 -34.92 79.05 Favored 'General case' 0 C--O 1.202 -1.429 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 174.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.471 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 44.7 mt-30 -75.39 -19.41 59.55 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.547 -179.095 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 48.2 mtt -86.92 -15.65 38.29 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.796 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.464 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 95.8 mt -52.37 -50.7 78.26 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -178.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 29.9 Cg_endo -62.96 -22.63 73.92 Favored 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 121.981 1.788 . . . . 0.0 112.524 178.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -83.72 -41.79 17.3 Favored 'General case' 0 N--CA 1.408 -2.546 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -176.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -81.41 -33.84 31.97 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.303 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 23.2 t -87.52 -1.51 57.98 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -178.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 53.34 60.22 3.87 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.146 1.378 . . . . 0.0 110.33 -179.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.428 ' C ' ' H ' ' A' ' 114' ' ' CYS . 79.5 mt -91.19 159.73 15.91 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-N 113.984 -1.462 . . . . 0.0 110.087 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -74.37 35.83 0.1 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.088 0.955 . . . . 0.0 112.221 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.428 ' H ' ' C ' ' A' ' 112' ' ' LEU . 57.3 m -157.62 149.27 21.95 Favored 'General case' 0 N--CA 1.417 -2.097 0 C-N-CA 125.702 1.601 . . . . 0.0 107.645 -175.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 4.5 p -134.59 131.96 38.48 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-O 120.99 0.424 . . . . 0.0 110.45 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . 0.471 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 62.0 mt . . . . . 0 C--N 1.303 -1.451 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 178.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 61.8 m . . . . . 0 N--CA 1.432 -1.338 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.7 p -68.29 154.99 40.65 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 176.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -92.04 71.41 5.49 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.713 0.768 . . . . 0.0 109.246 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.0 t -147.12 169.71 18.71 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.4 mp -128.82 114.72 19.09 Favored Pre-proline 0 C--N 1.31 -1.138 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -75.53 147.09 87.63 Favored 'Cis proline' 0 C--O 1.237 0.426 0 C-N-CA 124.075 -1.219 . . . . 0.0 111.816 0.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.414 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 59.1 Cg_endo -72.74 141.46 33.98 Favored 'Trans proline' 0 N--CA 1.446 -1.293 0 C-N-CA 122.118 1.878 . . . . 0.0 111.941 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.7 mm -92.03 113.1 26.77 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 177.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 84.4 m . . . . . 0 C--N 1.284 -2.241 0 CA-C-O 121.373 0.606 . . . . 0.0 111.798 -174.271 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 56.0 m . . . . . 0 N--CA 1.406 -2.63 0 CA-C-O 121.316 0.579 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -96.68 102.43 14.21 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.967 0.889 . . . . 0.0 109.827 177.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.2 mp -109.91 138.53 37.13 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.262 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 178.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.479 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 39.8 ptt180 -79.03 122.19 25.88 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.536 -177.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.506 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.5 pp -62.7 -15.82 15.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -176.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -79.3 -15.89 57.24 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.927 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.1 pt20 -84.88 -27.93 26.35 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 119.265 -0.974 . . . . 0.0 108.531 178.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.409 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.6 mm? -87.31 1.74 52.32 Favored 'General case' 0 CA--C 1.481 -1.707 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.41 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.467 ' HA ' HE21 ' A' ' 33' ' ' GLN . 26.1 t-20 -53.26 -34.72 58.39 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.171 0.919 . . . . 0.0 110.591 -179.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -69.47 -53.41 19.34 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.855 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.8 OUTLIER -55.96 -51.69 66.8 Favored 'General case' 0 CA--C 1.503 -0.843 0 O-C-N 123.164 0.29 . . . . 0.0 110.309 178.442 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.467 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.7 tt0 -49.51 -55.74 12.27 Favored 'General case' 0 N--CA 1.426 -1.658 0 C-N-CA 123.667 0.787 . . . . 0.0 111.713 176.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.7 ptm -68.69 -38.09 80.05 Favored 'General case' 0 C--O 1.209 -1.028 0 C-N-CA 121.088 -0.245 . . . . 0.0 111.497 -176.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.855 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -70.89 -19.45 62.61 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.009 0.433 . . . . 0.0 111.158 -177.444 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 84.6 mt -88.5 -34.09 17.55 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.902 175.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 82.8 p -85.94 -21.04 28.11 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 119.344 -0.942 . . . . 0.0 111.211 -178.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -89.26 127.07 35.74 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.31 -178.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 . . . . . 0 C--N 1.299 -1.6 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 171.474 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.432 -1.329 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -75.31 -43.34 51.45 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.1 m -62.93 -25.71 68.46 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 123.658 0.599 . . . . 0.0 110.539 179.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 63.9 mt -84.83 -46.99 10.81 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.538 177.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -68.83 -50.63 48.41 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -176.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.509 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.2 t -58.27 -34.29 70.34 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 120.921 0.391 . . . . 0.0 110.169 178.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.411 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 9.7 t30 -76.22 -27.21 56.73 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.294 0.568 . . . . 0.0 111.506 -178.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -82.78 -41.81 18.71 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.796 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.509 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.6 pp -70.64 -33.59 71.15 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.026 -178.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.411 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 3.4 pt20 -70.23 -14.97 62.85 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -176.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -79.74 -13.12 59.68 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.514 177.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 18.5 t -77.45 163.68 3.75 Favored 'Isoleucine or valine' 0 C--O 1.254 1.338 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 174.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -48.38 142.44 5.66 Favored 'General case' 0 CA--C 1.508 -0.654 0 C-N-CA 123.566 0.746 . . . . 0.0 110.782 176.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -61.17 -29.13 69.61 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -173.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.477 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 12.1 pt20 -80.31 -22.15 41.85 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-O 121.487 0.66 . . . . 0.0 109.96 178.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.477 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.4 m -99.77 -8.32 24.38 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.051 -172.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 76.1 mt-30 -60.93 -41.62 96.56 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.197 0.522 . . . . 0.0 110.869 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.3 p -78.31 -23.79 46.93 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.637 176.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.404 ' HA ' ' OE2' ' A' ' 73' ' ' GLU . 33.5 mm-40 -69.85 -30.79 68.36 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.935 177.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.459 ' O ' HG21 ' A' ' 78' ' ' VAL . . . -62.7 -27.33 69.18 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.83 176.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.424 ' O ' HG22 ' A' ' 79' ' ' VAL . 28.3 mm -73.36 -24.61 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.052 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -74.49 -41.94 59.83 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 -176.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.46 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 64.7 mm-40 -56.12 -46.4 79.19 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 111.818 -2.446 . . . . 0.0 110.052 -179.38 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.459 HG21 ' O ' ' A' ' 74' ' ' ALA . 22.9 t -54.94 -46.05 76.32 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 O-C-N 124.204 0.94 . . . . 0.0 110.152 -179.172 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.424 HG22 ' O ' ' A' ' 75' ' ' ILE . 26.0 t -67.78 -47.87 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.748 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -175.157 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.76 -45.85 85.33 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.104 -1.407 . . . . 0.0 111.945 -176.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.506 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.7 pt20 -77.29 -35.24 55.25 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 111.448 0.166 . . . . 0.0 111.448 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.07 -38.87 72.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.884 0.373 . . . . 0.0 111.483 -177.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -72.35 -36.74 68.86 Favored 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.059 -178.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.418 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -73.19 -32.47 64.84 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.761 -0.375 . . . . 0.0 111.231 -176.971 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.418 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 2.2 pt20 -71.9 -28.96 63.85 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.745 -176.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.463 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.2 mm? -85.27 -33.79 22.08 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.208 174.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -59.69 -35.73 75.08 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.552 0.741 . . . . 0.0 111.251 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -73.14 -11.72 60.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.137 -178.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -92.79 -126.69 4.15 Favored Glycine 0 N--CA 1.427 -1.96 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.016 -177.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -107.56 -22.4 12.54 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 120.929 0.395 . . . . 0.0 110.588 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 165.91 -128.78 1.82 Allowed Glycine 0 N--CA 1.434 -1.446 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 91.12 -28.86 7.52 Favored Glycine 0 C--O 1.202 -1.848 0 CA-C-O 119.549 -0.584 . . . . 0.0 112.479 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -52.76 -34.38 52.83 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 123.97 0.908 . . . . 0.0 111.714 -176.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.44 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 8.7 pt20 -75.57 -37.2 60.09 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.579 -179.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.569 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 13.1 pt20 -82.59 -45.71 14.24 Favored 'General case' 0 CA--C 1.498 -1.047 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.033 -177.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.463 HG21 ' HG ' ' A' ' 86' ' ' LEU . 96.0 t -57.66 -23.2 19.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 124.376 1.07 . . . . 0.0 110.725 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.419 ' HA ' HG11 ' A' ' 100' ' ' VAL . 53.0 tt0 -50.73 -40.36 54.18 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.803 0.441 . . . . 0.0 111.78 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.2 pt20 -68.76 -18.36 64.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.633 -176.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.446 ' O ' HD22 ' A' ' 36' ' ' LEU . 8.1 tpt -102.44 -48.55 4.12 Favored 'General case' 0 CA--C 1.485 -1.546 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -177.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.419 HG11 ' HA ' ' A' ' 97' ' ' GLN . 14.3 p -60.37 -24.27 30.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.747 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.81 -24.86 64.5 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.851 -0.531 . . . . 0.0 111.688 174.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -64.46 -30.39 71.43 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 120.773 0.321 . . . . 0.0 110.188 177.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.494 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -62.8 -28.79 70.24 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-O 121.418 0.628 . . . . 0.0 109.989 177.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -73.58 -18.6 61.04 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.163 -178.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 42.3 mtt -92.11 -18.28 23.78 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.808 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.494 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.9 OUTLIER -48.18 -48.28 64.74 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 123.884 0.873 . . . . 0.0 113.121 -178.326 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.422 ' HG2' HG12 ' A' ' 116' ' ' ILE . 22.5 Cg_exo -61.35 -26.09 81.08 Favored 'Trans proline' 0 C--N 1.359 1.104 0 C-N-CA 121.533 1.488 . . . . 0.0 113.355 178.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -89.17 -37.44 15.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.812 177.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -74.68 -34.17 62.61 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 12.8 t -93.75 -2.7 53.38 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 64.1 t30 57.27 63.64 1.83 Allowed 'General case' 0 C--O 1.244 0.785 0 CA-C-O 123.01 1.386 . . . . 0.0 110.885 -179.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.7 mt -100.36 157.88 16.3 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 113.039 -1.891 . . . . 0.0 109.401 178.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -78.22 31.25 0.18 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.747 1.219 . . . . 0.0 112.944 -173.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 91.8 m -150.3 167.84 25.81 Favored 'General case' 0 C--N 1.269 -2.923 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -174.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 69.6 m -150.79 133.72 15.93 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 175.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . 0.422 HG12 ' HG2' ' A' ' 107' ' ' PRO . 46.1 mm . . . . . 0 C--O 1.263 1.764 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -177.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.9 m . . . . . 0 N--CA 1.425 -1.723 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.6 p -69.27 155.4 40.48 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.291 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -87.75 73.61 9.27 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 175.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.2 t -150.04 167.23 27.36 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.9 mm -128.49 118.79 20.25 Favored Pre-proline 0 C--N 1.306 -1.311 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.76 147.63 89.91 Favored 'Cis proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.763 -1.349 . . . . 0.0 111.876 -1.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.28 136.08 25.94 Favored 'Trans proline' 0 C--O 1.247 0.94 0 C-N-CA 122.184 1.923 . . . . 0.0 112.063 -178.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.8 mm -96.15 124.01 48.65 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 178.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.1 m . . . . . 0 C--N 1.29 -2.019 0 CA-C-O 121.579 0.704 . . . . 0.0 112.06 -175.555 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.6 m . . . . . 0 N--CA 1.405 -2.68 0 N-CA-C 110.116 -0.328 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -99.84 124.48 45.18 Favored 'General case' 0 N--CA 1.415 -2.193 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 173.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.1 mp -119.93 145.47 26.15 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -176.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.485 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 35.1 ptt180 -66.14 120.68 13.63 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-O 121.599 0.714 . . . . 0.0 110.06 -178.231 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.47 -14.99 19.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.261 0.553 . . . . 0.0 111.97 -175.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -75.53 -20.84 58.43 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.54 -177.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 6.8 pt20 -85.41 -34.95 21.59 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 119.334 -0.946 . . . . 0.0 109.828 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -79.54 -7.81 58.74 Favored 'General case' 0 CA--C 1.475 -1.921 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.21 -177.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.503 ' HA ' HE21 ' A' ' 33' ' ' GLN . 55.6 t30 -54.08 -33.82 58.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 124.246 0.966 . . . . 0.0 110.192 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -69.52 -57.63 4.98 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -56.1 -47.5 77.95 Favored 'General case' 0 C--O 1.215 -0.718 0 O-C-N 123.909 0.756 . . . . 0.0 110.392 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.503 HE21 ' HA ' ' A' ' 30' ' ' ASN . 6.8 tt0 -52.76 -57.95 8.45 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 124.316 1.046 . . . . 0.0 111.842 176.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -67.41 -38.24 84.33 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.818 -175.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 -74.0 -28.74 61.6 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.3 mt -78.53 -24.33 45.76 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 120.176 -0.609 . . . . 0.0 110.757 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 73.6 p -89.87 -12.77 38.04 Favored 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 118.734 -1.186 . . . . 0.0 111.25 176.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.6 t -88.71 144.9 25.96 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.403 178.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 . . . . . 0 N--CA 1.438 -1.041 0 CA-C-O 121.247 0.546 . . . . 0.0 111.206 174.506 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.211 -0.971 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -82.5 -42.36 18.54 Favored 'General case' 0 CA--C 1.49 -1.357 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.3 m -60.42 -31.09 70.07 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.399 0.619 . . . . 0.0 109.93 178.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 44.9 mt -81.8 -53.13 6.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.116 177.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 25.3 t -59.13 -49.72 76.78 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 123.443 0.697 . . . . 0.0 111.731 -177.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.527 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.0 t -58.55 -35.56 72.52 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.45 0.643 . . . . 0.0 110.419 179.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -82.05 -23.69 35.71 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.874 0.845 . . . . 0.0 110.762 -176.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -86.84 -38.63 16.62 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.7 179.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.527 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 4.1 pp -68.76 -32.33 72.01 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.11 0.481 . . . . 0.0 109.865 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.456 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 14.6 pt20 -68.61 -10.32 55.28 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.903 -178.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.42 -15.49 59.31 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.516 0.674 . . . . 0.0 109.223 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.6 t -86.49 163.37 2.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 174.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.506 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.6 mt-10 -49.38 143.05 6.88 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 122.938 0.495 . . . . 0.0 110.675 175.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -59.8 -32.46 70.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -175.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.499 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 27.8 pt20 -72.89 -24.01 60.79 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.612 0.72 . . . . 0.0 109.972 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.499 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.0 m -100.22 -9.14 22.75 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.047 -174.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.506 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 28.0 mt-30 -61.5 -39.17 90.0 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.894 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.0 p -83.55 -23.99 31.79 Favored 'General case' 0 CA--C 1.502 -0.874 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.692 177.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -66.03 -34.36 77.91 Favored 'General case' 0 C--O 1.248 1.024 0 CA-C-O 122.073 0.939 . . . . 0.0 108.763 178.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.21 -31.52 71.29 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.7 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.419 HD13 HD23 ' A' ' 63' ' ' LEU . 31.0 mm -69.62 -33.62 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.638 -176.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.526 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 30.7 mmtp -67.88 -41.15 83.22 Favored 'General case' 0 CA--C 1.487 -1.445 0 CA-C-N 115.234 -0.894 . . . . 0.0 108.871 -178.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.442 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 6.6 mt-30 -61.05 -36.37 79.41 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.161 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 23.6 t -57.8 -46.57 87.08 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.702 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 178.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 45.1 t -62.51 -45.49 98.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.359 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 35.6 mt-10 -57.87 -52.23 66.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.236 -177.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 3.5 pt20 -75.06 -31.95 61.4 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.102 -175.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.16 -37.34 58.07 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -177.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -73.85 -32.86 63.86 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.575 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.421 ' HD3' ' C ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -75.95 -32.28 59.45 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.578 -175.913 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -71.83 -27.49 62.94 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.246 0.546 . . . . 0.0 110.261 -178.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.424 ' HG ' HG22 ' A' ' 96' ' ' VAL . 3.8 mm? -83.94 -35.11 24.26 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.988 174.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.45 ' HA ' ' NE2' ' A' ' 93' ' ' GLN . 29.6 tt0 -60.59 -33.5 72.83 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.515 0.726 . . . . 0.0 111.647 178.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -86.8 -1.55 57.86 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.258 0.551 . . . . 0.0 111.329 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -95.86 -144.83 17.72 Favored Glycine 0 N--CA 1.419 -2.434 0 CA-C-O 121.753 0.641 . . . . 0.0 113.023 -177.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -100.23 -41.28 7.16 Favored 'General case' 0 C--N 1.279 -2.458 0 CA-C-N 114.84 -0.68 . . . . 0.0 111.045 -174.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 179.69 -176.84 47.86 Favored Glycine 0 N--CA 1.418 -2.547 0 N-CA-C 108.919 -1.672 . . . . 0.0 108.919 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.438 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 119.66 -25.14 7.75 Favored Glycine 0 N--CA 1.408 -3.205 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.27 -177.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.45 ' NE2' ' HA ' ' A' ' 87' ' ' GLN . 19.4 mp0 -47.35 -40.3 17.02 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.931 0.892 . . . . 0.0 112.092 -178.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -77.11 -37.31 54.48 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.583 -176.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.653 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 4.1 pt20 -80.66 -43.52 20.29 Favored 'General case' 0 C--O 1.209 -1.065 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.147 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.424 HG22 ' HG ' ' A' ' 86' ' ' LEU . 69.0 t -61.06 -23.51 30.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 C-N-CA 124.594 1.158 . . . . 0.0 110.541 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -54.57 -37.62 65.69 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.873 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.653 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 30.0 pt20 -71.8 -18.35 62.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.866 0.365 . . . . 0.0 111.143 -178.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.2 tpt -96.78 -47.26 5.94 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 -176.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -62.45 -27.75 43.37 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.319 178.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.1 pptp? -63.85 -21.2 66.33 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.912 -0.492 . . . . 0.0 111.286 176.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -65.36 -28.82 69.55 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.383 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.43 -30.92 69.94 Favored 'General case' 0 C--O 1.207 -1.135 0 CA-C-O 121.186 0.517 . . . . 0.0 110.313 178.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.44 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 38.6 mt-30 -68.83 -19.31 64.26 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.253 0.549 . . . . 0.0 109.887 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 49.4 mtp -91.97 -19.94 21.89 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 7.0 mp -53.55 -47.5 96.2 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.59 -22.32 73.86 Favored 'Trans proline' 0 C--N 1.362 1.243 0 CA-C-N 120.74 1.3 . . . . 0.0 112.658 176.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -85.09 -49.5 8.21 Favored 'General case' 0 N--CA 1.411 -2.399 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -73.46 -38.92 65.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.062 -175.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.443 ' SG ' HD21 ' A' ' 112' ' ' LEU . 34.0 t -82.82 -0.83 49.78 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 63.12 40.71 8.75 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.886 1.274 . . . . 0.0 110.477 173.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.443 HD21 ' SG ' ' A' ' 110' ' ' CYS . 48.8 mt -80.97 159.55 24.87 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.314 -177.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -69.36 41.55 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 C-N-CA 125.062 1.345 . . . . 0.0 112.657 -176.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 56.7 m -158.06 146.13 18.67 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -176.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 40.1 m -134.03 119.25 18.74 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-O 121.062 0.458 . . . . 0.0 110.063 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . 0.44 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 67.1 mt . . . . . 0 C--N 1.304 -1.404 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 74.3 m . . . . . 0 N--CA 1.433 -1.275 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.6 p -75.87 160.85 29.51 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 121.087 0.47 . . . . 0.0 110.357 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -91.29 66.33 5.56 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.8 t -152.44 172.35 16.65 Favored 'General case' 0 N--CA 1.421 -1.901 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -177.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.8 mm -128.35 118.29 20.31 Favored Pre-proline 0 C--N 1.313 -1.009 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 177.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.62 146.41 86.51 Favored 'Cis proline' 0 C--O 1.244 0.796 0 C-N-CA 123.817 -1.326 . . . . 0.0 111.608 0.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -68.45 126.82 14.71 Favored 'Trans proline' 0 N--CA 1.446 -1.304 0 C-N-CA 121.799 1.666 . . . . 0.0 110.126 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 46.4 mm -89.58 112.37 24.35 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.187 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -178.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 63.2 m . . . . . 0 C--N 1.287 -2.147 0 CA-C-O 121.581 0.705 . . . . 0.0 110.82 -176.52 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.437 -1.083 0 CA-C-O 120.417 0.151 . . . . 0.0 111.273 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -106.73 116.82 32.58 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.867 0.842 . . . . 0.0 109.727 177.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -120.49 132.58 69.71 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 -177.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.525 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 21.7 ptt180 -67.49 117.06 8.94 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 121.148 0.499 . . . . 0.0 111.484 -177.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.559 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.7 pp -61.98 -14.37 11.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -177.424 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -79.24 -17.33 54.97 Favored 'General case' 0 N--CA 1.423 -1.8 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.257 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.0 pt20 -79.98 -23.57 41.5 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.489 ' HB2' ' OE1' ' A' ' 81' ' ' GLN . 2.5 mm? -93.73 4.46 53.9 Favored 'General case' 0 CA--C 1.489 -1.381 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.048 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -55.02 -31.95 61.45 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 123.624 0.577 . . . . 0.0 111.595 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.416 ' O ' ' HB3' ' A' ' 35' ' ' HIS . 5.1 t60 -71.67 -53.11 14.63 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 107.84 -1.171 . . . . 0.0 107.84 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.503 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -55.86 -50.29 71.02 Favored 'General case' 0 C--N 1.314 -0.97 0 O-C-N 124.357 1.036 . . . . 0.0 109.188 -177.988 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -49.92 -58.26 5.79 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 125.148 1.379 . . . . 0.0 111.83 174.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.2 ptm -66.8 -37.88 85.41 Favored 'General case' 0 C--O 1.192 -1.972 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.03 -177.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.416 ' HB3' ' O ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -58.66 -33.87 70.58 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 123.555 0.742 . . . . 0.0 111.246 179.0 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 89.4 mt -81.48 -41.27 22.0 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.147 178.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 45.8 p -85.24 -21.33 29.13 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.108 -175.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.6 t -90.76 121.23 32.47 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.214 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 . . . . . 0 C--N 1.282 -2.355 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 170.801 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.535 0.372 0 CA-C-O 121.405 0.621 . . . . 0.0 112.431 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -86.21 -40.11 15.92 Favored 'General case' 0 CA--C 1.496 -1.111 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 -179.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 t -59.27 -24.0 62.86 Favored 'General case' 0 C--O 1.209 -1.054 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.693 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.6 mt -87.63 -56.04 3.52 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.769 177.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 27.4 t -57.88 -51.75 68.32 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.454 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 11.0 t -59.31 -33.42 71.08 Favored 'General case' 0 N--CA 1.428 -1.542 0 C-N-CA 124.197 0.999 . . . . 0.0 110.748 178.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.472 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 2.8 t-20 -81.25 -23.19 38.18 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.129 -176.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 21.2 tp60 -80.06 -46.38 16.65 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.28 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.544 ' O ' ' HG2' ' A' ' 71' ' ' GLN . 3.6 pp -69.14 -35.44 76.37 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.291 -175.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.453 ' NE2' HD21 ' A' ' 61' ' ' ASN . 11.1 pt20 -68.88 -17.38 63.97 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 122.991 0.516 . . . . 0.0 111.735 -175.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 63.6 mm-40 -83.61 -13.31 54.61 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 121.377 0.608 . . . . 0.0 109.713 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.3 t -79.63 162.68 3.77 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -50.52 141.59 12.06 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 123.492 0.717 . . . . 0.0 110.98 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.409 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 18.8 ptpt -57.83 -31.77 66.96 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -174.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.429 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 4.1 pt20 -82.11 -12.71 58.05 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.26 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.429 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 42.7 m -110.75 -12.6 14.28 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.584 -174.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.544 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 67.4 mt-30 -56.28 -46.47 79.73 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.434 0.694 . . . . 0.0 110.796 176.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.0 p -75.09 -23.86 58.05 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.324 0.583 . . . . 0.0 111.468 178.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -73.98 -29.52 62.02 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.402 0.62 . . . . 0.0 110.287 177.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.464 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -64.24 -23.13 67.2 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.586 176.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.482 ' O ' HG23 ' A' ' 79' ' ' VAL . 35.2 mm -72.87 -27.75 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.362 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -73.03 -41.0 64.67 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 -175.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.462 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 12.1 mm100 -56.6 -47.95 78.49 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 111.676 -2.511 . . . . 0.0 110.133 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.464 HG22 ' O ' ' A' ' 74' ' ' ALA . 20.0 t -56.23 -44.59 79.8 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 O-C-N 124.03 0.832 . . . . 0.0 109.771 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 75' ' ' ILE . 31.0 t -68.09 -42.34 85.01 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.686 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -174.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -61.95 -53.0 61.7 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.597 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.559 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.7 pt20 -71.55 -31.05 66.58 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.791 0.329 . . . . 0.0 111.852 -176.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.2 -40.97 64.32 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.881 -0.327 . . . . 0.0 110.954 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -70.55 -41.38 72.56 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.154 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.51 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -65.33 -35.99 82.67 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.299 -176.168 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.51 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 17.4 pt20 -71.94 -33.6 68.35 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.604 -174.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.437 HD13 ' HA3' ' A' ' 92' ' ' GLY . 2.7 mm? -84.46 -39.29 19.1 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.391 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -57.48 -41.28 80.37 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 123.804 0.842 . . . . 0.0 111.06 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 84' ' ' LYS . 4.2 pt20 -90.98 -8.67 48.55 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.322 0.582 . . . . 0.0 110.737 -178.081 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -89.9 -78.88 1.34 Allowed Glycine 0 N--CA 1.426 -1.996 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.846 -176.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -132.76 -12.54 2.96 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.74 -106.79 1.42 Allowed Glycine 0 C--N 1.285 -2.254 0 N-CA-C 106.865 -2.494 . . . . 0.0 106.865 -173.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.437 ' HA3' HD13 ' A' ' 86' ' ' LEU . . . 77.26 -37.29 1.55 Allowed Glycine 0 C--O 1.185 -2.908 0 CA-C-O 119.039 -0.867 . . . . 0.0 115.04 172.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 14.0 mm100 -52.29 -21.06 3.12 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -175.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -79.2 -39.72 32.56 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.084 0.469 . . . . 0.0 110.877 174.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -86.0 -38.95 17.37 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 121.625 0.726 . . . . 0.0 110.217 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 72.2 t -69.71 -22.52 25.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.207 0 C-N-CA 125.631 1.572 . . . . 0.0 110.633 176.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.415 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 53.6 tt0 -45.91 -44.75 14.89 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -59.87 -28.13 67.27 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 123.069 0.548 . . . . 0.0 112.04 178.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.406 ' O ' HD22 ' A' ' 36' ' ' LEU . 5.2 tpt -96.59 -48.08 5.67 Favored 'General case' 0 CA--C 1.494 -1.206 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -174.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.2 p -60.38 -27.98 41.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.603 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -25.16 68.18 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.958 -0.464 . . . . 0.0 111.265 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -64.54 -25.58 68.04 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 122.661 0.384 . . . . 0.0 110.855 177.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.432 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -60.36 -36.26 77.59 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-O 121.495 0.664 . . . . 0.0 110.032 176.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -73.24 -16.51 61.4 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.74 0.781 . . . . 0.0 110.297 -177.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 54.3 mtp -92.67 -15.85 26.27 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.978 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.451 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 92.6 mt -55.1 -47.07 99.4 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.927 -177.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 12.3 Cg_endo -58.78 -22.28 60.95 Favored 'Trans proline' 0 C--N 1.366 1.497 0 C-N-CA 121.759 1.639 . . . . 0.0 113.127 175.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -84.82 -47.83 9.98 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -68.49 -47.41 67.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.1 -176.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 97.8 m -81.3 2.05 29.83 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 47.9 t30 53.58 64.48 1.83 Allowed 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 122.97 1.367 . . . . 0.0 110.697 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.9 mt -98.59 158.19 15.76 Favored 'General case' 0 C--N 1.275 -2.673 0 CA-C-N 113.396 -1.729 . . . . 0.0 108.659 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -81.08 45.1 0.81 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.814 0.816 . . . . 0.0 111.068 -175.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 57.2 m -160.88 155.3 23.3 Favored 'General case' 0 C--N 1.285 -2.226 0 C-N-CA 125.722 1.609 . . . . 0.0 106.712 -176.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 41.5 m -150.32 136.76 18.88 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 38.0 mm . . . . . 0 C--N 1.309 -1.158 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.001 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 58.1 m . . . . . 0 N--CA 1.428 -1.55 0 CA-C-O 120.952 0.406 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.6 p -82.53 166.1 19.57 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.781 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -90.55 76.98 6.51 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 175.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t -152.67 163.95 38.67 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.1 mm -128.79 115.91 19.26 Favored Pre-proline 0 C--N 1.305 -1.334 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 176.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.59 147.18 88.98 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.869 -1.305 . . . . 0.0 111.692 -1.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.85 140.16 45.46 Favored 'Trans proline' 0 C--O 1.247 0.959 0 C-N-CA 122.661 2.241 . . . . 0.0 111.789 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.3 mm -95.32 116.99 38.22 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 65.8 m . . . . . 0 C--N 1.284 -2.281 0 CA-C-O 121.462 0.649 . . . . 0.0 110.893 -177.948 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 86.3 m . . . . . 0 N--CA 1.415 -2.195 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -101.83 102.95 13.62 Favored 'General case' 0 N--CA 1.423 -1.81 0 CA-C-O 122.269 1.033 . . . . 0.0 109.2 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.479 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 3.1 mp -102.08 144.16 13.75 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.568 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -178.074 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.43 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.8 ptt180 -70.58 115.28 9.57 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.161 0.505 . . . . 0.0 110.736 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.404 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -65.64 -10.9 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -78.08 -21.02 51.16 Favored 'General case' 0 N--CA 1.427 -1.609 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.098 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.0 OUTLIER -82.06 -26.54 33.63 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 119.492 -0.883 . . . . 0.0 108.813 -179.98 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.442 ' HB3' HG21 ' A' ' 78' ' ' VAL . 2.4 mm? -86.58 -1.7 57.87 Favored 'General case' 0 CA--C 1.487 -1.474 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.152 -178.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.569 ' O ' ' HG2' ' A' ' 34' ' ' MET . 8.2 t30 -51.65 -32.65 30.19 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 124.265 0.978 . . . . 0.0 111.692 179.791 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -70.31 -56.42 6.78 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.444 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -53.84 -53.28 54.67 Favored 'General case' 0 CA--C 1.507 -0.709 0 O-C-N 123.918 0.761 . . . . 0.0 110.052 178.717 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -47.88 -56.14 8.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.201 1.001 . . . . 0.0 112.283 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.569 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 14.3 ptp -70.66 -44.11 67.78 Favored 'General case' 0 C--O 1.202 -1.402 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.261 -176.11 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -68.28 -22.88 64.71 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -178.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 89.0 mt -81.7 -34.24 30.74 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.663 174.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 62.0 p -84.2 -22.16 31.0 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 117.84 -1.544 . . . . 0.0 112.212 179.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.6 p -90.69 145.95 24.41 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-O 121.735 0.779 . . . . 0.0 112.559 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 . . . . . 0 C--N 1.281 -2.392 0 N-CA-C 104.645 -2.354 . . . . 0.0 104.645 169.795 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 . . . . . 0 N--CA 1.426 -1.627 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -80.22 -42.69 22.79 Favored 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.3 m -59.82 -27.23 66.43 Favored 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.732 0.645 . . . . 0.0 110.718 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.0 mt -88.15 -51.17 5.93 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.775 176.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.7 t -59.72 -48.14 82.85 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.429 0.692 . . . . 0.0 111.895 -177.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.511 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 42.1 t -57.86 -35.94 71.65 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.269 0.557 . . . . 0.0 110.091 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.54 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 4.1 t-20 -76.56 -25.67 54.29 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.16 -176.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -85.57 -44.9 12.26 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.954 178.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.511 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.7 pp -66.26 -31.9 73.0 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.365 0.603 . . . . 0.0 110.24 -177.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.54 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 3.3 pt20 -71.97 -9.24 58.08 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.684 -178.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -78.29 -15.91 58.28 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.416 0.627 . . . . 0.0 109.819 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.0 t -84.05 161.61 3.22 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 174.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 33.7 mt-10 -49.31 142.2 7.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.287 0.635 . . . . 0.0 111.306 177.095 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.454 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 15.5 ptpt -56.38 -33.42 65.72 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -174.06 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.476 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.8 pt20 -77.57 -22.81 50.38 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 121.758 0.79 . . . . 0.0 110.176 -179.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.476 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 66.3 m -98.57 -13.15 20.56 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.672 -173.142 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 76.8 mt-30 -57.04 -40.69 77.25 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 123.234 0.614 . . . . 0.0 111.802 178.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 20.4 p -83.47 -24.06 31.95 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 119.409 -0.917 . . . . 0.0 111.981 179.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -64.92 -36.8 85.55 Favored 'General case' 0 CA--C 1.553 1.091 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 177.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.412 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.12 -31.79 67.52 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.093 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 28.2 mm -69.91 -32.6 52.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.322 -176.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 14.6 mmmm -68.92 -41.07 78.66 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 -178.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.479 ' NE2' ' HB ' ' A' ' 24' ' ' ILE . 5.9 mt-30 -61.01 -37.87 84.07 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 113.598 -1.637 . . . . 0.0 110.639 -179.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.442 HG21 ' HB3' ' A' ' 29' ' ' LEU . 40.3 t -55.91 -46.85 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 123.94 0.775 . . . . 0.0 109.233 178.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 38.4 t -62.95 -46.08 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.357 -175.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 38.6 mt-10 -56.88 -52.3 65.7 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.307 -178.093 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -73.33 -32.12 64.38 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.816 -176.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.35 -39.69 71.14 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.045 -179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -72.56 -41.08 66.15 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.545 -179.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -27.92 68.04 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 120.841 0.353 . . . . 0.0 111.62 -176.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.424 ' HA ' ' NE2' ' A' ' 88' ' ' GLN . 17.1 pt20 -77.67 -30.33 51.95 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.824 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.482 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.2 mm? -87.04 -41.64 13.7 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.165 0.507 . . . . 0.0 111.982 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -58.66 -32.13 68.81 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.727 1.211 . . . . 0.0 112.412 -177.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.424 ' NE2' ' HA ' ' A' ' 85' ' ' GLN . 11.4 pt20 -73.72 -9.48 58.7 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -174.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -154.86 -73.6 0.01 OUTLIER Glycine 0 C--N 1.304 -1.206 0 C-N-CA 118.649 -1.738 . . . . 0.0 113.975 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -61.18 -43.03 99.52 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -175.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.482 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 101.49 -106.1 2.98 Favored Glycine 0 CA--C 1.473 -2.54 0 N-CA-C 105.728 -2.949 . . . . 0.0 105.728 -170.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.61 -24.94 1.44 Allowed Glycine 0 C--O 1.186 -2.892 0 N-CA-C 115.555 0.982 . . . . 0.0 115.555 169.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -58.61 -21.6 53.97 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 118.887 1.344 . . . . 0.0 113.719 -174.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -77.65 -38.11 48.49 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.503 174.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -85.19 -43.0 14.2 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 122.025 0.917 . . . . 0.0 109.38 -178.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 72.1 t -63.2 -22.71 31.42 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 C-N-CA 125.821 1.648 . . . . 0.0 110.146 177.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -45.14 -47.45 12.26 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.436 0.694 . . . . 0.0 112.527 -179.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -69.32 -17.6 63.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.041 -177.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 4.9 tpt -100.14 -45.45 5.64 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -178.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.7 p -66.55 -25.85 36.07 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.186 179.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.88 -26.26 67.28 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 122.025 -0.422 . . . . 0.0 111.395 175.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -63.0 -31.9 73.14 Favored 'General case' 0 C--O 1.208 -1.08 0 C-N-CA 122.802 0.441 . . . . 0.0 110.015 178.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.58 -31.81 71.88 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-O 121.147 0.499 . . . . 0.0 110.486 178.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -72.62 -20.91 61.2 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.728 0.775 . . . . 0.0 109.629 -179.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' MET . . . . . 0.444 ' O ' ' HB2' ' A' ' 108' ' ' ASN . 48.2 mtp -92.4 -17.3 24.8 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.563 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.43 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 3.6 mp -53.17 -46.52 97.75 Favored Pre-proline 0 N--CA 1.471 0.603 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 16.3 Cg_endo -60.94 -22.31 74.01 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 121.216 1.278 . . . . 0.0 112.577 176.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 105' ' ' MET . 16.0 m120 -84.71 -49.42 8.51 Favored 'General case' 0 N--CA 1.415 -2.196 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -74.2 -33.3 63.36 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.757 -174.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . 0.487 ' SG ' HD22 ' A' ' 112' ' ' LEU . 34.8 t -89.32 -6.98 56.25 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 60.0 64.33 1.29 Allowed 'General case' 0 C--O 1.241 0.633 0 CA-C-O 123.499 1.619 . . . . 0.0 110.653 -178.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.487 HD22 ' SG ' ' A' ' 110' ' ' CYS . 40.4 mt -101.83 159.24 15.51 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 112.412 -2.176 . . . . 0.0 109.555 178.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -74.32 45.28 0.22 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.092 0.957 . . . . 0.0 111.952 -175.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 56.0 m -162.12 164.49 27.97 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 124.046 0.938 . . . . 0.0 109.297 -175.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 55.0 m -150.64 123.74 8.8 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 66.4 mt . . . . . 0 C--N 1.311 -1.085 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -178.329 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 64.5 m . . . . . 0 N--CA 1.428 -1.529 0 CA-C-O 120.897 0.379 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.1 p -73.48 148.25 43.34 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -87.75 79.47 8.18 Favored 'General case' 0 N--CA 1.42 -1.93 0 CA-C-O 121.799 0.809 . . . . 0.0 108.876 177.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.4 p -140.98 164.91 28.99 Favored 'General case' 0 N--CA 1.417 -2.108 0 CA-C-N 113.984 -1.462 . . . . 0.0 107.99 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 34.1 mm -128.72 110.93 18.89 Favored Pre-proline 0 C--N 1.3 -1.578 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -73.06 151.49 97.14 Favored 'Cis proline' 0 C--O 1.248 1.004 0 C-N-CA 124.341 -1.108 . . . . 0.0 112.192 -0.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -74.02 156.98 47.3 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.258 1.972 . . . . 0.0 111.998 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.7 mm -114.65 117.2 54.87 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 N-CA-C 107.03 -1.471 . . . . 0.0 107.03 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 85.8 m . . . . . 0 C--N 1.291 -1.972 0 CA-C-O 121.826 0.822 . . . . 0.0 111.879 -177.654 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.404 -2.736 0 CA-C-O 121.383 0.611 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 3.3 pt20 -101.12 101.05 11.7 Favored 'General case' 0 N--CA 1.416 -2.143 0 CA-C-O 122.443 1.116 . . . . 0.0 110.276 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.426 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 2.4 mp -115.08 132.37 64.54 Favored 'Isoleucine or valine' 0 C--N 1.261 -3.241 0 N-CA-C 105.628 -1.99 . . . . 0.0 105.628 176.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.521 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.6 ptt180 -68.55 118.13 11.18 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -65.67 -16.42 20.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.226 0.536 . . . . 0.0 111.926 -176.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -74.87 -16.52 60.67 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.254 -178.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 7.0 pt20 -89.18 -19.63 25.22 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.277 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.88 -0.23 57.44 Favored 'General case' 0 CA--C 1.477 -1.859 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.743 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.411 ' O ' ' HG2' ' A' ' 34' ' ' MET . 7.8 t30 -50.38 -37.66 38.49 Favored 'General case' 0 C--O 1.218 -0.598 0 O-C-N 124.413 1.071 . . . . 0.0 111.146 178.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -66.81 -52.98 37.43 Favored 'General case' 0 C--O 1.215 -0.747 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.843 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.7 OUTLIER -58.28 -51.94 67.68 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 123.274 0.359 . . . . 0.0 110.639 179.523 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -50.05 -52.34 35.2 Favored 'General case' 0 N--CA 1.434 -1.233 0 C-N-CA 124.162 0.985 . . . . 0.0 111.608 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.411 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.1 ptm -71.71 -41.05 69.06 Favored 'General case' 0 C--O 1.211 -0.946 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.521 -177.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.843 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 1.4 p80 -68.16 -24.68 65.0 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.995 0.426 . . . . 0.0 111.954 -176.228 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 99' ' ' MET . 95.2 mt -83.39 -40.61 19.15 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.81 176.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.428 HG23 HG13 ' A' ' 96' ' ' VAL . 58.5 p -83.7 -21.0 32.49 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 118.947 -1.101 . . . . 0.0 112.929 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.6 m -90.66 121.54 32.66 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 C--N 1.297 -1.691 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 169.032 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.435 -1.186 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -72.88 -45.45 58.2 Favored 'General case' 0 C--O 1.214 -0.796 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 174.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.2 m -58.05 -26.89 63.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 122.876 0.471 . . . . 0.0 111.282 177.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.3 mt -81.71 -56.39 4.03 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.319 175.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.9 t -62.37 -48.52 79.4 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.2 0.6 . . . . 0.0 112.408 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.541 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.0 t -59.03 -32.27 69.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.444 0.698 . . . . 0.0 110.117 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.432 ' O ' ' HG2' ' A' ' 64' ' ' GLN . 8.1 t30 -76.88 -41.32 44.31 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.89 0.852 . . . . 0.0 110.322 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -65.13 -36.44 84.26 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.12 -179.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.541 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.6 pp -80.21 -33.24 38.29 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.161 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 4.0 pt20 -68.68 -23.11 64.35 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -174.706 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.93 -22.85 63.15 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.227 0.537 . . . . 0.0 110.053 176.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.8 t -74.66 158.16 5.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 177.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 1.3 mp0 -42.69 140.67 1.23 Allowed 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 125.03 1.332 . . . . 0.0 111.818 177.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -58.82 -32.97 69.87 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -173.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.579 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.5 pt20 -81.62 -11.8 58.97 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.579 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.3 m -112.5 -8.23 13.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.891 -172.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 99.1 mt-30 -60.64 -43.37 97.63 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.776 0.798 . . . . 0.0 109.819 177.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 2.9 p -77.71 -25.24 49.2 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.144 179.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -73.62 -29.27 62.26 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.08 179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.528 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.03 -32.92 70.17 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.497 176.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 22.5 mm -70.22 -32.15 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.926 -176.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -70.16 -40.52 74.67 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 -175.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.459 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 7.2 mt-30 -64.04 -36.86 85.37 Favored 'General case' 0 CA--C 1.497 -1.071 0 CA-C-N 113.681 -1.599 . . . . 0.0 109.968 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.528 HG23 ' O ' ' A' ' 74' ' ' ALA . 43.7 t -56.73 -46.86 83.24 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.812 0 O-C-N 124.649 1.218 . . . . 0.0 108.569 178.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 41.2 t -64.29 -46.77 92.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.275 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -57.91 -50.33 73.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.942 -178.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.459 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -73.89 -28.3 61.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.94 0.4 . . . . 0.0 111.635 -178.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.467 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.67 -38.54 58.67 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 120.962 0.41 . . . . 0.0 111.135 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -71.11 -38.17 72.35 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -30.72 65.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.685 -176.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 3.3 pt20 -74.68 -31.19 61.83 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.24 0.543 . . . . 0.0 110.499 -178.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.467 HD12 ' HA3' ' A' ' 92' ' ' GLY . 2.7 mm? -86.4 -37.31 18.51 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.172 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.18 -35.78 76.14 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.395 -178.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -83.35 -3.24 57.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.26 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -91.51 -70.99 1.19 Allowed Glycine 0 N--CA 1.437 -1.266 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.631 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.42 -37.56 0.14 Allowed 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.483 0.658 . . . . 0.0 110.29 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.411 ' C ' ' H ' ' A' ' 93' ' ' GLN . . . 166.2 -93.86 0.11 Allowed Glycine 0 N--CA 1.419 -2.448 0 N-CA-C 107.101 -2.4 . . . . 0.0 107.101 -178.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.467 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 75.42 -31.35 1.18 Allowed Glycine 0 C--O 1.2 -1.999 0 CA-C-O 119.413 -0.66 . . . . 0.0 114.721 173.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.411 ' H ' ' C ' ' A' ' 91' ' ' GLY . 26.9 mt-30 -47.83 -35.38 10.12 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 124.681 1.192 . . . . 0.0 112.201 -178.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -74.17 -42.16 60.35 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.428 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 19.4 pt20 -77.45 -44.71 28.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.48 0.657 . . . . 0.0 110.133 -178.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.428 HG13 HG23 ' A' ' 37' ' ' THR . 94.1 t -64.5 -22.85 32.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 C-N-CA 124.789 1.236 . . . . 0.0 110.355 177.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -45.83 -46.0 15.29 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.004 0.522 . . . . 0.0 112.407 -178.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -65.08 -18.22 65.11 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.914 0.388 . . . . 0.0 111.957 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' MET . . . . . 0.414 ' O ' ' HB2' ' A' ' 102' ' ' LYS . 7.6 tpt -101.65 -49.25 4.06 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.3 p -63.02 -23.95 34.67 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.824 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -23.07 66.93 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 121.827 -0.546 . . . . 0.0 110.565 175.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 99' ' ' MET . 22.7 mtpp -67.56 -26.43 66.29 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.301 176.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.95 -32.26 73.65 Favored 'General case' 0 C--O 1.211 -0.949 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -69.69 -19.98 63.56 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 122.079 0.943 . . . . 0.0 109.243 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' MET . . . . . 0.437 ' HA ' HD21 ' A' ' 108' ' ' ASN . 52.9 mtp -92.15 -19.12 22.6 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.03 179.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.3 mp -54.1 -45.52 99.05 Favored Pre-proline 0 N--CA 1.47 0.543 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -176.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.19 -22.23 74.02 Favored 'Trans proline' 0 C--N 1.366 1.471 0 CA-C-N 120.791 1.318 . . . . 0.0 112.552 176.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . 0.437 HD21 ' HA ' ' A' ' 105' ' ' MET . 32.0 m-80 -86.84 -45.19 11.1 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -69.53 -43.39 73.1 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.303 -177.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 13.9 t -86.36 -0.82 56.75 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -176.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 56.88 59.5 3.46 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 122.957 1.361 . . . . 0.0 109.973 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 57.5 mt -96.87 157.42 15.91 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 113.638 -1.619 . . . . 0.0 110.344 -178.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -78.77 43.87 0.51 Allowed 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 124.825 1.25 . . . . 0.0 112.492 -173.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 54.2 m -156.96 157.1 34.14 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 -176.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.0 m -136.83 140.88 42.75 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 38.4 mm . . . . . 0 N--CA 1.434 -1.253 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 175.498 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.812 ' SG ' ' HB2' ' A' ' 9' ' ' PRO . 4.1 t . . . . . 0 N--CA 1.427 -1.602 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 74.9 p -77.37 149.57 35.2 Favored 'General case' 0 C--N 1.271 -2.816 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.94 71.12 5.57 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 119.372 -0.931 . . . . 0.0 109.655 178.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 t -143.65 168.37 20.06 Favored 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 74.3 mt -129.7 115.35 18.07 Favored Pre-proline 0 C--N 1.308 -1.222 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.71 146.38 86.56 Favored 'Cis proline' 0 C--O 1.246 0.887 0 C-N-CA 123.863 -1.307 . . . . 0.0 111.981 0.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.812 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 91.1 Cg_endo -77.22 152.66 31.12 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.371 2.047 . . . . 0.0 112.802 -178.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 mm -109.36 111.64 37.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.0 m . . . . . 0 C--N 1.292 -1.915 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.229 -173.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 67.4 m . . . . . 0 N--CA 1.419 -1.977 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -106.95 101.83 11.23 Favored 'General case' 0 N--CA 1.42 -1.975 0 CA-C-O 122.176 0.989 . . . . 0.0 109.186 176.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -108.39 132.56 55.91 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.452 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.533 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.7 ptt-85 -67.58 114.19 6.02 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 121.832 0.825 . . . . 0.0 109.432 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.468 ' HB ' HE22 ' A' ' 81' ' ' GLN . 2.5 pp -68.0 -9.65 11.25 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 CA-C-N 115.254 -0.885 . . . . 0.0 113.203 -174.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -77.42 -20.52 54.46 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.519 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.3 pt20 -81.52 -20.98 38.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -89.27 -4.86 58.0 Favored 'General case' 0 CA--C 1.477 -1.84 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.623 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -55.92 -32.71 64.03 Favored 'General case' 0 C--O 1.218 -0.597 0 O-C-N 124.03 0.831 . . . . 0.0 110.808 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -66.28 -56.66 10.14 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -54.22 -51.21 65.17 Favored 'General case' 0 C--O 1.218 -0.59 0 O-C-N 123.827 0.704 . . . . 0.0 109.715 178.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -50.68 -60.52 2.95 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 124.062 0.945 . . . . 0.0 112.422 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -67.84 -35.33 78.4 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.736 -173.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -73.99 -30.27 62.39 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.681 -177.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.9 mt -84.54 -24.64 29.21 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 71.3 p -84.76 -12.93 52.69 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.196 -1.402 . . . . 0.0 110.129 175.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.0 t -88.49 149.97 23.37 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.645 177.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.43 ' CZ ' ' HA ' ' A' ' 96' ' ' VAL . 50.7 m-85 . . . . . 0 N--CA 1.434 -1.264 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.452 -0.364 0 CA-C-O 120.583 0.23 . . . . 0.0 111.422 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -73.76 -45.05 54.22 Favored 'General case' 0 CA--C 1.491 -1.294 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.2 m -56.63 -36.38 69.41 Favored 'General case' 0 C--O 1.213 -0.837 0 O-C-N 123.907 0.754 . . . . 0.0 110.333 179.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 40.2 mt -79.3 -47.35 16.0 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.955 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.6 t -69.28 -50.39 47.35 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.765 -175.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 7.5 t -52.36 -43.43 64.67 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 124.178 0.991 . . . . 0.0 110.048 175.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.437 ' HA ' ' CD ' ' A' ' 64' ' ' GLN . 8.1 t30 -72.06 -23.76 61.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.373 -176.275 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -83.83 -48.18 10.33 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.255 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.525 ' O ' ' HG2' ' A' ' 71' ' ' GLN . 3.7 pp -65.21 -34.0 77.34 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-O 121.214 0.531 . . . . 0.0 111.037 -177.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.437 ' CD ' ' HA ' ' A' ' 61' ' ' ASN . 13.4 pt20 -69.31 -15.57 63.37 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.178 0.591 . . . . 0.0 111.865 -176.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -84.58 -11.44 56.01 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.479 0.657 . . . . 0.0 110.301 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 11.6 t -82.74 163.45 3.03 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 174.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 46.0 mt-10 -47.47 144.06 3.25 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.408 0.683 . . . . 0.0 111.657 176.213 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -63.19 -28.93 70.39 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -175.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.501 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 4.0 pt20 -80.0 -14.86 58.25 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.507 0.67 . . . . 0.0 110.399 177.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.501 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.7 m -110.94 -7.09 14.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.156 -173.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 72.0 mt-30 -62.95 -40.33 97.36 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.092 0.472 . . . . 0.0 110.347 177.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.402 ' O ' ' HB ' ' A' ' 75' ' ' ILE . 32.1 p -77.34 -23.83 50.86 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.419 176.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -71.0 -32.03 68.73 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.328 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.08 -27.01 68.81 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.815 177.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.416 ' O ' HG21 ' A' ' 79' ' ' VAL . 31.0 mm -69.55 -32.5 53.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.734 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -70.8 -41.64 71.37 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 106.465 -1.679 . . . . 0.0 106.465 -174.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.418 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 0.1 OUTLIER -56.99 -44.07 82.34 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 112.492 -2.14 . . . . 0.0 110.584 -179.025 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 15.8 t -59.41 -45.96 93.09 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.584 0 O-C-N 124.079 0.862 . . . . 0.0 109.59 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.416 HG21 ' O ' ' A' ' 75' ' ' ILE . 40.1 t -65.53 -46.25 90.27 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.89 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -175.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -54.64 -51.85 64.12 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.196 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.468 HE22 ' HB ' ' A' ' 26' ' ' ILE . 3.6 pt20 -76.43 -34.46 58.77 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -175.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.54 -33.89 67.15 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.834 0.349 . . . . 0.0 111.098 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 3.9 pt20 -76.37 -35.69 58.55 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.892 179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -71.1 -35.87 71.97 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.088 -176.984 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -68.63 -30.04 68.67 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 121.221 0.534 . . . . 0.0 110.7 -176.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.455 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.1 mm? -86.28 -37.48 18.51 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.982 175.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -60.91 -34.81 75.24 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.983 0.913 . . . . 0.0 111.868 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -75.62 -4.83 42.32 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.507 0.67 . . . . 0.0 111.738 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -105.24 -132.52 7.38 Favored Glycine 0 N--CA 1.428 -1.837 0 N-CA-C 110.984 -0.847 . . . . 0.0 110.984 178.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -88.62 -23.78 22.98 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 120.781 0.325 . . . . 0.0 111.686 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 157.98 -94.44 0.14 Allowed Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . 0.45 ' HA3' HD11 ' A' ' 86' ' ' LEU . . . 73.05 -36.91 0.76 Allowed Glycine 0 C--O 1.202 -1.847 0 N-CA-C 115.421 0.929 . . . . 0.0 115.421 176.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -49.32 -29.23 5.74 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 124.118 0.967 . . . . 0.0 113.462 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -77.03 -40.1 47.71 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 122.227 0.211 . . . . 0.0 111.204 178.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -79.63 -45.88 18.25 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.455 HG21 ' HG ' ' A' ' 86' ' ' LEU . 84.4 t -62.22 -23.03 30.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 C-N-CA 125.29 1.436 . . . . 0.0 111.07 177.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -42.58 -52.34 4.82 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.427 1.091 . . . . 0.0 112.732 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -60.12 -18.21 45.65 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.752 0.821 . . . . 0.0 112.778 -178.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 5.6 tpt -106.01 -47.09 3.93 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -177.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.1 p -64.78 -23.78 34.15 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-O 120.899 0.381 . . . . 0.0 111.527 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' A' ' 105' ' ' MET . 0.0 OUTLIER -61.69 -25.31 67.33 Favored 'General case' 0 C--O 1.218 -0.599 0 O-C-N 121.791 -0.568 . . . . 0.0 110.966 173.567 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -65.47 -27.93 68.85 Favored 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 122.499 0.32 . . . . 0.0 110.207 177.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.462 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -63.36 -36.18 82.87 Favored 'General case' 0 C--O 1.202 -1.401 0 CA-C-O 121.948 0.88 . . . . 0.0 109.001 175.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -76.82 -16.06 59.55 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.3 -178.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' MET . . . . . 0.505 ' HG3' ' O ' ' A' ' 101' ' ' LYS . 68.4 mtp -91.57 -14.7 29.83 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.057 178.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.462 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 96.9 mt -51.46 -50.09 78.61 Favored Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 123.559 0.537 . . . . 0.0 112.351 -178.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 19.5 Cg_endo -61.38 -26.3 81.28 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.817 1.678 . . . . 0.0 112.663 177.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -83.1 -28.3 29.58 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-O 121.358 0.599 . . . . 0.0 109.616 -177.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -84.33 -47.85 10.31 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.452 0.644 . . . . 0.0 111.022 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 88.4 m -82.63 0.58 42.44 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -175.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 60.2 t30 56.87 61.68 2.53 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 122.175 0.988 . . . . 0.0 109.963 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.415 ' C ' ' H ' ' A' ' 114' ' ' CYS . 74.9 mt -95.09 158.52 15.43 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.735 -178.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -72.55 17.65 0.11 Allowed 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.93 0.892 . . . . 0.0 113.318 -172.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.415 ' H ' ' C ' ' A' ' 112' ' ' LEU . 83.1 m -148.31 158.01 43.83 Favored 'General case' 0 C--N 1.268 -2.949 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 -169.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 31.9 p -134.69 146.88 49.9 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 33.6 mm . . . . . 0 C--N 1.303 -1.431 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 177.646 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.479 0 N-CA-C 111.286 -0.726 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.543 ' O ' ' HA ' ' A' ' 11' ' ' CYS . 48.6 mtm180 -76.47 141.07 41.44 Favored 'General case' 0 CA--C 1.485 -1.535 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 66.7 m -132.92 144.73 50.35 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 51.8 p -83.38 154.71 23.88 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.85 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -85.86 69.58 10.58 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.5 m -158.6 168.23 27.45 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 81.5 mt -128.22 123.16 22.38 Favored Pre-proline 0 C--N 1.309 -1.192 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -71.53 142.76 74.42 Favored 'Cis proline' 0 C--O 1.244 0.809 0 C-N-CA 123.642 -1.399 . . . . 0.0 112.61 0.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.88 142.49 39.15 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 122.353 2.035 . . . . 0.0 110.857 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.495 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 44.8 mm -101.68 107.72 22.13 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.262 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 2' ' ' ARG . 77.5 m -104.06 131.72 51.03 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 121.899 0.856 . . . . 0.0 111.618 -178.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -90.1 157.36 45.63 Favored Pre-proline 0 C--N 1.297 -1.685 0 CA-C-N 113.946 -1.479 . . . . 0.0 111.435 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.91 -6.78 17.8 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 122.881 2.388 . . . . 0.0 113.66 -177.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -144.16 160.36 41.06 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . 0.473 ' HA2' ' HG3' ' A' ' 2' ' ' ARG . . . -153.0 90.32 0.13 Allowed Glycine 0 N--CA 1.419 -2.443 0 C-N-CA 118.787 -1.673 . . . . 0.0 114.198 178.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -70.76 -27.55 64.02 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 174.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.554 ' HA ' ' OE1' ' A' ' 69' ' ' GLN . 12.6 t70 -98.47 105.59 17.76 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.323 -1.308 . . . . 0.0 107.831 176.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -141.84 61.37 12.69 Favored Pre-proline 0 C--N 1.304 -1.372 0 CA-C-O 121.055 0.455 . . . . 0.0 111.703 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.48 ' HA ' ' SG ' ' A' ' 22' ' ' CYS . 98.3 Cg_endo -75.54 8.02 2.81 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 123.042 2.495 . . . . 0.0 113.714 -172.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.42 ' HD3' ' H ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -102.87 -31.17 10.4 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 -179.3 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -135.6 46.07 1.06 Allowed Glycine 0 N--CA 1.419 -2.462 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.96 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.48 ' SG ' ' HA ' ' A' ' 19' ' ' PRO . 33.7 m -57.67 121.06 9.49 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-N 114.558 -0.821 . . . . 0.0 110.65 175.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -101.73 112.46 25.06 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 122.092 0.948 . . . . 0.0 109.994 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.404 HG23 ' CB ' ' A' ' 74' ' ' ALA . 3.0 mp -120.08 131.22 73.02 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.284 0 N-CA-C 105.637 -1.986 . . . . 0.0 105.637 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.477 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 24.4 ptt-85 -73.03 123.52 23.69 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 121.099 0.476 . . . . 0.0 109.744 -176.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.75 -16.65 21.38 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -174.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.439 ' CD ' ' HB2' ' A' ' 25' ' ' ARG . 17.8 pm0 -75.77 -18.31 59.57 Favored 'General case' 0 N--CA 1.421 -1.915 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.973 -178.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 6.3 pt20 -83.83 -19.53 34.8 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -91.75 3.26 55.52 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.624 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -59.11 -34.47 72.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 123.762 0.664 . . . . 0.0 109.317 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -69.73 -50.35 44.35 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.057 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.81 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.5 OUTLIER -58.11 -48.73 79.31 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 120.772 0.32 . . . . 0.0 110.338 178.408 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -52.52 -52.15 56.05 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 123.44 0.696 . . . . 0.0 111.651 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.4 ptm -70.64 -38.41 73.86 Favored 'General case' 0 C--O 1.205 -1.288 0 C-N-CA 120.676 -0.41 . . . . 0.0 111.062 -177.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.81 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 1.4 p80 -70.83 -23.36 62.34 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.371 -0.532 . . . . 0.0 111.926 -176.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 99' ' ' MET . 91.5 mt -88.86 -39.08 14.09 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.218 174.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 41.1 p -83.61 -22.79 32.13 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 118.21 -1.396 . . . . 0.0 112.31 -175.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 t -92.5 121.74 34.25 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.903 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -87.06 93.14 9.28 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 169.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -65.26 169.92 5.21 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.025 -1.443 . . . . 0.0 112.455 -171.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 26.7 p90 -89.18 -31.73 17.8 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -166.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.42 -6.06 56.03 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 121.536 0.684 . . . . 0.0 110.09 -176.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 50.5 mt -78.52 86.9 4.51 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.236 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -95.78 -51.14 4.62 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 26.5 mmt -129.85 76.72 1.74 Allowed 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.641 ' HA ' ' OE1' ' A' ' 52' ' ' GLN . . . -80.86 78.83 7.62 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 114.823 -1.08 . . . . 0.0 112.022 -175.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 47.8 t -123.41 -70.76 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 176.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -137.48 96.37 3.24 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.51 0.671 . . . . 0.0 111.928 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -146.62 120.45 5.15 Favored Pre-proline 0 C--N 1.303 -1.45 0 N-CA-C 105.712 -1.958 . . . . 0.0 105.712 176.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -53.23 -37.45 80.42 Favored 'Trans proline' 0 N--CA 1.484 0.947 0 C-N-CA 123.444 2.763 . . . . 0.0 114.625 -172.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -69.74 -15.08 63.08 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -176.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.641 ' OE1' ' HA ' ' A' ' 46' ' ' ALA . 19.1 mt-30 -68.44 -40.47 81.12 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -76.96 3.79 11.4 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.247 -0.888 . . . . 0.0 113.173 -175.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.604 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 11.8 pt20 -58.24 -36.4 73.14 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 121.102 0.477 . . . . 0.0 110.402 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -26.66 68.13 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.344 -178.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -83.13 -41.6 18.34 Favored 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.8 m -56.67 -31.52 64.51 Favored 'General case' 0 C--O 1.212 -0.882 0 O-C-N 123.708 0.63 . . . . 0.0 110.121 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 65.8 mt -82.99 -48.06 11.06 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.232 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.2 t -65.94 -50.07 65.72 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -178.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.536 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.7 t -59.31 -30.8 68.61 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.101 0.56 . . . . 0.0 110.29 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.477 ' HA ' ' NE2' ' A' ' 64' ' ' GLN . 27.5 t-20 -78.7 -25.04 44.69 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.43 0.633 . . . . 0.0 111.471 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -84.9 -42.9 14.58 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.198 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.536 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.7 pp -68.49 -31.99 71.65 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.647 -177.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.477 ' NE2' ' HA ' ' A' ' 61' ' ' ASN . 9.3 pt20 -71.2 -10.36 59.63 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -177.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -86.11 -12.43 50.04 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 121.816 0.817 . . . . 0.0 109.424 176.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 15.6 t -83.46 163.28 2.97 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.24 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 174.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.432 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 1.6 mp0 -48.2 142.23 5.58 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 124.187 0.995 . . . . 0.0 111.738 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -53.65 -35.58 61.15 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 124.767 1.227 . . . . 0.0 112.915 -174.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.554 ' OE1' ' HA ' ' A' ' 17' ' ' ASP . 3.2 pt20 -87.49 -20.81 26.02 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.221 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 59.5 m -95.17 -8.84 35.16 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.681 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.444 ' HB3' HD21 ' A' ' 112' ' ' LEU . 23.0 mt-30 -57.33 -43.12 83.1 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.87 176.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 6.5 p -80.87 -24.21 38.49 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.163 0.506 . . . . 0.0 111.177 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -67.92 -33.18 74.19 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.483 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.449 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.72 -31.29 68.15 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.459 177.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.422 HD12 HD21 ' A' ' 63' ' ' LEU . 21.1 mm -73.18 -27.57 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.238 0 CA-C-N 115.095 -0.957 . . . . 0.0 109.94 -177.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -74.54 -39.81 62.11 Favored 'General case' 0 CA--C 1.484 -1.589 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 -175.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -56.22 -40.42 74.04 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 112.626 -2.079 . . . . 0.0 109.215 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 74' ' ' ALA . 25.9 t -60.64 -47.9 90.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.929 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 42.3 t -61.6 -48.71 87.51 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.198 -174.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -61.75 -41.53 97.79 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.655 -175.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -79.97 -28.82 39.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.634 0.254 . . . . 0.0 111.163 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.98 -41.12 60.15 Favored 'General case' 0 C--N 1.311 -1.077 0 O-C-N 122.19 -0.319 . . . . 0.0 111.314 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -69.48 -35.63 75.78 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.126 -178.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.458 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -72.01 -36.23 69.66 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.178 -178.388 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.458 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 5.8 pt20 -72.8 -34.51 66.94 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.355 -174.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.459 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 2.4 mm? -76.79 -36.62 56.85 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.62 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -66.39 -40.35 89.62 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.623 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -75.12 -17.46 60.42 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.367 0.604 . . . . 0.0 110.157 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -83.08 -65.52 1.59 Allowed Glycine 0 N--CA 1.421 -2.357 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -158.43 -26.2 0.08 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -175.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.459 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 146.38 -114.97 0.77 Allowed Glycine 0 CA--C 1.492 -1.397 0 N-CA-C 108.476 -1.85 . . . . 0.0 108.476 -174.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.23 -32.17 2.3 Favored Glycine 0 C--O 1.196 -2.252 0 CA-C-O 118.909 -0.94 . . . . 0.0 114.488 172.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -48.1 -32.66 7.11 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.921 0.888 . . . . 0.0 113.396 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -72.87 -38.12 67.11 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.964 0.412 . . . . 0.0 111.429 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.448 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 20.0 pt20 -85.43 -44.19 12.96 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 121.475 0.655 . . . . 0.0 109.662 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 92.0 t -61.19 -22.53 27.55 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 C-N-CA 125.412 1.485 . . . . 0.0 110.933 176.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -46.44 -46.23 18.63 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.448 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 20.1 pt20 -63.55 -18.5 63.92 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -178.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.444 ' O ' HD23 ' A' ' 36' ' ' LEU . 4.7 tpt -100.43 -46.83 5.11 Favored 'General case' 0 N--CA 1.438 -1.072 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -177.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.9 p -62.08 -26.17 39.38 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-O 120.834 0.35 . . . . 0.0 111.771 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -23.42 67.34 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.805 -0.559 . . . . 0.0 111.345 177.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -65.93 -25.59 67.21 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.024 178.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.22 -28.82 69.04 Favored 'General case' 0 C--O 1.203 -1.385 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.332 176.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.17 -24.52 62.26 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.265 1.031 . . . . 0.0 109.083 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 49.0 mtm -92.37 -13.02 30.78 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.528 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.464 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.1 OUTLIER -54.0 -46.75 98.52 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.226 0.61 . . . . 0.0 111.06 -177.965 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.579 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 20.3 Cg_endo -60.72 -26.89 83.88 Favored 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 121.382 1.388 . . . . 0.0 112.666 175.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -77.97 -46.98 19.62 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -64.64 -47.96 76.61 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.305 -0.862 . . . . 0.0 112.44 -177.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 10.2 t -84.08 -3.32 57.99 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.2 0.524 . . . . 0.0 109.701 -175.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.2 t30 58.17 64.23 1.55 Allowed 'General case' 0 C--O 1.247 0.944 0 CA-C-O 123.072 1.415 . . . . 0.0 110.717 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.444 HD21 ' HB3' ' A' ' 71' ' ' GLN . 31.6 mt -101.63 158.52 16.03 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 112.992 -1.913 . . . . 0.0 109.015 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -72.92 44.68 0.14 Allowed 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 124.368 1.067 . . . . 0.0 112.988 -176.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.579 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 67.0 m -160.47 152.14 19.75 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -175.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.8 m -151.33 114.92 4.87 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 6.3 pt . . . . . 0 N--CA 1.428 -1.547 0 CA-C-O 118.459 -0.781 . . . . 0.0 112.546 -177.448 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.325 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.4 mtt85 -95.85 145.16 25.59 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 117.093 0.447 . . . . 0.0 110.538 -178.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 72.6 m -129.12 148.88 51.1 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 177.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.4 p -75.65 142.43 42.58 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 176.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.66 68.88 10.55 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.825 0.821 . . . . 0.0 109.976 178.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.1 t -150.5 170.96 17.86 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 105.936 -1.875 . . . . 0.0 105.936 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.3 mp -127.39 125.35 23.91 Favored Pre-proline 0 C--N 1.298 -1.635 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.29 143.26 76.7 Favored 'Cis proline' 0 C--O 1.243 0.76 0 C-N-CA 123.722 -1.366 . . . . 0.0 111.985 -1.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.77 129.76 21.72 Favored 'Trans proline' 0 C--O 1.254 1.282 0 C-N-CA 122.122 1.882 . . . . 0.0 111.43 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 37.6 mm -92.41 111.69 24.75 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 75.9 m -106.5 137.79 43.86 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.449 0.642 . . . . 0.0 111.305 -175.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -112.87 143.06 28.33 Favored Pre-proline 0 N--CA 1.415 -2.186 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.721 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -85.23 28.03 0.58 Allowed 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 123.056 2.504 . . . . 0.0 111.567 -179.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -120.06 135.4 54.95 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 115.271 -0.877 . . . . 0.0 108.896 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 148.68 -94.26 0.16 Allowed Glycine 0 CA--C 1.476 -2.351 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.486 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 20.6 tp -156.3 -56.72 0.09 Allowed 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 121.457 0.646 . . . . 0.0 109.921 -174.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -70.01 111.64 5.84 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.876 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.4 ' ND2' ' HA2' ' A' ' 21' ' ' GLY . 23.0 t-20 -134.62 85.14 37.53 Favored Pre-proline 0 C--N 1.296 -1.748 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -81.99 -23.31 4.63 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 121.665 1.576 . . . . 0.0 111.587 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -144.16 -53.97 0.34 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.126 -1.805 . . . . 0.0 106.126 177.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.4 ' HA2' ' ND2' ' A' ' 18' ' ' ASN . . . 152.59 -53.5 0.47 Allowed Glycine 0 CA--C 1.473 -2.572 0 N-CA-C 105.527 -3.029 . . . . 0.0 105.527 -178.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 60.0 m -86.23 127.75 34.8 Favored 'General case' 0 N--CA 1.409 -2.494 0 CA-C-N 113.231 -1.485 . . . . 0.0 108.576 170.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -107.6 117.07 33.12 Favored 'General case' 0 N--CA 1.416 -2.137 0 CA-C-O 121.871 0.843 . . . . 0.0 108.948 172.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.405 ' N ' HD11 ' A' ' 24' ' ' ILE . 3.3 mp -111.69 143.34 21.69 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.64 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 -177.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.514 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.2 ptt180 -69.72 116.27 9.92 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 118.399 0.545 . . . . 0.0 110.382 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 pp -63.66 -14.8 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.395 0.617 . . . . 0.0 112.393 -175.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -73.43 -22.9 60.09 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.698 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.0 pt20 -83.73 -18.5 37.67 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -94.87 -0.7 53.8 Favored 'General case' 0 CA--C 1.48 -1.715 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.441 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -59.14 -30.97 68.53 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 123.751 0.657 . . . . 0.0 111.273 -178.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -71.08 -52.56 18.68 Favored 'General case' 0 C--O 1.216 -0.662 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.832 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 1.6 t -56.47 -46.79 80.22 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 124.173 0.989 . . . . 0.0 109.032 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -53.11 -56.02 19.48 Favored 'General case' 0 N--CA 1.425 -1.692 0 C-N-CA 124.926 1.291 . . . . 0.0 111.349 174.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.7 ptm -70.29 -33.66 71.82 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.397 -173.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.832 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -69.89 -23.42 63.25 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.631 -178.72 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.9 mt -88.54 -36.14 16.54 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.862 175.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 72.4 p -80.15 -19.78 46.41 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 119.161 -1.016 . . . . 0.0 112.809 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 66.4 p -89.57 135.43 33.61 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -178.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -116.05 113.97 23.92 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 172.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -83.52 169.23 15.68 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -176.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 9.0 p90 -108.7 -28.56 9.17 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.544 -173.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.417 ' O ' ' HG2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -82.56 10.95 6.32 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 119.676 -0.81 . . . . 0.0 111.467 -174.562 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -66.82 106.7 1.95 Allowed 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 174.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 33.2 mmt180 -114.68 0.57 13.93 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.138 0.494 . . . . 0.0 110.678 -175.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 20.2 ptm -161.67 29.88 0.13 Allowed 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.463 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.71 89.23 3.07 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-O 121.445 0.64 . . . . 0.0 111.702 -177.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 61.1 t -122.39 -61.96 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 105.566 -2.012 . . . . 0.0 105.566 172.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -130.88 97.76 4.42 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 105.877 -1.897 . . . . 0.0 105.877 170.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -144.59 129.95 9.49 Favored Pre-proline 0 C--N 1.286 -2.171 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -173.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.55 -26.99 83.83 Favored 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 123.084 2.523 . . . . 0.0 113.034 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -74.61 -9.56 58.69 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -70.87 -31.64 68.38 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -76.59 10.71 1.98 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.765 -174.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -61.05 -37.6 83.23 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.942 0.877 . . . . 0.0 109.594 175.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.417 ' HB2' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -74.12 -23.68 59.33 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.252 178.932 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.92 -38.73 61.74 Favored 'General case' 0 CA--C 1.495 -1.166 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.082 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 m -56.97 -35.59 69.33 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 42.4 mt -73.41 -51.67 16.45 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.247 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.6 t -60.78 -50.5 73.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 122.776 0.43 . . . . 0.0 111.277 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.543 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.4 t -59.44 -33.63 71.51 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 124.168 0.987 . . . . 0.0 110.161 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.411 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 16.9 t-20 -79.22 -23.21 43.93 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.517 0.675 . . . . 0.0 110.411 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -82.26 -48.26 11.44 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.857 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.543 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.6 pp -67.41 -33.36 75.02 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.431 -177.299 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -69.59 -12.77 61.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.982 -176.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 68.6 mm-40 -89.39 -11.01 44.43 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.464 0.649 . . . . 0.0 109.569 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -80.84 164.45 3.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 174.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -45.6 136.5 5.81 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.828 0.451 . . . . 0.0 110.9 173.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.454 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 17.2 ptpt -57.9 -33.99 69.33 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -174.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.413 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 24.5 pt20 -76.11 -20.46 57.62 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.835 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.413 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 58.8 m -102.29 -9.38 20.44 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.776 -174.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.454 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 29.6 mt-30 -59.45 -42.62 92.38 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 121.17 0.509 . . . . 0.0 110.773 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.2 p -78.82 -24.22 44.62 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.279 0.562 . . . . 0.0 111.406 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -71.43 -32.54 68.49 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.442 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.493 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.84 -29.85 69.75 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.766 176.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.453 ' O ' HG23 ' A' ' 79' ' ' VAL . 28.2 mm -68.9 -35.64 70.27 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.654 -178.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -63.48 -44.62 93.88 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -176.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.415 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 4.6 mt-30 -61.65 -41.92 98.18 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 113.322 -1.763 . . . . 0.0 110.32 -177.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 74' ' ' ALA . 38.2 t -53.31 -47.56 57.23 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.082 0 O-C-N 124.413 1.07 . . . . 0.0 109.359 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 75' ' ' ILE . 41.4 t -67.76 -45.83 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.091 0 CA-C-N 115.476 -0.783 . . . . 0.0 108.939 -174.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -56.94 -51.61 68.48 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.208 -178.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 20.3 pt20 -72.61 -31.74 65.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.648 -177.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.18 -38.46 66.15 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.871 0.367 . . . . 0.0 111.37 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -75.72 -34.75 60.37 Favored 'General case' 0 C--N 1.312 -1.043 0 C-N-CA 120.014 -0.674 . . . . 0.0 110.144 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.82 -31.7 65.0 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.14 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -71.32 -33.33 69.57 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.579 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.567 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 4.1 mm? -78.66 -37.04 42.87 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.009 175.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -58.03 -41.73 83.85 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.924 0.89 . . . . 0.0 110.732 179.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -79.28 -14.41 59.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.777 -176.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -96.75 -105.88 2.3 Favored Glycine 0 N--CA 1.425 -2.04 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.988 -176.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -102.92 -17.35 15.53 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.145 0.498 . . . . 0.0 111.649 -175.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.567 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 128.08 -93.12 0.36 Allowed Glycine 0 N--CA 1.428 -1.889 0 N-CA-C 108.601 -1.8 . . . . 0.0 108.601 -173.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.436 ' HA3' HD11 ' A' ' 86' ' ' LEU . . . 72.25 -37.37 0.67 Allowed Glycine 0 C--O 1.193 -2.46 0 N-CA-C 115.77 1.068 . . . . 0.0 115.77 172.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -49.63 -27.7 4.93 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 118.538 1.169 . . . . 0.0 113.111 -178.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.453 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 4.5 pt20 -67.3 -45.0 77.84 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 120.67 0.271 . . . . 0.0 110.477 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.459 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 19.2 pt20 -86.51 -42.64 13.37 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 121.521 0.677 . . . . 0.0 111.075 -175.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.438 HG21 ' HG ' ' A' ' 86' ' ' LEU . 91.0 t -64.57 -22.95 32.33 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.191 0 C-N-CA 125.108 1.363 . . . . 0.0 111.766 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -48.1 -45.09 32.37 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.459 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 28.8 pt20 -61.3 -21.79 64.29 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 122.961 0.504 . . . . 0.0 112.322 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 3.3 tpt -100.42 -44.89 5.75 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -175.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.95 -24.13 34.88 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.516 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -23.66 67.38 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.755 -0.59 . . . . 0.0 110.578 176.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -63.26 -29.25 70.61 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.444 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -63.71 -29.88 71.05 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 121.191 0.52 . . . . 0.0 110.266 177.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -73.14 -17.23 61.41 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.792 0.806 . . . . 0.0 109.511 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 50.7 mtp -92.14 -20.61 21.06 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.331 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 5.0 mp -52.15 -45.51 93.84 Favored Pre-proline 0 N--CA 1.468 0.43 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -59.79 -22.5 68.3 Favored 'Trans proline' 0 C--N 1.369 1.624 0 C-N-CA 121.141 1.227 . . . . 0.0 112.862 176.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -89.45 -45.82 9.16 Favored 'General case' 0 N--CA 1.411 -2.39 0 CA-C-O 121.126 0.488 . . . . 0.0 109.971 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -68.31 -38.95 82.09 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.868 -176.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.458 ' SG ' HD22 ' A' ' 112' ' ' LEU . 16.7 t -87.3 -6.46 58.51 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -179.01 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.1 t30 57.74 64.4 1.57 Allowed 'General case' 0 CA--C 1.508 -0.638 0 C-N-CA 124.91 1.284 . . . . 0.0 110.082 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.458 HD22 ' SG ' ' A' ' 110' ' ' CYS . 47.5 mt -96.04 159.46 14.95 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 113.372 -1.74 . . . . 0.0 109.935 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -71.7 37.53 0.06 Allowed 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 123.612 0.765 . . . . 0.0 112.709 -177.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.402 ' H ' ' C ' ' A' ' 112' ' ' LEU . 74.4 m -157.15 154.58 29.55 Favored 'General case' 0 C--N 1.28 -2.416 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -175.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 12.0 p -149.74 134.14 17.42 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 43.0 mm . . . . . 0 C--N 1.307 -1.241 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -178.872 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.814 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.7 mmt180 -86.27 141.71 29.08 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-N 117.546 0.673 . . . . 0.0 110.002 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 63.7 m -123.37 149.28 45.14 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 177.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 77.5 p -86.96 157.74 19.41 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.865 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -91.98 76.81 5.46 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.305 0.574 . . . . 0.0 109.594 176.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.9 t -152.01 172.0 16.96 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.6 mp -128.33 117.77 20.22 Favored Pre-proline 0 N--CA 1.435 -1.206 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.34 147.74 90.18 Favored 'Cis proline' 0 C--O 1.246 0.908 0 C-N-CA 123.596 -1.418 . . . . 0.0 111.801 -0.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -69.92 139.57 39.98 Favored 'Trans proline' 0 C--O 1.247 0.952 0 C-N-CA 122.164 1.909 . . . . 0.0 111.094 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.531 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 44.3 mm -97.44 111.44 27.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.955 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 73.6 m -105.35 125.0 50.49 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-O 121.491 0.662 . . . . 0.0 110.235 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -84.36 155.42 63.06 Favored Pre-proline 0 C--N 1.284 -2.244 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.422 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -70.58 -8.23 23.13 Favored 'Trans proline' 0 C--O 1.24 0.609 0 C-N-CA 122.657 2.238 . . . . 0.0 113.211 -177.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.454 ' CG ' ' H ' ' A' ' 15' ' ' GLY . 23.3 t70 -161.79 -148.16 0.14 Allowed 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . 0.454 ' H ' ' CG ' ' A' ' 14' ' ' ASP . . . 161.51 -42.09 0.4 Allowed Glycine 0 N--CA 1.435 -1.422 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -141.96 -58.76 0.47 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -165.59 92.59 0.54 Allowed 'General case' 0 C--N 1.284 -2.24 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -130.46 75.15 79.47 Favored Pre-proline 0 C--N 1.297 -1.711 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.215 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -73.25 -40.02 1.86 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 121.956 1.771 . . . . 0.0 111.237 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.16 -34.11 17.96 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 124.57 -67.94 0.5 Allowed Glycine 0 CA--C 1.464 -3.123 0 N-CA-C 107.955 -2.058 . . . . 0.0 107.955 -177.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 67.8 m -67.1 133.09 49.17 Favored 'General case' 0 N--CA 1.418 -2.05 0 CA-C-N 114.307 -0.946 . . . . 0.0 109.414 172.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -107.11 108.54 20.05 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-O 121.869 0.843 . . . . 0.0 108.893 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.449 ' N ' HD13 ' A' ' 24' ' ' ILE . 3.0 mp -102.49 141.3 18.84 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.691 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -175.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.486 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 20.6 ptt180 -67.11 114.14 5.63 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 121.672 0.749 . . . . 0.0 111.12 -177.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.23 -15.65 12.95 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -73.75 -23.19 59.7 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.835 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.3 pt20 -83.37 -33.31 25.83 Favored 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.721 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -82.15 -8.64 59.66 Favored 'General case' 0 CA--C 1.474 -1.971 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.021 -177.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -58.09 -30.27 66.11 Favored 'General case' 0 C--N 1.314 -0.937 0 O-C-N 124.17 0.919 . . . . 0.0 110.855 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -70.18 -54.66 11.9 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -54.08 -50.52 66.6 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.396 1.079 . . . . 0.0 108.524 -178.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -53.86 -61.15 2.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 125.504 1.522 . . . . 0.0 112.581 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -67.17 -34.87 78.46 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.831 0.348 . . . . 0.0 111.825 -172.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.424 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 8.9 t-80 -67.51 -33.13 74.46 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.804 -177.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 91.4 mt -84.64 -34.68 23.03 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.433 ' CG2' ' HB2' ' A' ' 82' ' ' ALA . 41.8 p -79.71 -21.01 45.14 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 118.83 -1.148 . . . . 0.0 113.165 -176.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 57.2 p -88.68 154.73 20.07 Favored 'General case' 0 N--CA 1.424 -1.727 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.829 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -128.09 132.0 49.03 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 173.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.431 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 5.2 t0 -85.65 171.71 11.44 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -176.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 55.3 p90 -102.78 -34.57 8.97 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -172.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.81 8.18 21.0 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.993 -175.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.431 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 60.0 mt -65.19 102.8 0.69 Allowed 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 175.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -94.16 -37.96 11.32 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-O 121.107 0.48 . . . . 0.0 111.212 -177.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 20.5 ptm -155.29 26.34 0.41 Allowed 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.96 -177.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.17 91.65 6.18 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.514 -177.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 92.0 t -116.3 -47.88 4.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.993 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -144.81 107.73 4.5 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-O 121.57 0.7 . . . . 0.0 110.607 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 30.8 p30 -157.36 154.25 25.23 Favored Pre-proline 0 C--N 1.302 -1.466 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.493 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 12.6 Cg_endo -55.39 -30.23 72.03 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.352 2.701 . . . . 0.0 113.137 -178.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -68.21 -33.5 74.53 Favored 'General case' 0 C--O 1.206 -1.196 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -177.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -70.75 -20.77 62.6 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.867 0.365 . . . . 0.0 111.252 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.493 ' OE1' ' HA ' ' A' ' 50' ' ' PRO . 45.7 mt-30 -79.65 4.17 16.89 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.196 -178.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.576 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 13.7 pt20 -59.42 -39.49 83.66 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.637 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.424 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -67.08 -20.75 65.86 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.498 -177.944 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.3 tp -74.97 -52.27 11.57 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 175.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.7 m -55.31 -27.66 48.41 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.929 -178.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 50.1 mt -88.34 -51.37 5.78 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.958 178.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.44 -50.19 60.35 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.94 0.496 . . . . 0.0 112.129 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.54 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 10.1 t -59.37 -41.43 89.29 Favored 'General case' 0 CA--C 1.492 -1.274 0 C-N-CA 123.412 0.685 . . . . 0.0 109.664 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -72.08 -26.67 62.25 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.944 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.425 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 0.1 OUTLIER -78.27 -48.92 14.67 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.474 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.54 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.9 pp -67.61 -31.64 71.82 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.651 -177.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -74.23 -6.96 50.92 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.693 -178.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.7 -24.12 56.2 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 174.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.9 t -81.19 161.84 3.68 Favored 'Isoleucine or valine' 0 C--O 1.248 1.025 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.302 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.443 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 47.7 mt-10 -50.2 141.48 11.3 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.984 0.914 . . . . 0.0 112.263 176.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -62.57 -24.79 67.73 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -174.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.439 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 12.4 pt20 -82.55 -15.36 52.59 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.458 0.647 . . . . 0.0 110.533 178.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.439 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 64.2 m -107.81 -9.34 15.78 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.167 -174.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 76.9 mt-30 -59.33 -40.83 87.57 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 14.5 p -81.2 -24.54 37.4 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.488 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -67.74 -32.97 73.95 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.145 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.52 ' O ' HG21 ' A' ' 78' ' ' VAL . . . -61.57 -34.89 76.37 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.361 177.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.47 ' O ' HG23 ' A' ' 79' ' ' VAL . 30.8 mm -65.12 -37.18 79.57 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.787 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.274 -178.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -66.0 -43.18 88.45 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 -175.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.491 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.4 mt-30 -62.7 -41.22 99.01 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 113.47 -1.696 . . . . 0.0 109.402 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.52 HG21 ' O ' ' A' ' 74' ' ' ALA . 27.8 t -55.17 -46.82 77.87 Favored 'Isoleucine or valine' 0 C--N 1.356 0.859 0 O-C-N 123.769 0.668 . . . . 0.0 109.845 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 75' ' ' ILE . 21.2 t -70.07 -46.7 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.101 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -173.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -64.85 -35.25 80.53 Favored 'General case' 0 N--CA 1.424 -1.734 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.183 -174.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 3.8 pt20 -85.61 -26.35 26.13 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.979 0.419 . . . . 0.0 111.607 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.464 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -72.27 -44.94 62.07 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.105 0.478 . . . . 0.0 110.22 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -69.21 -29.55 67.54 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.4 tttt -65.04 -46.26 81.98 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 124.477 1.111 . . . . 0.0 111.332 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 2.7 pt20 -69.07 -23.29 64.01 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-O 121.339 0.59 . . . . 0.0 110.791 -175.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.423 ' HG ' HG23 ' A' ' 96' ' ' VAL . 4.4 mm? -86.13 -36.0 19.83 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.918 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -65.13 -37.4 87.32 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 123.327 0.651 . . . . 0.0 110.981 177.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -82.02 0.47 40.13 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.677 0.751 . . . . 0.0 111.069 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -96.68 -120.15 3.83 Favored Glycine 0 N--CA 1.424 -2.119 0 N-CA-C 108.986 -1.646 . . . . 0.0 108.986 175.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -116.45 -56.56 2.28 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-O 121.114 0.483 . . . . 0.0 109.961 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -155.62 -141.07 3.13 Favored Glycine 0 CA--C 1.493 -1.29 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 -178.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 95.09 -30.3 8.27 Favored Glycine 0 C--O 1.202 -1.886 0 CA-C-O 119.128 -0.818 . . . . 0.0 113.227 177.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -49.44 -34.62 17.06 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 123.513 0.725 . . . . 0.0 112.812 -175.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -78.8 -33.24 46.38 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -85.45 -39.24 17.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.854 0.835 . . . . 0.0 110.092 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.423 HG23 ' HG ' ' A' ' 86' ' ' LEU . 84.5 t -63.72 -22.67 31.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.328 -1.305 . . . . 0.0 110.501 174.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -46.15 -47.34 17.55 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 123.429 0.455 . . . . 0.0 112.128 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -59.46 -21.55 60.24 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.159 0.504 . . . . 0.0 112.028 -178.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.9 tpt -104.07 -45.22 4.79 Favored 'General case' 0 N--CA 1.423 -1.79 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.747 -173.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.26 -24.01 31.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 CA-C-O 121.077 0.465 . . . . 0.0 110.765 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -22.66 66.48 Favored 'General case' 0 C--N 1.333 -0.118 0 O-C-N 121.91 -0.494 . . . . 0.0 111.017 176.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -66.2 -28.24 68.61 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.37 177.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.517 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -62.85 -35.34 79.65 Favored 'General case' 0 C--O 1.201 -1.476 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 176.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -68.01 -18.87 64.84 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.565 0.698 . . . . 0.0 110.026 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 36.1 mtp -92.67 -13.97 28.73 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.317 -178.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.517 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 1.7 mm? -51.15 -44.97 88.82 Favored Pre-proline 0 N--CA 1.476 0.839 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.471 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 18.5 Cg_endo -60.67 -31.04 91.61 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 121.387 1.391 . . . . 0.0 112.417 176.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -77.26 -36.02 54.76 Favored 'General case' 0 N--CA 1.427 -1.608 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -178.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -75.11 -49.57 19.19 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.454 0.645 . . . . 0.0 111.254 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 38.8 t -82.19 -2.24 51.65 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.456 -173.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 66.46 42.93 2.74 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 122.765 1.269 . . . . 0.0 110.19 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 68.4 mt -82.4 157.67 23.61 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.057 -178.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -74.74 31.44 0.09 Allowed 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.587 1.155 . . . . 0.0 112.895 -175.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 99.3 m -154.5 160.04 41.32 Favored 'General case' 0 C--N 1.28 -2.419 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -173.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 27.1 p -146.4 144.57 29.82 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 70.8 mt . . . . . 0 C--N 1.301 -1.528 0 CA-C-O 118.243 -0.884 . . . . 0.0 109.076 -178.159 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.41 ' HA3' ' O ' ' A' ' 12' ' ' PHE . . . . . . . . 0 CA--C 1.502 -0.765 0 N-CA-C 111.364 -0.695 . . . . 0.0 111.364 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 77.9 mtp180 -95.24 139.88 30.93 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 50.5 m -120.5 145.09 47.63 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-O 120.828 0.347 . . . . 0.0 111.631 -175.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.4 p -79.01 161.33 26.69 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.438 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -85.37 69.71 10.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.438 0.637 . . . . 0.0 109.765 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.8 t -143.01 169.66 17.15 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 34.7 mm -129.15 112.61 18.39 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 178.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -76.92 146.48 84.0 Favored 'Cis proline' 0 C--O 1.246 0.891 0 C-N-CA 123.969 -1.263 . . . . 0.0 109.919 -2.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -64.46 142.51 78.69 Favored 'Trans proline' 0 C--N 1.328 -0.549 0 C-N-CA 122.56 2.173 . . . . 0.0 112.065 -176.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.423 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 42.0 mm -92.35 116.15 32.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.6 m -104.63 121.85 44.39 Favored 'General case' 0 C--N 1.285 -2.198 0 CA-C-O 121.609 0.718 . . . . 0.0 110.736 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.41 ' O ' ' HA3' ' A' ' 1' ' ' GLY . 60.0 m-85 -100.79 142.36 24.46 Favored Pre-proline 0 N--CA 1.427 -1.577 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.386 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -79.64 -10.75 14.37 Favored 'Trans proline' 0 N--CA 1.454 -0.825 0 C-N-CA 122.387 2.058 . . . . 0.0 113.626 -177.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' ' 15' ' ' GLY . 19.4 t70 -137.41 -167.31 2.09 Favored 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -173.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . 0.424 ' H ' ' CG ' ' A' ' 14' ' ' ASP . . . 90.56 24.54 28.07 Favored Glycine 0 N--CA 1.432 -1.568 0 N-CA-C 111.399 -0.68 . . . . 0.0 111.399 -175.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.46 HD23 ' H ' ' A' ' 16' ' ' LEU . 1.9 pt? -101.41 -18.13 16.16 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 121.044 0.45 . . . . 0.0 111.352 -176.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -122.47 110.51 15.7 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -133.29 99.88 14.37 Favored Pre-proline 0 C--N 1.293 -1.876 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.415 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . 32.0 Cg_exo -63.07 -40.73 32.05 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.323 2.016 . . . . 0.0 109.423 174.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.533 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 4.1 mpt_? -126.68 -47.51 1.54 Allowed 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 172.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.26 38.45 4.8 Favored Glycine 0 CA--C 1.473 -2.574 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.487 -177.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 68.1 m -67.98 137.67 55.31 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 114.256 -0.972 . . . . 0.0 110.028 177.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -100.61 112.83 25.27 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-O 121.714 0.769 . . . . 0.0 109.216 175.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.9 mp -114.33 139.03 42.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.969 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 -175.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.449 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 21.4 ptt-85 -67.12 121.77 16.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.487 0.66 . . . . 0.0 111.616 -175.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.38 -18.91 19.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 115.536 -0.757 . . . . 0.0 112.717 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -74.0 -17.23 61.02 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.192 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.488 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 1.2 pt20 -91.85 -19.05 22.93 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.157 -177.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -96.45 2.33 52.45 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.306 178.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.549 ' O ' ' HG2' ' A' ' 34' ' ' MET . 43.5 t30 -52.05 -39.72 60.06 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 124.754 1.283 . . . . 0.0 111.488 -178.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -70.61 -52.77 19.2 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -175.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.458 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 1.2 m -55.26 -50.2 70.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 123.866 0.729 . . . . 0.0 110.32 178.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -54.01 -59.84 4.12 Favored 'General case' 0 N--CA 1.433 -1.286 0 C-N-CA 123.707 0.803 . . . . 0.0 112.319 176.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.549 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.4 ptm -65.39 -41.05 94.12 Favored 'General case' 0 C--O 1.204 -1.322 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -66.8 -26.23 66.84 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 120.904 0.383 . . . . 0.0 110.302 -176.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 91.7 mt -88.32 -26.5 22.22 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 69.8 p -88.51 -19.25 26.66 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.587 -1.245 . . . . 0.0 111.578 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 74.3 p -90.01 139.4 30.64 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -120.62 86.73 2.62 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -74.94 174.2 9.63 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 114.186 -1.37 . . . . 0.0 111.017 -173.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -106.06 -30.68 9.13 Favored 'General case' 0 C--N 1.284 -2.283 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.917 -172.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.5 10.67 12.35 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.657 -0.817 . . . . 0.0 111.63 -174.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 52.5 mt -71.06 91.11 0.88 Allowed 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.313 175.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.3 mtm180 -93.22 -31.11 14.86 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 121.155 0.502 . . . . 0.0 110.687 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 65.5 mtt -116.91 69.48 0.76 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.866 0.841 . . . . 0.0 109.984 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -127.02 27.99 5.86 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.267 -1.333 . . . . 0.0 109.58 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 49.8 t -81.75 -66.54 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.224 -177.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -154.25 29.42 0.45 Allowed 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -82.98 132.91 49.47 Favored Pre-proline 0 C--N 1.284 -2.264 0 CA-C-N 114.15 -1.387 . . . . 0.0 111.477 -169.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -61.39 -17.4 53.15 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 122.695 2.263 . . . . 0.0 110.651 175.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -67.57 -17.72 64.74 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.404 178.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -70.2 -26.51 63.92 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.473 0.654 . . . . 0.0 109.594 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -74.6 5.42 4.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.772 -177.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.564 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 26.2 pt20 -53.99 -43.07 69.71 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.743 0.817 . . . . 0.0 110.031 176.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.446 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.0 OUTLIER -66.99 -26.46 66.81 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.321 -178.565 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -75.08 -43.69 51.69 Favored 'General case' 0 C--O 1.209 -1.071 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.6 m -57.87 -30.64 65.98 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.31 0.576 . . . . 0.0 110.79 178.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 56.5 mt -84.77 -56.16 3.73 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.506 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.3 t -62.1 -48.98 77.77 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.637 1.175 . . . . 0.0 111.397 -176.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.496 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 43.5 t -59.27 -36.53 75.7 Favored 'General case' 0 C--O 1.215 -0.755 0 C-N-CA 122.397 0.279 . . . . 0.0 110.456 178.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.52 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 8.6 t30 -71.71 -36.56 70.57 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-O 121.217 0.532 . . . . 0.0 110.466 -178.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.488 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 8.2 tp-100 -71.72 -44.24 64.49 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.914 -179.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.496 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.3 pp -72.8 -30.7 64.28 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 121.178 0.513 . . . . 0.0 110.961 -177.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.523 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 11.9 pt20 -72.36 -14.33 61.7 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -176.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 61' ' ' ASN . 44.3 mt-10 -80.22 -16.41 54.83 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-O 121.758 0.79 . . . . 0.0 109.363 177.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 18.8 t -79.61 163.13 3.65 Favored 'Isoleucine or valine' 0 C--O 1.25 1.128 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 175.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -51.03 145.09 7.89 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 123.856 0.862 . . . . 0.0 111.334 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.594 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 8.9 ptpp? -58.9 -32.53 69.6 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -176.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.404 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 13.1 pt20 -80.05 -21.61 43.26 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.637 0.732 . . . . 0.0 109.785 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.404 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.8 m -97.66 -13.07 21.72 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.653 -173.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.594 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 50.6 mt-30 -57.29 -46.62 82.97 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 121.175 0.512 . . . . 0.0 110.363 175.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.452 ' HA ' HG12 ' A' ' 75' ' ' ILE . 14.9 p -79.35 -23.63 43.27 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.924 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.483 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 10.2 mm-40 -66.62 -35.59 80.55 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 175.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.453 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -60.83 -25.25 66.49 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 123.551 0.74 . . . . 0.0 110.526 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.452 HG12 ' HA ' ' A' ' 72' ' ' CYS . 30.0 mm -73.8 -27.02 22.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.945 -178.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -75.89 -38.91 57.33 Favored 'General case' 0 CA--C 1.486 -1.494 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -175.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.505 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 67.6 mm-40 -59.46 -44.15 93.05 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 111.56 -2.563 . . . . 0.0 109.711 -178.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 74' ' ' ALA . 21.4 t -57.79 -45.72 87.13 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.708 0 O-C-N 123.627 0.579 . . . . 0.0 109.996 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.445 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 25.9 t -68.05 -47.04 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.317 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -174.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -55.28 -57.34 12.19 Favored 'General case' 0 N--CA 1.428 -1.571 0 O-C-N 124.836 1.335 . . . . 0.0 110.081 -178.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 9.7 pt20 -68.63 -30.02 68.65 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.02 -39.68 60.96 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 120.917 0.389 . . . . 0.0 111.093 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 13.7 pt20 -77.58 -37.02 51.42 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.649 -178.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.481 ' CG ' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -70.83 -30.45 66.88 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.34 0.126 . . . . 0.0 111.34 -177.794 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 2.8 pt20 -69.03 -28.68 66.78 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.229 0.537 . . . . 0.0 109.749 -178.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.418 ' HG ' HG23 ' A' ' 96' ' ' VAL . 4.3 mm? -87.8 -44.03 11.42 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.935 174.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -66.26 -22.48 66.32 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.47 1.108 . . . . 0.0 113.404 -176.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -66.5 -12.52 57.89 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -179.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 138.48 67.14 0.05 OUTLIER Glycine 0 CA--C 1.48 -2.138 0 C-N-CA 119.676 -1.25 . . . . 0.0 112.171 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -145.96 -58.11 0.31 Allowed 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 129.83 -134.91 8.09 Favored Glycine 0 N--CA 1.427 -1.963 0 N-CA-C 106.152 -2.779 . . . . 0.0 106.152 -174.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.63 -34.82 1.6 Allowed Glycine 0 C--O 1.196 -2.278 0 N-CA-C 115.352 0.901 . . . . 0.0 115.352 171.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -48.06 -29.52 3.62 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.651 1.18 . . . . 0.0 114.118 -176.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.503 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 3.3 pt20 -80.88 -43.72 19.45 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.287 0.565 . . . . 0.0 111.054 177.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 25.8 pt20 -84.08 -44.27 14.24 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 121.254 0.55 . . . . 0.0 111.649 -173.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.418 HG23 ' HG ' ' A' ' 86' ' ' LEU . 64.3 t -64.53 -23.48 33.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 C-N-CA 124.86 1.264 . . . . 0.0 110.418 178.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -51.11 -47.41 61.96 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 19.4 pt20 -67.82 -16.92 64.33 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.351 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 7.3 tpt -100.1 -49.07 4.41 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.5 p -59.95 -28.12 40.23 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.673 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.416 ' HE3' ' O ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -58.7 -25.05 62.49 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 175.468 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -65.13 -28.94 69.78 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 122.64 0.376 . . . . 0.0 110.529 177.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.415 ' HB3' ' CD1' ' A' ' 36' ' ' LEU . . . -60.78 -28.73 68.97 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.465 0.65 . . . . 0.0 110.987 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -73.16 -15.76 61.45 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.561 0.696 . . . . 0.0 110.988 -177.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 46.1 mtt -91.69 -13.97 30.83 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.878 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.502 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 98.3 mt -50.67 -48.09 83.54 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.452 -177.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 19.7 Cg_endo -59.19 -26.95 83.62 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 122.105 1.87 . . . . 0.0 113.113 177.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -83.59 -44.41 14.63 Favored 'General case' 0 N--CA 1.41 -2.438 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -74.93 -24.87 58.56 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.303 -175.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.404 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 25.6 t -98.8 -7.49 27.4 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.915 -178.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.3 t30 58.75 64.82 1.35 Allowed 'General case' 0 C--O 1.239 0.534 0 CA-C-O 122.819 1.295 . . . . 0.0 110.732 -176.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 107' ' ' PRO . 60.8 mt -99.67 158.95 15.41 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 113.272 -1.786 . . . . 0.0 110.07 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -72.7 35.26 0.07 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.806 1.242 . . . . 0.0 112.608 -177.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 40.3 m -157.3 159.71 37.82 Favored 'General case' 0 C--N 1.276 -2.598 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 30.6 m -148.47 143.79 26.96 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 39.7 mm . . . . . 0 C--N 1.311 -1.091 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.316 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.461 ' HA2' ' O ' ' A' ' 14' ' ' ASP . . . . . . . . 0 CA--C 1.502 -0.739 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.5 mmt85 -94.43 126.36 39.65 Favored 'General case' 0 CA--C 1.477 -1.839 0 CA-C-N 117.805 0.803 . . . . 0.0 109.612 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.498 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 5.4 m -123.57 146.37 48.19 Favored 'General case' 0 C--N 1.279 -2.465 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.138 -173.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.8 p -73.68 156.26 38.13 Favored 'General case' 0 C--O 1.253 1.267 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -84.1 70.21 10.48 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.9 t -153.14 163.34 40.04 Favored 'General case' 0 N--CA 1.419 -1.996 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -178.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 78.2 mt -129.15 119.01 19.51 Favored Pre-proline 0 C--N 1.301 -1.539 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.26 144.18 72.34 Favored 'Cis proline' 0 C--O 1.246 0.878 0 C-N-CA 123.921 -1.283 . . . . 0.0 112.417 -1.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -71.45 133.74 23.11 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.1 1.866 . . . . 0.0 111.459 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.3 mm -92.01 113.58 27.58 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 178.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.498 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.2 t -123.06 134.83 54.25 Favored 'General case' 0 N--CA 1.41 -2.442 0 C-N-CA 118.771 -1.171 . . . . 0.0 111.872 -172.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -76.45 151.55 83.14 Favored Pre-proline 0 N--CA 1.427 -1.608 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.747 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.07 -27.63 84.66 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.552 2.168 . . . . 0.0 112.083 -176.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.461 ' O ' ' HA2' ' A' ' 1' ' ' GLY . 13.1 t70 -139.0 -71.11 0.41 Allowed 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.922 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.34 3.72 69.16 Favored Glycine 0 C--N 1.292 -1.893 0 N-CA-C 115.163 0.825 . . . . 0.0 115.163 173.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -125.48 -24.18 3.95 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 118.568 1.184 . . . . 0.0 112.117 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -87.76 119.86 28.5 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 175.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -141.91 81.64 14.4 Favored Pre-proline 0 C--N 1.296 -1.732 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -175.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -79.97 -21.95 7.78 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.236 1.957 . . . . 0.0 112.683 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -133.34 -63.87 0.74 Allowed 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 105.828 -1.915 . . . . 0.0 105.828 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -179.18 -60.88 0.08 OUTLIER Glycine 0 CA--C 1.476 -2.385 0 N-CA-C 106.989 -2.445 . . . . 0.0 106.989 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.9 m -74.84 129.35 37.52 Favored 'General case' 0 C--N 1.28 -2.423 0 CA-C-N 114.565 -0.817 . . . . 0.0 109.191 172.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -106.75 120.37 41.81 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.424 ' N ' HD11 ' A' ' 24' ' ' ILE . 3.3 mp -114.51 143.8 23.46 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.631 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 -178.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.497 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 39.1 ptt180 -66.79 116.54 7.79 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -67.51 -15.54 19.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.363 -173.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -84.5 -9.74 58.08 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.6 -177.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 7.7 pt20 -87.23 -20.68 26.58 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 118.963 -1.095 . . . . 0.0 108.157 176.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.25 -5.24 57.78 Favored 'General case' 0 CA--C 1.474 -1.959 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.203 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -53.31 -31.99 46.74 Favored 'General case' 0 C--O 1.209 -1.061 0 O-C-N 124.525 1.141 . . . . 0.0 111.101 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -67.23 -58.33 5.03 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.774 -0.371 . . . . 0.0 110.122 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -54.1 -49.98 67.9 Favored 'General case' 0 C--O 1.22 -0.451 0 O-C-N 123.752 0.657 . . . . 0.0 109.71 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -50.18 -58.66 5.09 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 124.579 1.151 . . . . 0.0 112.321 174.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -67.85 -43.46 79.42 Favored 'General case' 0 C--O 1.208 -1.118 0 O-C-N 121.992 -0.443 . . . . 0.0 112.136 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -66.21 -26.22 67.28 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.409 ' CD1' ' HB2' ' A' ' 103' ' ' ALA . 98.7 mt -88.58 -28.32 20.79 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 176.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.413 HG22 HG11 ' A' ' 96' ' ' VAL . 66.1 p -86.31 -11.69 51.49 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 119.305 -0.958 . . . . 0.0 111.341 178.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.5 p -89.08 121.88 31.85 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -107.77 101.66 10.94 Favored 'General case' 0 N--CA 1.423 -1.796 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 168.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.421 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 5.8 t70 -82.09 172.15 13.54 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.604 -174.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -104.28 -31.32 9.63 Favored 'General case' 0 C--N 1.284 -2.245 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -171.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.17 5.74 36.45 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.483 -0.887 . . . . 0.0 111.79 -175.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.421 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 50.9 mt -66.22 90.63 0.15 Allowed 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.405 177.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -120.57 -35.45 3.39 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.492 0.663 . . . . 0.0 109.57 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 58.4 mtt -105.59 5.67 31.48 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.789 -1.096 . . . . 0.0 108.89 -177.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -128.78 95.51 4.12 Favored 'General case' 0 N--CA 1.427 -1.599 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.18 -177.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 61.8 t -116.02 -63.91 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.587 0 N-CA-C 105.829 -1.915 . . . . 0.0 105.829 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -128.42 98.33 5.01 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 104.768 -2.308 . . . . 0.0 104.768 170.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -137.9 137.19 20.87 Favored Pre-proline 0 C--N 1.296 -1.752 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -170.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.572 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 11.0 Cg_endo -54.51 -28.52 55.31 Favored 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 123.445 2.764 . . . . 0.0 113.167 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -78.57 -14.1 59.5 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-O 120.991 0.424 . . . . 0.0 111.312 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -84.03 -17.28 40.92 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.099 0.476 . . . . 0.0 109.739 175.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.572 ' OE1' ' HA ' ' A' ' 50' ' ' PRO . 51.6 mt-30 -78.6 -0.11 28.53 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.025 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.565 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 4.2 pt20 -53.17 -40.38 64.31 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 124.532 1.133 . . . . 0.0 110.351 178.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.423 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.0 OUTLIER -65.92 -25.01 66.95 Favored 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.842 -176.699 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -79.75 -43.6 22.27 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.2 m -57.64 -33.26 68.1 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 123.702 0.626 . . . . 0.0 110.562 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 51.0 mt -84.52 -50.77 7.43 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.734 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.4 t -62.56 -49.56 74.81 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 123.243 0.617 . . . . 0.0 111.574 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.473 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 33.0 t -58.3 -38.62 77.42 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 122.597 0.359 . . . . 0.0 110.115 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.552 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 7.5 t30 -73.35 -29.97 63.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.317 0.58 . . . . 0.0 110.686 -177.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -77.15 -43.61 33.33 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.277 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.473 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.5 pp -72.23 -34.18 68.12 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.514 -177.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -70.65 -12.97 61.89 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -176.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.552 ' HG3' ' O ' ' A' ' 61' ' ' ASN . 37.0 mt-10 -84.5 -8.95 58.76 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-O 121.643 0.735 . . . . 0.0 110.294 177.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 39.9 t -83.92 163.23 2.92 Favored 'Isoleucine or valine' 0 C--O 1.247 0.971 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 173.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.1 mt-10 -51.51 142.69 13.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.072 0.549 . . . . 0.0 111.36 177.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -56.91 -33.79 67.3 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -175.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.422 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 19.7 pt20 -78.96 -21.3 47.36 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 121.381 0.61 . . . . 0.0 110.42 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.422 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 49.7 m -100.4 -11.02 20.58 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.473 -174.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 74.2 mt-30 -59.21 -43.81 92.29 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 123.241 0.617 . . . . 0.0 110.881 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.409 ' HA ' HG12 ' A' ' 75' ' ' ILE . 10.9 p -78.32 -23.39 47.07 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 120.258 -0.577 . . . . 0.0 111.728 177.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -68.37 -34.08 75.41 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.472 0.653 . . . . 0.0 110.323 177.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.67 -27.83 66.74 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.367 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.409 HG12 ' HA ' ' A' ' 72' ' ' CYS . 28.9 mm -71.64 -34.96 54.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.973 -178.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -64.29 -44.73 90.76 Favored 'General case' 0 C--O 1.249 1.052 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.48 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.8 mt-30 -58.28 -45.52 87.75 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 112.682 -2.054 . . . . 0.0 110.914 -176.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 19.6 t -52.45 -44.87 45.08 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.954 0 O-C-N 124.103 0.877 . . . . 0.0 110.06 -178.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.19 -48.88 71.84 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -174.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.97 -39.26 94.15 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.632 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 20.2 pt20 -78.66 -32.65 47.29 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 120.751 0.31 . . . . 0.0 111.698 -179.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.6 -35.06 60.63 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.105 0.479 . . . . 0.0 111.642 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -76.03 -36.0 59.27 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.373 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.7 -32.2 65.57 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.059 -176.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 17.7 pt20 -69.4 -38.15 77.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.038 0.447 . . . . 0.0 110.176 -178.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.453 ' HG ' HG21 ' A' ' 96' ' ' VAL . 3.7 mm? -74.91 -33.34 61.99 Favored 'General case' 0 C--O 1.246 0.903 0 CA-C-O 121.074 0.464 . . . . 0.0 110.713 178.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.477 ' HA ' ' NE2' ' A' ' 93' ' ' GLN . 50.0 tt0 -60.0 -43.59 95.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.948 -1.023 . . . . 0.0 110.511 178.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -88.92 -2.45 58.6 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.773 -176.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -98.57 -82.09 1.64 Allowed Glycine 0 N--CA 1.425 -2.053 0 CA-C-N 115.424 -0.807 . . . . 0.0 113.041 -177.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -134.95 -23.4 1.54 Allowed 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -172.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.431 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 132.98 -127.89 4.92 Favored Glycine 0 CA--C 1.473 -2.556 0 N-CA-C 105.966 -2.854 . . . . 0.0 105.966 -170.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.476 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 78.86 -20.66 4.36 Favored Glycine 0 C--O 1.192 -2.487 0 CA-C-N 118.605 1.202 . . . . 0.0 114.151 174.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.477 ' NE2' ' HA ' ' A' ' 87' ' ' GLN . 46.3 mt-30 -50.73 -37.95 44.63 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 125.551 1.541 . . . . 0.0 110.71 -175.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -78.57 -37.6 42.27 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.843 -178.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.529 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 10.5 pt20 -81.02 -42.55 20.93 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.345 0.593 . . . . 0.0 110.025 -178.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.453 HG21 ' HG ' ' A' ' 86' ' ' LEU . 90.3 t -63.96 -24.57 36.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 CA-C-N 114.823 -1.081 . . . . 0.0 110.205 177.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -49.0 -44.5 41.28 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.05 0.54 . . . . 0.0 112.003 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 13.9 pt20 -69.4 -17.84 63.7 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -176.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 7.3 tpt -98.87 -47.18 5.38 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.6 p -62.76 -25.0 37.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.396 178.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -20.17 65.4 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.644 -0.66 . . . . 0.0 112.089 175.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -66.41 -28.59 68.74 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.452 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -64.25 -24.41 67.65 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-O 121.353 0.597 . . . . 0.0 110.562 178.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -75.17 -16.4 60.51 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.526 0.679 . . . . 0.0 110.38 -179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' MET . . . . . 0.454 ' O ' ' HG2' ' A' ' 109' ' ' GLN . 46.0 mtt -88.18 -14.91 37.42 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.423 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.452 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 93.4 mt -49.46 -49.96 68.35 Favored Pre-proline 0 C--N 1.322 -0.589 0 O-C-N 123.654 0.596 . . . . 0.0 112.537 -177.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.429 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 20.8 Cg_endo -62.22 -23.97 75.79 Favored 'Trans proline' 0 C--N 1.365 1.421 0 C-N-CA 121.734 1.623 . . . . 0.0 113.267 177.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -82.75 -45.67 14.09 Favored 'General case' 0 N--CA 1.417 -2.119 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . 0.454 ' HG2' ' O ' ' A' ' 105' ' ' MET . 10.6 mm100 -74.15 -39.15 63.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.958 -175.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 10.2 t -86.16 -3.62 59.0 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -177.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 58.33 61.79 2.18 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 124.701 1.2 . . . . 0.0 109.884 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.453 ' C ' ' H ' ' A' ' 114' ' ' CYS . 52.7 mt -94.59 160.16 14.76 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.591 -178.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -67.2 30.66 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.494 0 C-N-CA 124.935 1.294 . . . . 0.0 113.218 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.453 ' H ' ' C ' ' A' ' 112' ' ' LEU . 67.7 m -155.25 143.77 20.44 Favored 'General case' 0 C--N 1.274 -2.69 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -176.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 38.0 m -133.08 116.9 16.9 Favored 'General case' 0 C--N 1.286 -2.16 0 CA-C-O 120.873 0.368 . . . . 0.0 110.152 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.9 mm . . . . . 0 C--N 1.31 -1.126 0 N-CA-C 107.035 -1.469 . . . . 0.0 107.035 178.368 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -1.002 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mmm180 -95.08 151.28 19.33 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.786 ' SG ' ' HB2' ' A' ' 9' ' ' PRO . 4.0 t -146.64 161.25 40.95 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.5 p -85.47 157.2 20.52 Favored 'General case' 0 C--N 1.283 -2.312 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.304 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -87.74 76.58 8.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 177.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.7 m -147.41 160.26 42.76 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.153 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 69.4 mt -129.54 111.6 17.75 Favored Pre-proline 0 C--N 1.309 -1.156 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -73.65 143.83 79.08 Favored 'Cis proline' 0 C--O 1.241 0.648 0 C-N-CA 124.362 -1.099 . . . . 0.0 111.78 -0.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.786 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 74.5 Cg_endo -72.75 155.9 53.55 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.586 2.191 . . . . 0.0 112.681 -178.114 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.8 mm -110.96 112.0 38.65 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 64.6 m -103.51 143.89 32.12 Favored 'General case' 0 C--N 1.298 -1.653 0 C-N-CA 119.124 -1.03 . . . . 0.0 110.285 -174.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.425 ' C ' ' H ' ' A' ' 14' ' ' ASP . 81.3 m-85 -98.36 153.23 38.12 Favored Pre-proline 0 C--N 1.296 -1.719 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.73 -175.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.79 45.96 1.92 Allowed 'Trans proline' 0 C--N 1.358 1.067 0 C-N-CA 123.638 2.892 . . . . 0.0 110.275 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.425 ' H ' ' C ' ' A' ' 12' ' ' PHE . 21.0 t70 -58.76 -53.0 63.31 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 125.994 1.718 . . . . 0.0 112.146 -177.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -106.04 -43.02 1.57 Allowed Glycine 0 C--N 1.291 -1.945 0 C-N-CA 120.237 -0.983 . . . . 0.0 110.668 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.4 pp -166.42 169.85 13.53 Favored 'General case' 0 N--CA 1.415 -2.184 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -140.71 19.25 2.34 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-O 121.231 0.538 . . . . 0.0 110.445 174.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.429 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 3.9 p-10 -72.44 118.17 65.3 Favored Pre-proline 0 CA--C 1.514 -0.437 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.148 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 18' ' ' ASN . 11.7 Cg_exo -75.35 -24.23 12.48 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.737 1.625 . . . . 0.0 111.884 177.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.509 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 1.5 mpt_? -132.26 -63.43 0.8 Allowed 'General case' 0 CA--C 1.483 -1.606 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 175.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -150.03 -52.21 0.02 OUTLIER Glycine 0 CA--C 1.474 -2.479 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.736 -177.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.5 m -85.12 128.66 34.74 Favored 'General case' 0 C--N 1.28 -2.423 0 CA-C-O 121.139 0.495 . . . . 0.0 110.487 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.424 ' HB3' ' HB3' ' A' ' 18' ' ' ASN . 23.4 pt20 -106.92 103.28 12.66 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.415 177.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.9 mp -108.54 132.34 56.7 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.557 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.457 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 18.9 ptt-85 -67.42 121.42 15.73 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 123.799 0.687 . . . . 0.0 110.607 -177.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -64.58 -15.81 18.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.408 ' HG2' ' HB2' ' A' ' 25' ' ' ARG . 20.9 pt20 -75.56 -8.89 57.91 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.523 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.575 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 1.4 pt20 -98.49 -18.2 18.33 Favored 'General case' 0 N--CA 1.42 -1.959 0 C-N-CA 118.861 -1.136 . . . . 0.0 109.989 178.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -99.33 -3.84 33.07 Favored 'General case' 0 CA--C 1.476 -1.874 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.68 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.478 ' O ' ' HG2' ' A' ' 34' ' ' MET . 26.7 p30 -54.24 -32.24 55.5 Favored 'General case' 0 C--N 1.311 -1.1 0 O-C-N 124.022 0.826 . . . . 0.0 112.938 -178.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -68.8 -56.82 6.8 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.2 m -55.35 -49.82 71.25 Favored 'General case' 0 C--O 1.213 -0.827 0 O-C-N 123.869 0.731 . . . . 0.0 110.172 178.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.43 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.0 tt0 -51.93 -57.2 10.13 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 123.489 0.716 . . . . 0.0 112.425 176.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 26.3 ptt? -68.31 -41.44 80.85 Favored 'General case' 0 CA--C 1.507 -0.709 0 C-N-CA 120.242 -0.583 . . . . 0.0 112.418 -174.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 59.2 m-70 -72.05 -24.41 61.52 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.434 ' O ' ' HB3' ' A' ' 99' ' ' MET . 99.3 mt -88.65 -21.76 23.79 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 119.916 -0.713 . . . . 0.0 111.988 177.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.412 ' CG2' ' HB2' ' A' ' 82' ' ' ALA . 32.1 p -85.73 -21.15 28.4 Favored 'General case' 0 C--N 1.298 -1.651 0 C-N-CA 118.177 -1.409 . . . . 0.0 111.548 176.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.8 m -89.8 122.97 33.38 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.648 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -83.28 101.28 11.17 Favored 'General case' 0 N--CA 1.437 -1.108 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 171.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -76.34 177.98 6.87 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.508 -1.223 . . . . 0.0 111.106 -175.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -97.74 -38.93 9.29 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -171.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.82 4.6 9.37 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.943 0.878 . . . . 0.0 111.534 -175.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 69.8 mt -75.54 -8.86 57.84 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.354 176.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -55.07 -29.19 57.02 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 124.477 1.111 . . . . 0.0 112.433 177.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 65.7 mtm -120.12 21.59 11.74 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -134.87 95.41 3.32 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.628 -177.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 42.7 t -84.08 -60.96 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 176.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -140.1 86.7 2.1 Favored 'General case' 0 C--N 1.309 -1.187 0 C-N-CA 125.134 1.373 . . . . 0.0 107.597 173.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -120.48 150.57 52.36 Favored Pre-proline 0 C--N 1.306 -1.319 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.392 -175.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -61.63 -23.13 75.96 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.985 2.457 . . . . 0.0 112.588 -177.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.7 mtpt -65.24 -23.13 66.98 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 178.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -68.89 -29.79 68.15 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.154 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -79.72 12.8 2.4 Favored 'General case' 0 C--O 1.211 -0.922 0 C-N-CA 119.698 -0.801 . . . . 0.0 112.205 -177.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.406 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 13.2 pt20 -61.1 -47.39 86.5 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-O 121.686 0.755 . . . . 0.0 109.13 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.402 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.4 p-80 -72.13 -20.79 61.57 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.637 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.83 -44.12 56.63 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 176.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.0 m -56.43 -34.72 67.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.069 0.461 . . . . 0.0 110.317 177.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 45.9 mt -78.49 -51.55 9.83 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.233 0.54 . . . . 0.0 110.838 178.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.9 t -63.57 -49.75 72.19 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.417 1.087 . . . . 0.0 111.076 -176.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.479 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 12.8 t -58.02 -37.99 75.35 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.613 0.765 . . . . 0.0 110.479 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -75.31 -25.05 57.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.514 0.673 . . . . 0.0 110.789 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.575 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 8.2 tp-100 -83.22 -42.91 16.7 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.321 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.479 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 4.0 pp -68.92 -28.29 66.53 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.609 0.718 . . . . 0.0 110.572 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.43 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 12.0 pt20 -75.77 -6.83 52.51 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.265 -177.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -84.03 -11.75 56.26 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-O 121.721 0.772 . . . . 0.0 109.12 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 12.4 t -89.25 164.5 2.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 CA-C-N 114.902 -1.045 . . . . 0.0 108.767 177.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -46.79 144.49 2.35 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.628 0.771 . . . . 0.0 111.031 173.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.527 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -61.3 -33.47 73.64 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.017 1.118 . . . . 0.0 114.017 -176.348 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.434 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 28.4 pt20 -75.53 -25.12 56.92 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.764 0.792 . . . . 0.0 110.004 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.434 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 60.1 m -94.27 -13.63 26.32 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.099 -174.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.527 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 54.3 mt-30 -56.87 -43.86 81.63 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 121.211 0.529 . . . . 0.0 110.202 175.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.402 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.8 p -79.9 -23.81 41.57 Favored 'General case' 0 N--CA 1.435 -1.213 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.414 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -68.88 -32.0 71.34 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.251 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.442 ' O ' ' HB2' ' A' ' 77' ' ' GLN . . . -62.28 -26.17 68.25 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 123.59 0.756 . . . . 0.0 110.183 177.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.402 HG12 ' HA ' ' A' ' 72' ' ' CYS . 31.0 mm -72.63 -31.2 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.356 -178.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -72.66 -40.81 66.05 Favored 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -175.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.472 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 53.2 mm-40 -57.6 -42.33 83.02 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 112.256 -2.247 . . . . 0.0 110.927 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.421 HG22 ' O ' ' A' ' 74' ' ' ALA . 23.4 t -58.94 -46.49 91.39 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.79 0 O-C-N 123.833 0.708 . . . . 0.0 109.255 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.424 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 19.7 t -69.17 -42.24 81.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -58.88 -48.4 81.53 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.677 -178.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 9.1 pt20 -76.26 -35.55 58.89 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 123.122 0.264 . . . . 0.0 111.386 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.412 ' HB2' ' CG2' ' A' ' 37' ' ' THR . . . -69.97 -35.92 74.81 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.901 0.381 . . . . 0.0 111.681 -178.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 28.9 pt20 -79.06 -35.46 42.48 Favored 'General case' 0 C--N 1.308 -1.215 0 C-N-CA 118.798 -1.161 . . . . 0.0 110.537 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.43 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -69.39 -30.16 68.08 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.097 -177.314 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -71.35 -37.99 71.66 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 121.216 0.531 . . . . 0.0 109.621 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.478 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 2.6 mm? -78.44 -35.45 46.82 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.471 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -58.16 -43.39 87.38 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.222 0.609 . . . . 0.0 111.547 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.1 pt20 -81.85 -14.42 56.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.311 0.577 . . . . 0.0 110.141 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -84.87 -88.82 0.87 Allowed Glycine 0 N--CA 1.428 -1.848 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.262 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -125.79 -18.34 5.18 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.28 0.562 . . . . 0.0 111.873 -175.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.478 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 127.45 -104.2 0.68 Allowed Glycine 0 CA--C 1.476 -2.355 0 N-CA-C 106.713 -2.555 . . . . 0.0 106.713 -171.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.33 -32.21 1.15 Allowed Glycine 0 C--O 1.196 -2.247 0 N-CA-C 115.634 1.013 . . . . 0.0 115.634 170.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -47.36 -34.27 6.77 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.504 1.122 . . . . 0.0 112.291 -178.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.403 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 10.7 pt20 -68.91 -45.08 71.8 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.528 178.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.431 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 4.1 pt20 -82.93 -47.18 12.07 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 121.074 0.464 . . . . 0.0 110.171 -176.156 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.404 ' CG1' ' HA ' ' A' ' 37' ' ' THR . 91.5 t -59.41 -22.69 23.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 125.66 1.584 . . . . 0.0 110.224 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -43.02 -45.12 5.02 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.165 0.986 . . . . 0.0 112.67 178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.431 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 3.7 pt20 -68.63 -17.77 64.17 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.434 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 7.7 tpt -101.96 -47.34 4.6 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.8 p -65.05 -24.13 34.79 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 120.831 0.348 . . . . 0.0 111.354 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.471 ' HA ' HE21 ' A' ' 104' ' ' GLN . 15.2 ptpt -62.3 -24.82 67.52 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.748 -0.595 . . . . 0.0 110.956 174.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.419 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 26.3 mtpp -63.55 -30.9 71.95 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.475 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -59.9 -38.72 83.06 Favored 'General case' 0 C--O 1.204 -1.34 0 O-C-N 123.722 0.638 . . . . 0.0 109.861 176.09 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.471 HE21 ' HA ' ' A' ' 101' ' ' LYS . 38.6 mt-30 -72.79 -16.9 61.62 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.632 -177.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 43.4 mtt -82.23 -21.2 36.47 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.879 -0.513 . . . . 0.0 110.517 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 7.5 mp -47.43 -46.59 58.59 Favored Pre-proline 0 N--CA 1.481 1.076 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.3 -22.38 74.03 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 120.897 1.356 . . . . 0.0 112.871 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 61.7 m-80 -89.35 -42.79 11.35 Favored 'General case' 0 N--CA 1.403 -2.799 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -73.56 -36.74 65.64 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.831 -177.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.402 ' SG ' HD21 ' A' ' 112' ' ' LEU . 16.1 t -89.94 -3.8 57.84 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 60.3 t30 55.43 63.4 2.1 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 124.779 1.232 . . . . 0.0 110.276 -177.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.422 ' C ' ' H ' ' A' ' 114' ' ' CYS . 52.4 mt -93.28 159.75 15.13 Favored 'General case' 0 C--N 1.284 -2.276 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.305 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -70.43 35.03 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.392 1.077 . . . . 0.0 113.405 -175.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.422 ' H ' ' C ' ' A' ' 112' ' ' LEU . 57.4 m -158.02 156.4 31.05 Favored 'General case' 0 C--N 1.284 -2.249 0 C-N-CA 125.171 1.388 . . . . 0.0 107.284 -175.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 42.1 m -142.46 120.95 12.45 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 67.7 mt . . . . . 0 C--N 1.299 -1.619 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 177.36 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.769 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -71.9 143.41 49.36 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.7 m -134.34 161.21 35.61 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.46 -177.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 43.2 p -90.29 158.06 17.36 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 175.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -87.26 72.0 9.93 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.0 p -145.73 159.42 43.19 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 75.3 mt -128.83 117.24 19.38 Favored Pre-proline 0 C--N 1.299 -1.598 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -71.49 146.35 85.12 Favored 'Cis proline' 0 C--O 1.242 0.694 0 C-N-CA 124.109 -1.205 . . . . 0.0 112.3 0.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -71.97 145.83 45.94 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.619 2.213 . . . . 0.0 113.083 -177.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.6 mm -96.2 108.78 21.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.7 m -108.19 135.58 49.29 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-O 121.473 0.654 . . . . 0.0 112.271 -175.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -88.64 154.82 50.86 Favored Pre-proline 0 C--N 1.305 -1.35 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.268 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -37.45 -56.81 0.8 Allowed 'Trans proline' 0 C--N 1.368 1.576 0 C-N-CA 124.198 3.265 . . . . 0.0 113.997 -178.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -152.55 -64.15 0.16 Allowed 'General case' 0 CA--C 1.502 -0.898 0 C-N-CA 120.478 -0.489 . . . . 0.0 111.086 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -157.07 107.27 0.32 Allowed Glycine 0 N--CA 1.418 -2.506 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 -176.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.438 ' H ' HD22 ' A' ' 16' ' ' LEU . 2.2 pt? -83.12 -13.32 55.87 Favored 'General case' 0 C--N 1.278 -2.517 0 CA-C-N 115.132 -0.534 . . . . 0.0 111.55 -179.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -99.47 94.79 6.6 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.767 0.794 . . . . 0.0 111.99 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -128.73 82.71 68.1 Favored Pre-proline 0 C--N 1.292 -1.92 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.962 175.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -65.5 -27.12 54.31 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 123.485 2.79 . . . . 0.0 113.473 -174.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.426 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 0.2 OUTLIER -96.49 -51.18 4.44 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 -178.039 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 153.74 -55.68 0.43 Allowed Glycine 0 CA--C 1.457 -3.565 0 N-CA-C 107.48 -2.248 . . . . 0.0 107.48 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.457 ' SG ' ' HG3' ' A' ' 73' ' ' GLU . 95.2 m -84.51 134.62 34.42 Favored 'General case' 0 N--CA 1.405 -2.694 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 171.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -106.2 113.06 26.36 Favored 'General case' 0 C--N 1.288 -2.099 0 CA-C-O 122.036 0.922 . . . . 0.0 108.82 173.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.449 ' N ' HD11 ' A' ' 24' ' ' ILE . 3.3 mp -106.94 146.08 13.72 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.504 0 CA-C-N 114.116 -1.402 . . . . 0.0 107.785 -174.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.458 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 34.2 ptt180 -65.64 120.16 12.44 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-O 121.551 0.691 . . . . 0.0 109.171 -178.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 pp -69.88 -15.98 19.84 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.466 -175.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -71.67 -23.21 61.62 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.488 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.473 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 6.9 pt20 -83.83 -18.8 36.37 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.587 -178.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -94.31 -4.06 49.36 Favored 'General case' 0 CA--C 1.48 -1.719 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.236 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.532 ' O ' ' HG2' ' A' ' 34' ' ' MET . 3.4 t-20 -57.15 -32.02 65.96 Favored 'General case' 0 C--N 1.317 -0.816 0 O-C-N 123.89 0.744 . . . . 0.0 110.646 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -69.53 -53.74 17.54 Favored 'General case' 0 C--O 1.221 -0.406 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -55.61 -51.69 66.3 Favored 'General case' 0 C--O 1.222 -0.393 0 O-C-N 123.605 0.566 . . . . 0.0 109.832 178.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.0 tt0 -51.77 -56.58 13.02 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 123.899 0.88 . . . . 0.0 112.468 176.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.532 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 26.6 ptm -69.92 -42.87 72.75 Favored 'General case' 0 CA--C 1.504 -0.81 0 C-N-CA 119.967 -0.693 . . . . 0.0 112.263 -174.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.413 ' CE1' ' HD1' ' A' ' 55' ' ' HIS . 2.0 t-80 -67.35 -27.12 66.86 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.916 -175.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 94.8 mt -88.63 -28.48 20.62 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 112.17 0.434 . . . . 0.0 112.17 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.405 ' HA ' HG11 ' A' ' 96' ' ' VAL . 35.2 p -84.64 -21.67 30.18 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 118.233 -1.387 . . . . 0.0 111.451 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.8 p -91.36 121.65 33.28 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -89.55 90.18 8.15 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 166.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -76.61 169.88 17.46 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.473 -171.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -100.91 -33.64 10.12 Favored 'General case' 0 C--N 1.283 -2.286 0 CA-C-N 115.723 -0.671 . . . . 0.0 112.724 -168.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.68 7.23 21.12 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.054 -1.058 . . . . 0.0 111.974 -177.224 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 73.5 mt -80.1 37.84 0.39 Allowed 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 124.065 0.946 . . . . 0.0 110.582 177.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -73.44 -23.85 60.17 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -172.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 84.8 mtp -110.2 13.37 23.11 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 121.488 0.661 . . . . 0.0 109.512 177.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -137.68 84.09 2.02 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.19 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 57.3 t -93.67 -68.37 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.464 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -134.66 16.6 3.62 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 173.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -64.65 163.92 24.15 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 113.863 -1.517 . . . . 0.0 109.29 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.51 -19.5 44.72 Favored 'Trans proline' 0 C--N 1.367 1.548 0 C-N-CA 122.595 2.196 . . . . 0.0 112.117 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -59.64 -23.64 63.2 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.51 175.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -70.2 -15.45 62.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.942 0.401 . . . . 0.0 111.471 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -74.96 0.7 14.93 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 122.189 -0.319 . . . . 0.0 110.8 176.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.623 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 26.6 pt20 -55.07 -54.05 48.01 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.65 0.78 . . . . 0.0 110.275 175.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.451 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.8 p-80 -74.75 -22.17 58.93 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.54 -176.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -70.3 -44.89 67.41 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 175.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 51.0 m -57.37 -36.3 71.06 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 123.563 0.54 . . . . 0.0 110.574 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 35.9 mt -80.85 -53.19 6.69 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.627 -178.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 19.6 t -66.2 -48.34 70.95 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.198 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.503 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 32.8 t -58.46 -34.23 70.63 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 117.868 0.304 . . . . 0.0 110.653 176.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -76.41 -24.68 54.02 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.626 0.727 . . . . 0.0 110.6 -178.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.473 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 6.1 tp-100 -85.58 -46.88 10.39 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.639 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.503 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.9 pp -64.27 -31.61 72.88 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.673 -177.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.413 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 7.3 pt20 -70.87 -10.28 59.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.641 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -75.87 -21.07 57.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 122.062 0.934 . . . . 0.0 108.841 176.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 8.9 t -82.26 163.61 3.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 176.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 31.9 mt-10 -54.84 144.07 23.8 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-O 119.268 -0.396 . . . . 0.0 110.695 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.433 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 18.1 ptpt -57.8 -31.78 66.9 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -77.18 -20.17 55.79 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.075 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.421 ' HA ' ' CG ' ' A' ' 73' ' ' GLU . 63.0 m -103.97 -10.67 17.94 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.866 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.582 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 29.2 mt-30 -62.82 -37.76 88.03 Favored 'General case' 0 C--O 1.217 -0.637 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.415 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.8 p -80.96 -24.51 38.03 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.549 176.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.457 ' HG3' ' SG ' ' A' ' 22' ' ' CYS . 8.4 mm-40 -67.22 -36.1 80.97 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 177.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.1 -28.5 69.13 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 123.577 0.751 . . . . 0.0 110.645 178.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.415 HG12 ' HA ' ' A' ' 72' ' ' CYS . 31.5 mm -69.68 -37.51 74.16 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.598 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -65.55 -41.11 93.36 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -177.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.8 mt-30 -61.03 -38.63 86.82 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 113.505 -1.68 . . . . 0.0 110.621 -178.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 20.8 t -61.11 -44.58 98.58 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.906 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 29.0 t -65.63 -47.77 84.99 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.894 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -174.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.402 ' CD ' HH21 ' A' ' 20' ' ' ARG . 52.6 mt-10 -58.68 -50.63 73.15 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.68 -178.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 11.0 pt20 -71.82 -31.72 66.83 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.835 0.35 . . . . 0.0 111.886 -177.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.72 -38.23 54.67 Favored 'General case' 0 C--N 1.315 -0.908 0 O-C-N 122.131 -0.356 . . . . 0.0 111.307 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -72.95 -34.08 66.3 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.357 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.555 ' O ' ' HG2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -70.67 -38.12 73.74 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.46 -178.156 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.4 ' N ' ' HD3' ' A' ' 84' ' ' LYS . 3.3 pt20 -68.07 -37.97 81.87 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.136 -175.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.454 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.6 mm? -76.64 -33.73 58.33 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.872 178.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.411 ' HB2' ' NE2' ' A' ' 93' ' ' GLN . 10.0 tt0 -64.85 -37.3 87.16 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.252 0.549 . . . . 0.0 110.509 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 84' ' ' LYS . 4.6 pt20 -90.49 0.33 57.36 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.667 0.746 . . . . 0.0 110.422 178.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -99.29 -100.6 2.26 Favored Glycine 0 N--CA 1.421 -2.337 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.896 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -118.18 -5.88 10.89 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.008 0.432 . . . . 0.0 112.025 -174.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.454 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 116.57 -101.37 0.97 Allowed Glycine 0 CA--C 1.468 -2.867 0 N-CA-C 106.825 -2.51 . . . . 0.0 106.825 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 72.4 -34.81 0.67 Allowed Glycine 0 C--O 1.196 -2.229 0 N-CA-C 116.082 1.193 . . . . 0.0 116.082 170.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.411 ' NE2' ' HB2' ' A' ' 87' ' ' GLN . 90.8 mt-30 -46.53 -34.25 4.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 118.322 1.061 . . . . 0.0 112.866 -176.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -71.41 -42.19 68.63 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 120.982 0.42 . . . . 0.0 111.449 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -82.83 -47.88 11.39 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 -176.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.405 HG11 ' HA ' ' A' ' 37' ' ' THR . 80.7 t -59.04 -22.83 22.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 125.461 1.504 . . . . 0.0 110.725 178.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -44.48 -46.15 9.56 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 123.562 0.745 . . . . 0.0 112.502 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -67.57 -18.02 64.85 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -176.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.8 tpt -102.29 -48.24 4.25 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.0 p -63.72 -24.09 34.96 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 CA-C-O 121.06 0.457 . . . . 0.0 111.183 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.486 ' HA ' HE21 ' A' ' 104' ' ' GLN . 0.0 OUTLIER -65.49 -21.02 66.59 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.703 -0.623 . . . . 0.0 111.539 176.228 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -67.33 -27.89 67.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 176.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.449 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -62.99 -32.11 73.38 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 121.599 0.714 . . . . 0.0 109.807 175.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.486 HE21 ' HA ' ' A' ' 101' ' ' LYS . 43.8 mt-30 -74.4 -15.46 60.92 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.645 -178.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 61.2 mtp -90.33 -18.29 25.81 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.793 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.449 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 96.4 mt -50.25 -51.23 65.0 Favored Pre-proline 0 C--N 1.323 -0.544 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -176.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.401 ' HA ' ' CG ' ' A' ' 112' ' ' LEU . 18.0 Cg_endo -60.79 -24.92 80.13 Favored 'Trans proline' 0 C--N 1.362 1.282 0 C-N-CA 121.73 1.62 . . . . 0.0 113.169 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -84.47 -41.0 17.03 Favored 'General case' 0 N--CA 1.414 -2.251 0 CA-C-O 121.157 0.503 . . . . 0.0 109.822 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -80.37 -37.32 32.58 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.123 -176.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.403 ' SG ' HD23 ' A' ' 112' ' ' LEU . 24.2 t -84.38 -6.04 59.34 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.199 0.524 . . . . 0.0 109.693 -178.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 57.45 65.03 1.43 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 122.989 1.376 . . . . 0.0 110.784 -177.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.412 ' C ' ' H ' ' A' ' 114' ' ' CYS . 41.9 mt -93.67 159.41 15.23 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 113.272 -1.785 . . . . 0.0 109.363 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -75.88 35.79 0.13 Allowed 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 121.658 0.742 . . . . 0.0 112.094 -174.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.412 ' H ' ' C ' ' A' ' 112' ' ' LEU . 78.7 m -154.0 149.06 26.82 Favored 'General case' 0 C--N 1.285 -2.23 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 -176.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 25.7 p -136.1 132.38 36.04 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 118.114 0.416 . . . . 0.0 110.189 -176.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 26.6 mm . . . . . 0 C--N 1.308 -1.205 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 178.738 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.591 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.403 ' HG2' HD22 ' A' ' 18' ' ' ASN . 12.0 mmt180 -95.14 127.52 41.26 Favored 'General case' 0 CA--C 1.471 -2.063 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 58.3 m -118.95 140.81 49.37 Favored 'General case' 0 C--N 1.26 -3.297 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.288 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.9 p -71.27 151.11 44.55 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.773 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -79.12 72.0 5.65 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.359 0.6 . . . . 0.0 110.355 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.9 t -149.08 163.92 36.17 Favored 'General case' 0 N--CA 1.419 -2.02 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.3 mt -129.75 118.82 18.87 Favored Pre-proline 0 C--N 1.304 -1.391 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -75.32 140.93 69.67 Favored 'Cis proline' 0 C--O 1.243 0.727 0 C-N-CA 123.809 -1.329 . . . . 0.0 110.876 -1.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.08 152.01 80.76 Favored 'Trans proline' 0 C--O 1.244 0.79 0 C-N-CA 122.954 2.436 . . . . 0.0 113.21 -175.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.7 mm -102.81 118.26 49.45 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 75.8 m -105.81 130.75 53.73 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-O 121.62 0.724 . . . . 0.0 111.625 -176.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -114.05 152.53 45.86 Favored Pre-proline 0 C--N 1.29 -2.013 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.83 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -57.34 -46.02 30.76 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 122.417 2.078 . . . . 0.0 110.235 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.408 ' HA ' ' ND2' ' A' ' 18' ' ' ASN . 15.8 t0 -147.11 160.71 42.1 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 115.049 -0.978 . . . . 0.0 108.532 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -130.98 -13.54 1.96 Allowed Glycine 0 N--CA 1.413 -2.838 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.32 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -170.27 -50.49 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 117.124 0.462 . . . . 0.0 111.474 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -170.08 100.65 0.29 Allowed 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.764 -174.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.408 ' ND2' ' HA ' ' A' ' 14' ' ' ASP . 94.3 m-20 -117.93 85.67 23.61 Favored Pre-proline 0 C--N 1.312 -1.045 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.375 176.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -82.48 -15.65 8.55 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.006 1.804 . . . . 0.0 110.586 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 0.7 OUTLIER -140.91 -47.22 0.4 Allowed 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 176.901 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 144.7 -63.92 0.47 Allowed Glycine 0 CA--C 1.478 -2.236 0 N-CA-C 108.977 -1.649 . . . . 0.0 108.977 178.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.7 m -66.63 135.58 54.31 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 114.577 -0.811 . . . . 0.0 109.033 171.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -99.95 91.74 4.95 Favored 'General case' 0 N--CA 1.422 -1.831 0 CA-C-O 122.439 1.114 . . . . 0.0 110.978 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.5 mp -94.14 138.39 20.67 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.818 0 N-CA-C 105.328 -2.101 . . . . 0.0 105.328 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.45 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.5 ptt-85 -71.66 120.54 17.39 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.057 0.456 . . . . 0.0 110.0 -176.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -63.53 -16.31 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-O 121.288 0.566 . . . . 0.0 112.236 -176.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -77.14 -17.74 58.4 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.62 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.6 pt20 -86.62 -29.2 22.74 Favored 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 119.401 -0.919 . . . . 0.0 108.544 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -85.11 -7.79 58.93 Favored 'General case' 0 CA--C 1.473 -2.004 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.491 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.43 ' O ' ' HG2' ' A' ' 34' ' ' MET . 8.6 t30 -54.12 -34.84 61.32 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 124.335 1.022 . . . . 0.0 110.889 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -69.06 -55.12 11.74 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -52.29 -53.74 40.27 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 125.114 1.366 . . . . 0.0 108.347 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -49.55 -61.34 2.16 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 126.101 1.76 . . . . 0.0 112.45 175.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.43 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.3 ptm -69.82 -28.69 65.91 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -173.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.613 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 3.0 t-80 -72.48 -25.72 61.53 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-O 121.139 0.495 . . . . 0.0 109.834 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.5 mt -88.52 -32.17 18.33 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.41 177.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 58.9 p -82.75 -22.14 34.45 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 118.622 -1.231 . . . . 0.0 111.785 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.8 t -90.94 127.73 36.51 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.256 0.551 . . . . 0.0 111.934 -178.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -105.2 -179.56 3.98 Favored 'General case' 0 N--CA 1.423 -1.791 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 171.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -139.92 172.71 12.38 Favored 'General case' 0 C--N 1.285 -2.236 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.6 p90 -96.53 -34.63 11.39 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -168.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.2 15.03 18.31 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.44 -175.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 68.4 mt -65.36 96.25 0.23 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.673 177.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -106.93 -24.72 11.93 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 69.9 mtm -137.15 87.63 2.29 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.448 ' HA ' ' HG3' ' A' ' 52' ' ' GLN . . . -131.46 12.95 5.01 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.695 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 22.0 t -73.3 -59.56 3.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-O 121.298 0.571 . . . . 0.0 110.035 -177.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -134.54 82.06 1.94 Allowed 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -140.3 136.61 17.0 Favored Pre-proline 0 C--N 1.297 -1.689 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.027 -174.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -41.25 -50.62 4.34 Favored 'Trans proline' 0 C--N 1.363 1.307 0 C-N-CA 124.856 3.704 . . . . 0.0 114.639 -176.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -75.86 -10.02 59.08 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -175.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.448 ' HG3' ' HA ' ' A' ' 46' ' ' ALA . 12.6 mm100 -102.87 -11.63 18.13 Favored 'General case' 0 C--N 1.295 -1.787 0 C-N-CA 119.948 -0.701 . . . . 0.0 109.922 -178.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.5 pt20 -117.13 8.54 13.31 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 121.772 0.796 . . . . 0.0 109.789 178.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.477 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 13.7 pt20 -65.47 -28.88 69.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.035 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.613 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.6 OUTLIER -58.17 -26.62 62.96 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.349 179.494 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.3 tp -72.22 -52.03 18.33 Favored 'General case' 0 CA--C 1.489 -1.403 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.0 m -59.23 -21.76 60.05 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.614 -176.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 41.1 mt -89.76 -57.66 2.79 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.014 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 52.2 t -64.39 -50.51 67.39 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.155 0.982 . . . . 0.0 112.372 -175.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.547 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 12.1 t -59.23 -39.68 83.52 Favored 'General case' 0 CA--C 1.495 -1.145 0 CA-C-O 121.613 0.721 . . . . 0.0 109.281 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.421 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 27.9 t-20 -70.77 -28.03 64.36 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.956 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -81.13 -42.56 20.73 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.325 0.583 . . . . 0.0 110.446 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.547 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.7 pp -72.25 -31.65 65.99 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.908 -176.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.421 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 17.6 pt20 -68.9 -15.16 63.42 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.711 -176.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -81.7 -22.67 37.28 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.7 t -70.75 161.65 4.54 Favored 'Isoleucine or valine' 0 C--O 1.249 1.026 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.431 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.3 mt-10 -50.09 140.63 12.29 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 123.417 0.687 . . . . 0.0 112.298 178.061 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -55.17 -33.31 62.86 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.111 0.564 . . . . 0.0 112.471 -177.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -81.9 -7.35 59.6 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.068 0.461 . . . . 0.0 110.576 -178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 61.3 m -117.5 -11.28 10.51 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -174.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 75.9 mt-30 -57.96 -48.54 79.64 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.258 0.623 . . . . 0.0 112.03 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 14.7 p -74.82 -23.12 58.42 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.804 -0.759 . . . . 0.0 112.145 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -68.3 -32.54 72.75 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.613 0.721 . . . . 0.0 109.614 178.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.464 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -59.43 -28.75 67.24 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.704 177.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.449 ' O ' HG22 ' A' ' 79' ' ' VAL . 27.8 mm -70.98 -32.95 50.03 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -176.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -66.46 -44.14 83.58 Favored 'General case' 0 CA--C 1.491 -1.32 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 -177.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.507 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.3 mt-30 -59.16 -46.22 88.95 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 113.103 -1.862 . . . . 0.0 110.349 -177.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.464 HG22 ' O ' ' A' ' 74' ' ' ALA . 19.6 t -53.42 -44.7 56.08 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 O-C-N 124.211 0.944 . . . . 0.0 110.138 -179.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 75' ' ' ILE . 26.1 t -70.12 -45.04 77.5 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -175.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -60.04 -52.58 64.75 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.678 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 20.7 pt20 -70.61 -31.76 68.86 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.855 -176.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.452 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -72.11 -41.46 67.21 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.76 0.314 . . . . 0.0 111.193 178.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.5 pt20 -72.1 -37.84 69.47 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 119.99 -0.684 . . . . 0.0 110.089 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.432 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -68.77 -32.34 72.01 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -178.097 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 1.7 pt20 -71.19 -28.84 64.51 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 121.683 0.754 . . . . 0.0 109.755 -177.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.515 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.7 mm? -86.29 -37.28 18.7 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.965 176.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -58.18 -36.45 73.07 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.925 1.29 . . . . 0.0 111.333 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -80.19 -9.89 59.74 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-O 121.018 0.437 . . . . 0.0 111.302 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -113.82 -115.57 3.21 Favored Glycine 0 N--CA 1.43 -1.732 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.017 -177.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -71.24 -43.26 67.62 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 124.198 0.999 . . . . 0.0 111.371 -174.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.515 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 142.68 -85.95 0.19 Allowed Glycine 0 CA--C 1.478 -2.224 0 N-CA-C 107.007 -2.437 . . . . 0.0 107.007 -171.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.457 ' HA3' HD11 ' A' ' 86' ' ' LEU . . . 74.18 -44.55 1.36 Allowed Glycine 0 C--O 1.199 -2.08 0 N-CA-C 115.531 0.972 . . . . 0.0 115.531 171.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.455 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 56.2 mt-30 -44.37 -30.94 0.92 Allowed 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 125.292 1.437 . . . . 0.0 113.677 -176.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -75.88 -41.3 52.54 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 120.819 0.342 . . . . 0.0 111.321 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -85.51 -43.88 13.17 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.62 0.724 . . . . 0.0 110.227 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 75.9 t -63.81 -22.72 31.62 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 C-N-CA 125.781 1.632 . . . . 0.0 110.547 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 64.5 tt0 -45.48 -45.65 13.22 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.478 0.711 . . . . 0.0 112.844 -178.135 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -67.25 -21.97 65.71 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -177.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.9 tpt -94.94 -49.55 5.51 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -176.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.9 p -61.51 -28.31 43.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.813 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -24.45 65.21 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 177.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -62.46 -38.03 88.22 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.41 ' HA ' HD13 ' A' ' 106' ' ' LEU . . . -52.07 -35.55 47.91 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.581 178.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -68.14 -17.25 64.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.134 0.492 . . . . 0.0 111.239 -178.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 40.8 mtt -91.81 -14.57 29.57 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.423 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 6.9 mp -53.16 -45.49 98.25 Favored Pre-proline 0 C--O 1.207 -1.182 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.423 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 19.6 Cg_endo -61.52 -26.49 80.88 Favored 'Trans proline' 0 C--N 1.358 1.07 0 CA-C-N 121.067 1.417 . . . . 0.0 112.125 176.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -83.51 -42.87 16.38 Favored 'General case' 0 N--CA 1.417 -2.124 0 CA-C-O 121.277 0.56 . . . . 0.0 110.277 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -79.92 -38.89 31.48 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -176.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 19.6 t -80.77 -5.73 57.55 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 45.4 t30 64.32 58.82 1.07 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 122.952 1.358 . . . . 0.0 109.873 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 49.5 mt -100.23 158.43 15.87 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-N 113.536 -1.666 . . . . 0.0 108.228 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -82.83 45.53 1.01 Allowed 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.62 0.724 . . . . 0.0 111.194 -174.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 48.7 m -157.35 160.55 38.59 Favored 'General case' 0 C--N 1.292 -1.893 0 C-N-CA 124.994 1.318 . . . . 0.0 107.889 -176.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.8 m -149.36 135.77 19.25 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 176.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 81.0 mt . . . . . 0 C--N 1.304 -1.402 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -178.673 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.167 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -94.92 141.68 28.36 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-N 116.982 0.391 . . . . 0.0 109.979 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 62.7 m -116.81 149.35 40.13 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.3 p -84.6 156.56 21.53 Favored 'General case' 0 C--N 1.296 -1.727 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -79.81 74.57 6.53 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 122.082 0.944 . . . . 0.0 109.595 174.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 47.5 t -136.92 157.72 46.1 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.101 -1.409 . . . . 0.0 107.286 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.6 mm -128.51 109.65 19.15 Favored Pre-proline 0 C--N 1.294 -1.819 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 176.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -73.97 150.81 96.17 Favored 'Cis proline' 0 C--O 1.253 1.271 0 C-N-CA 124.177 -1.176 . . . . 0.0 111.322 -3.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.18 150.84 66.2 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.722 2.281 . . . . 0.0 113.178 -175.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.405 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 46.9 mm -97.31 114.19 33.73 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 82.3 m -106.6 129.04 54.59 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-O 121.277 0.56 . . . . 0.0 111.522 -176.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -73.38 151.93 89.86 Favored Pre-proline 0 C--N 1.307 -1.239 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.283 177.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -78.22 2.62 7.84 Favored 'Trans proline' 0 C--O 1.249 1.062 0 C-N-CA 122.685 2.256 . . . . 0.0 113.407 -176.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -167.21 -169.67 1.31 Allowed 'General case' 0 C--O 1.25 1.109 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 -177.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.8 0.26 48.92 Favored Glycine 0 CA--C 1.487 -1.696 0 N-CA-C 115.235 0.854 . . . . 0.0 115.235 173.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -152.4 120.32 6.17 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 118.655 -1.218 . . . . 0.0 110.139 -176.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.413 ' HB2' ' OE1' ' A' ' 69' ' ' GLN . 3.9 p30 -103.82 141.29 36.38 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 176.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -135.97 61.76 42.61 Favored Pre-proline 0 C--N 1.299 -1.612 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -173.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -72.89 -6.65 19.39 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.332 2.021 . . . . 0.0 113.597 -173.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.537 ' HD3' ' N ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -104.63 -25.26 12.8 Favored 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 178.789 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -102.38 18.22 51.69 Favored Glycine 0 N--CA 1.411 -3.001 0 CA-C-N 113.95 -1.477 . . . . 0.0 112.656 -177.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 29.9 m -65.66 113.36 4.19 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-O 121.036 0.446 . . . . 0.0 110.907 175.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -106.54 109.83 21.87 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-O 121.819 0.819 . . . . 0.0 108.882 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.743 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 2.7 mp -115.02 143.72 24.14 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.107 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.558 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 18.6 ptt180 -71.61 122.12 19.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.81 -13.34 16.69 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.045 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -75.72 -18.88 59.43 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.9 -178.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.558 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.4 pt20 -81.13 -16.97 51.51 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.525 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.412 ' HB3' HG21 ' A' ' 78' ' ' VAL . 2.2 mm? -96.59 2.59 52.42 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.138 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.461 ' OD1' ' HE1' ' A' ' 34' ' ' MET . 28.6 t-20 -52.52 -39.27 61.17 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 124.343 1.027 . . . . 0.0 112.223 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -69.2 -54.78 13.07 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.2 m -55.13 -47.25 75.32 Favored 'General case' 0 C--O 1.221 -0.418 0 O-C-N 123.467 0.48 . . . . 0.0 110.652 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -54.55 -55.39 29.79 Favored 'General case' 0 N--CA 1.437 -1.095 0 C-N-CA 123.457 0.703 . . . . 0.0 112.335 176.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.461 ' HE1' ' OD1' ' A' ' 30' ' ' ASN . 14.2 ptp -68.43 -41.74 79.88 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -176.26 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -70.25 -25.41 63.36 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.057 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.444 ' O ' ' HB3' ' A' ' 99' ' ' MET . 86.9 mt -88.33 -25.13 22.92 Favored 'General case' 0 C--O 1.214 -0.816 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 177.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.452 ' CG2' ' HB2' ' A' ' 82' ' ' ALA . 29.9 p -87.78 -21.57 25.04 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 117.919 -1.512 . . . . 0.0 111.333 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.2 m -90.63 143.47 26.71 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.558 174.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.46 ' CZ ' ' HA ' ' A' ' 96' ' ' VAL . 48.8 m-85 -106.41 130.24 54.25 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.642 ' OD2' ' HD3' ' A' ' 42' ' ' LYS . 10.2 t70 -60.87 148.5 39.25 Favored 'General case' 0 N--CA 1.421 -1.897 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.26 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -124.65 -26.8 3.77 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.229 -172.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.642 ' HD3' ' OD2' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -91.95 9.52 32.73 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.806 -175.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.414 ' HG ' ' OD2' ' A' ' 40' ' ' ASP . 83.9 mt -49.43 113.15 0.76 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.764 173.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -105.15 -79.3 0.56 Allowed 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 67.0 mtt -102.56 3.04 36.96 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.309 0.576 . . . . 0.0 109.915 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.502 ' HA ' ' CG ' ' A' ' 49' ' ' ASN . . . -72.16 105.75 4.1 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.18 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 29.8 t -112.38 -62.53 2.18 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 176.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -134.72 33.07 3.23 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.502 ' CG ' ' HA ' ' A' ' 46' ' ' ALA . 2.9 m-20 -59.84 141.38 89.37 Favored Pre-proline 0 C--N 1.313 -0.999 0 CA-C-N 114.218 -1.355 . . . . 0.0 111.391 -177.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -59.44 -23.34 70.11 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.917 2.411 . . . . 0.0 111.913 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -69.17 -15.3 63.37 Favored 'General case' 0 C--O 1.218 -0.586 0 O-C-N 122.092 -0.38 . . . . 0.0 111.749 177.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -81.19 -9.08 59.85 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 121.306 0.574 . . . . 0.0 109.741 178.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -87.3 6.63 32.46 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.77 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.461 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 23.6 pt20 -49.47 -48.77 47.49 Favored 'General case' 0 C--O 1.249 1.05 0 C-N-CA 124.521 1.128 . . . . 0.0 111.084 178.136 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.434 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.4 p-80 -70.93 -22.68 62.21 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.267 -177.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -78.5 -46.15 20.29 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -178.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.9 m -55.06 -33.37 62.68 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.471 0.653 . . . . 0.0 110.519 178.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 58.3 mt -82.95 -56.13 3.99 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.858 178.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.8 t -58.68 -49.42 77.61 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.196 0.999 . . . . 0.0 111.348 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.483 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 38.5 t -57.82 -37.08 73.18 Favored 'General case' 0 C--O 1.212 -0.903 0 C-N-CA 123.028 0.531 . . . . 0.0 110.839 178.162 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.42 ' HA ' HE21 ' A' ' 64' ' ' GLN . 12.5 t30 -76.42 -25.32 54.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.872 0.844 . . . . 0.0 110.816 -177.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.518 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 6.3 tp-100 -79.61 -48.61 13.49 Favored 'General case' 0 C--N 1.283 -2.311 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.369 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.483 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.9 pp -69.05 -31.7 70.66 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.866 -177.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.42 HE21 ' HA ' ' A' ' 61' ' ' ASN . 25.6 pt20 -71.92 -11.18 60.66 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -176.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.35 -10.23 57.77 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.929 0.871 . . . . 0.0 109.785 175.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -82.73 163.68 2.98 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 172.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.569 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 27.7 mm-40 -50.55 149.4 3.21 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-N 118.101 0.409 . . . . 0.0 112.023 174.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -62.51 -38.4 89.8 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.779 -171.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.413 ' OE1' ' HB2' ' A' ' 17' ' ' ASP . 24.5 pt20 -76.3 -19.59 58.12 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-O 121.534 0.683 . . . . 0.0 110.158 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 57.2 m -98.83 -11.5 21.72 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.541 -176.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.569 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 29.2 mt-30 -62.19 -38.84 90.65 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-O 121.414 0.626 . . . . 0.0 109.365 176.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.6 p -80.31 -24.84 39.68 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.125 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -71.32 -29.89 65.56 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.597 178.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.71 -30.44 71.54 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.42 176.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 31.4 mm -69.45 -33.94 59.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.539 -179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -65.78 -41.11 92.41 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 -177.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.743 ' NE2' ' HB ' ' A' ' 24' ' ' ILE . 9.0 mt-30 -65.49 -33.13 75.2 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.743 -177.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.412 HG21 ' HB3' ' A' ' 29' ' ' LEU . 22.0 t -58.66 -46.7 90.26 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.03 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.485 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 42.7 t -64.46 -50.61 75.34 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.167 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 -176.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -50.5 -47.51 57.27 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.996 -1.457 . . . . 0.0 112.276 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.64 ' HA ' ' CD ' ' A' ' 84' ' ' LYS . 29.6 pt20 -83.1 -32.91 26.5 Favored 'General case' 0 N--CA 1.432 -1.342 0 C-N-CA 119.531 -0.868 . . . . 0.0 113.272 -176.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.452 ' HB2' ' CG2' ' A' ' 37' ' ' THR . . . -71.27 -32.8 69.13 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-O 121.057 0.456 . . . . 0.0 110.493 -178.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 4.4 pt20 -74.1 -43.24 58.37 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.167 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.64 ' CD ' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -72.78 -25.08 61.04 Favored 'General case' 0 CA--C 1.498 -1.047 0 C-N-CA 118.197 -1.401 . . . . 0.0 111.824 -175.333 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -71.03 -34.12 70.99 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 119.777 -0.769 . . . . 0.0 109.863 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.16 -31.47 25.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.802 177.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -63.18 -38.32 90.71 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 122.871 0.469 . . . . 0.0 111.903 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -87.94 4.08 46.18 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.433 0.635 . . . . 0.0 112.156 -174.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -101.72 -130.65 7.1 Favored Glycine 0 C--N 1.286 -2.249 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.433 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -93.81 -8.1 41.45 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.647 0.737 . . . . 0.0 110.435 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.62 -150.65 17.32 Favored Glycine 0 N--CA 1.422 -2.28 0 N-CA-C 108.716 -1.754 . . . . 0.0 108.716 -176.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 112.91 -19.91 20.4 Favored Glycine 0 C--O 1.189 -2.671 0 C-N-CA 119.723 -1.227 . . . . 0.0 111.079 -177.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -51.38 -37.66 49.31 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 124.088 0.955 . . . . 0.0 111.252 -177.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -76.92 -33.25 57.76 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.014 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.409 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 29.8 pt20 -83.17 -44.51 14.97 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.349 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.46 ' HA ' ' CZ ' ' A' ' 39' ' ' PHE . 93.2 t -64.2 -22.54 31.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 C-N-CA 125.537 1.535 . . . . 0.0 110.687 177.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -45.95 -45.39 15.56 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.471 1.108 . . . . 0.0 112.285 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.8 pt20 -65.25 -18.75 65.56 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -178.214 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.444 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 3.6 tpt -98.87 -45.92 5.82 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.86 -25.02 36.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 120.891 0.376 . . . . 0.0 111.253 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -63.21 -22.66 67.01 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.374 -0.829 . . . . 0.0 111.831 174.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -66.45 -25.99 66.99 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 122.393 0.277 . . . . 0.0 110.444 175.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.471 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -60.97 -30.25 70.15 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 121.564 0.697 . . . . 0.0 110.487 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -70.51 -19.82 62.89 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.188 -178.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 56.0 mtp -92.4 -15.07 27.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.67 -178.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.516 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 97.5 mt -55.78 -45.93 99.81 Favored Pre-proline 0 C--N 1.317 -0.819 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.226 -178.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 14.5 Cg_endo -58.25 -25.01 70.28 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 122.222 1.948 . . . . 0.0 113.195 174.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.05 -47.71 13.19 Favored 'General case' 0 N--CA 1.419 -1.991 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -67.29 -38.45 85.04 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.595 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.437 ' SG ' HD22 ' A' ' 112' ' ' LEU . 15.9 t -90.33 -4.11 57.32 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-O 120.832 0.349 . . . . 0.0 110.336 -177.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 60.31 60.67 1.97 Allowed 'General case' 0 N--CA 1.477 0.916 0 CA-C-O 122.783 1.278 . . . . 0.0 109.67 -178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.464 ' C ' ' H ' ' A' ' 114' ' ' CYS . 38.5 mt -91.65 160.06 15.56 Favored 'General case' 0 C--N 1.286 -2.192 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.133 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -70.0 26.96 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.477 1.111 . . . . 0.0 112.753 -177.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.464 ' H ' ' C ' ' A' ' 112' ' ' LEU . 85.2 m -157.66 158.81 36.15 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 -173.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.7 p -150.99 130.41 12.9 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 48.5 mt . . . . . 0 C--N 1.309 -1.153 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -178.119 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.443 ' HA2' ' O ' ' A' ' 14' ' ' ASP . . . . . . . . 0 CA--C 1.499 -0.915 0 N-CA-C 112.239 -0.345 . . . . 0.0 112.239 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.48 ' H ' ' HB3' ' A' ' 14' ' ' ASP . 35.1 mmt180 -88.59 127.94 35.57 Favored 'General case' 0 CA--C 1.477 -1.858 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 175.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 63.1 m -140.71 151.81 44.81 Favored 'General case' 0 C--N 1.266 -3.053 0 O-C-N 123.399 0.437 . . . . 0.0 110.36 -174.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.3 p -79.43 161.29 26.22 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.825 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -88.11 66.44 8.54 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.725 0.774 . . . . 0.0 109.312 177.285 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 64.8 p -138.57 160.16 40.29 Favored 'General case' 0 N--CA 1.42 -1.967 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.0 mm -128.77 112.85 18.98 Favored Pre-proline 0 C--N 1.302 -1.488 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 176.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -72.62 154.2 98.89 Favored 'Cis proline' 0 CA--C 1.547 1.139 0 C-N-CA 123.716 -1.368 . . . . 0.0 112.228 -0.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.88 150.85 30.76 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 122.264 1.976 . . . . 0.0 113.022 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -98.6 113.07 32.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 105.674 -1.972 . . . . 0.0 105.674 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 80.9 m -106.43 139.28 41.16 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 121.592 0.711 . . . . 0.0 111.963 -177.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -92.26 165.45 19.74 Favored Pre-proline 0 C--N 1.302 -1.471 0 CA-C-N 114.537 -1.21 . . . . 0.0 110.648 -178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -67.16 76.09 0.46 Allowed 'Trans proline' 0 C--N 1.367 1.528 0 C-N-CA 123.064 2.509 . . . . 0.0 111.428 175.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.48 ' HB3' ' H ' ' A' ' 2' ' ' ARG . 9.8 t70 -140.67 132.48 27.47 Favored 'General case' 0 C--N 1.279 -2.469 0 CA-C-N 113.662 -1.608 . . . . 0.0 106.756 175.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.41 23.78 49.67 Favored Glycine 0 C--N 1.304 -1.229 0 C-N-CA 120.296 -0.954 . . . . 0.0 110.935 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.435 ' H ' HD22 ' A' ' 16' ' ' LEU . 1.5 pt? -94.85 -20.88 19.07 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 121.916 0.865 . . . . 0.0 109.13 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -131.33 85.13 2.23 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 174.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -107.93 114.53 59.91 Favored Pre-proline 0 C--N 1.283 -2.294 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.246 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -74.03 -21.36 18.31 Favored 'Trans proline' 0 N--CA 1.451 -1.019 0 C-N-CA 121.319 1.346 . . . . 0.0 110.749 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.499 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 6.0 mpt_? -127.84 -63.2 1.03 Allowed 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 176.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 175.85 -72.2 0.08 OUTLIER Glycine 0 CA--C 1.479 -2.182 0 N-CA-C 108.81 -1.716 . . . . 0.0 108.81 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 32.8 m -74.79 132.92 41.95 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 171.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -100.51 110.17 22.33 Favored 'General case' 0 N--CA 1.414 -2.271 0 C-N-CA 118.165 -1.414 . . . . 0.0 108.817 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 mp -111.92 137.58 44.06 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.899 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 178.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.473 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 13.9 ptp180 -67.25 116.55 8.15 Favored 'General case' 0 N--CA 1.417 -2.111 0 CA-C-O 121.783 0.802 . . . . 0.0 109.335 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.644 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -67.69 -13.75 17.28 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.958 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.257 -174.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -77.43 -16.55 58.74 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.637 -178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.1 pt20 -85.92 -20.31 29.19 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 119.116 -1.034 . . . . 0.0 109.29 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.437 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.5 mm? -91.54 -2.9 57.01 Favored 'General case' 0 CA--C 1.483 -1.607 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.52 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.451 ' HA ' HE21 ' A' ' 33' ' ' GLN . 36.2 t-20 -51.38 -35.4 38.6 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.58 -1.191 . . . . 0.0 110.959 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 t-160 -69.76 -54.42 13.77 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.433 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.7 OUTLIER -54.08 -52.21 61.67 Favored 'General case' 0 C--O 1.22 -0.487 0 O-C-N 123.737 0.648 . . . . 0.0 109.92 178.112 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.451 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.2 tt0 -50.31 -60.06 3.35 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.053 0.941 . . . . 0.0 112.44 177.208 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.9 ptt? -68.13 -39.54 82.68 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.682 -172.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -70.9 -26.26 63.14 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.282 -175.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 90.6 mt -87.62 -27.73 22.32 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.403 ' HA ' HG12 ' A' ' 96' ' ' VAL . 39.9 p -86.01 -22.02 27.5 Favored 'General case' 0 N--CA 1.422 -1.836 0 C-N-CA 118.032 -1.467 . . . . 0.0 111.787 179.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.9 p -90.89 148.07 22.72 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.414 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -111.62 157.72 20.09 Favored 'General case' 0 N--CA 1.417 -2.119 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -121.18 177.92 4.96 Favored 'General case' 0 C--N 1.279 -2.487 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 -177.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.1 p90 -95.93 -35.83 11.3 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -170.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.48 8.88 14.98 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 119.382 -0.927 . . . . 0.0 111.576 -175.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 28.9 mt -76.89 83.49 3.45 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.023 178.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -98.51 -25.24 14.83 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-O 122.4 1.095 . . . . 0.0 109.025 177.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.5 ptp -151.7 82.09 1.28 Allowed 'General case' 0 C--N 1.286 -2.189 0 CA-C-N 113.507 -1.678 . . . . 0.0 107.616 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.8 29.42 7.57 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 113.506 -1.679 . . . . 0.0 108.446 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.3 t -75.24 -61.1 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -144.36 87.77 1.9 Allowed 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -123.15 137.91 29.02 Favored Pre-proline 0 C--N 1.304 -1.4 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.842 -174.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.558 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 11.7 Cg_endo -55.7 -42.15 70.34 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 123.472 2.782 . . . . 0.0 114.298 -178.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -73.76 -18.06 61.02 Favored 'General case' 0 CA--C 1.5 -0.975 0 O-C-N 121.823 -0.548 . . . . 0.0 112.287 -176.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -69.92 -25.23 63.57 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.684 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.558 ' HG2' ' O ' ' A' ' 50' ' ' PRO . 12.7 pt20 -73.05 4.88 3.81 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.803 -177.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.489 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 14.0 pt20 -53.15 -46.55 68.9 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.995 0.918 . . . . 0.0 110.011 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -72.81 -21.47 60.96 Favored 'General case' 0 C--O 1.209 -1.047 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.423 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -77.91 -43.07 31.13 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.4 m -56.84 -34.6 67.92 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 123.655 0.597 . . . . 0.0 110.123 177.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 50.5 mt -79.75 -56.14 4.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.191 177.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 22.7 t -58.97 -49.27 78.49 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 124.186 0.994 . . . . 0.0 111.846 -175.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.495 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.7 t -58.99 -34.39 71.78 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 122.838 0.455 . . . . 0.0 110.651 177.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -77.53 -23.49 50.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.603 0.716 . . . . 0.0 110.852 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -83.17 -47.88 11.12 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.514 178.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.495 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.7 pp -66.48 -31.57 72.4 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.425 0.631 . . . . 0.0 111.014 -177.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.53 -14.6 63.12 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.134 -177.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -77.25 -22.91 51.45 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.453 0.644 . . . . 0.0 109.312 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.2 t -74.78 161.73 4.72 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.088 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.576 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 38.3 mt-10 -53.46 144.01 17.98 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -55.54 -31.24 61.95 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.99 0.916 . . . . 0.0 112.087 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.561 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.9 pt20 -84.94 -5.08 59.35 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.744 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.561 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 61.5 m -125.61 -6.27 6.93 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.991 -175.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.576 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 99.0 mt-30 -61.97 -41.88 98.51 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.433 0.635 . . . . 0.0 109.93 177.108 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 6.0 p -78.28 -23.55 47.17 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.329 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -72.0 -30.96 65.76 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.269 177.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.509 ' HA ' ' HG3' ' A' ' 77' ' ' GLN . . . -60.77 -24.27 65.64 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.267 176.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.479 ' O ' HG23 ' A' ' 79' ' ' VAL . 32.6 mm -74.31 -29.97 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.683 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -71.54 -39.19 70.85 Favored 'General case' 0 CA--C 1.489 -1.383 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 -176.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.509 ' HG3' ' HA ' ' A' ' 74' ' ' ALA . 44.0 mm-40 -56.16 -46.75 79.19 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 112.286 -2.234 . . . . 0.0 109.075 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.437 HG22 ' HB3' ' A' ' 29' ' ' LEU . 12.2 t -57.89 -46.25 87.47 Favored 'Isoleucine or valine' 0 C--N 1.354 0.786 0 O-C-N 124.297 0.998 . . . . 0.0 109.667 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 75' ' ' ILE . 23.6 t -67.49 -41.3 85.84 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.813 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.898 -173.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -60.83 -52.83 63.42 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.107 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.644 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.1 pt20 -68.89 -37.27 78.9 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -176.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.62 -37.14 73.77 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 120.903 0.382 . . . . 0.0 111.508 -177.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -75.72 -38.43 58.55 Favored 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.233 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.472 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -67.34 -33.17 74.69 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 120.593 0.235 . . . . 0.0 111.07 -177.197 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.472 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 2.2 pt20 -72.2 -29.82 64.35 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.073 0.463 . . . . 0.0 110.769 -176.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -87.14 -33.11 19.53 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.534 0.683 . . . . 0.0 111.454 175.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -63.15 -36.5 83.82 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.256 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -81.99 -6.98 59.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.006 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -92.06 -133.08 5.97 Favored Glycine 0 N--CA 1.429 -1.827 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.161 -177.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -104.83 -18.95 14.05 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 120.891 0.377 . . . . 0.0 111.098 -176.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 154.61 -141.57 8.3 Favored Glycine 0 CA--C 1.477 -2.343 0 N-CA-C 109.159 -1.576 . . . . 0.0 109.159 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 96.06 -24.44 29.98 Favored Glycine 0 N--CA 1.424 -2.112 0 C-N-CA 120.358 -0.925 . . . . 0.0 113.267 176.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -54.05 -31.52 51.76 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -77.11 -35.17 56.57 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.327 179.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -83.99 -43.54 15.07 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.61 0.719 . . . . 0.0 109.68 -177.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.403 HG12 ' HA ' ' A' ' 37' ' ' THR . 95.4 t -63.04 -23.15 32.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.507 177.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -46.48 -43.73 16.94 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.675 0.79 . . . . 0.0 112.936 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -69.4 -17.94 63.71 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.098 0.475 . . . . 0.0 111.865 -177.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 5.9 tpt -102.06 -47.38 4.57 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.143 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.5 p -64.73 -24.03 34.7 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.692 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.469 ' HG3' ' N ' ' A' ' 102' ' ' LYS . 34.9 pttt -59.23 -26.96 65.32 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.778 -0.576 . . . . 0.0 110.711 173.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.469 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 26.0 mtpp -65.02 -28.71 69.68 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.412 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -61.43 -43.49 98.78 Favored 'General case' 0 C--O 1.197 -1.659 0 O-C-N 123.931 0.769 . . . . 0.0 108.959 174.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -70.67 -16.89 62.84 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.197 -178.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 27.3 mtm -91.39 -13.38 32.52 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.095 -0.378 . . . . 0.0 111.29 177.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.536 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 95.7 mt -50.64 -45.35 85.62 Favored Pre-proline 0 CA--C 1.543 0.698 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 16.0 Cg_endo -58.25 -24.54 67.96 Favored 'Trans proline' 0 C--N 1.367 1.53 0 C-N-CA 122.172 1.915 . . . . 0.0 112.86 176.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -85.62 -44.06 12.94 Favored 'General case' 0 N--CA 1.413 -2.307 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -73.21 -35.86 66.39 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.315 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 25.0 t -90.05 -3.83 57.73 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-O 121.331 0.586 . . . . 0.0 109.797 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 61.7 t30 62.37 50.86 3.57 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 122.736 1.255 . . . . 0.0 110.853 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 66.3 mt -89.54 158.61 17.59 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.712 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -80.3 43.79 0.65 Allowed 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 124.067 0.947 . . . . 0.0 112.06 -174.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 59.5 m -159.16 162.63 36.4 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.4 p -146.32 140.71 26.64 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 73.0 mt . . . . . 0 C--N 1.307 -1.262 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.48 -178.51 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.542 ' HA3' ' O ' ' A' ' 12' ' ' PHE . . . . . . . . 0 CA--C 1.503 -0.713 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 64.7 mtm-85 -94.7 127.16 40.49 Favored 'General case' 0 CA--C 1.493 -1.243 0 CA-C-N 117.161 0.481 . . . . 0.0 109.725 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 21.5 m -113.52 147.82 37.22 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -176.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.4 p -78.58 146.16 34.36 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 175.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -87.82 69.82 9.54 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.676 0.75 . . . . 0.0 109.358 177.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.8 t -146.85 171.47 15.15 Favored 'General case' 0 N--CA 1.418 -2.074 0 N-CA-C 106.7 -1.592 . . . . 0.0 106.7 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 37.9 mm -128.84 119.83 20.21 Favored Pre-proline 0 C--N 1.305 -1.362 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -71.72 146.91 86.89 Favored 'Cis proline' 0 C--O 1.249 1.049 0 C-N-CA 123.751 -1.354 . . . . 0.0 111.645 -1.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -73.97 139.66 27.48 Favored 'Trans proline' 0 N--CA 1.445 -1.353 0 C-N-CA 122.252 1.968 . . . . 0.0 111.347 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.3 mm -106.18 115.54 48.05 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.464 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.8 t -117.57 132.34 56.54 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 119.431 -0.908 . . . . 0.0 111.028 -176.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.542 ' O ' ' HA3' ' A' ' 1' ' ' GLY . 48.3 m-85 -97.45 150.47 36.83 Favored Pre-proline 0 C--N 1.302 -1.473 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.756 -179.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.36 11.98 2.48 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.839 2.359 . . . . 0.0 114.097 -175.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -120.91 137.94 54.35 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 178.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -167.55 -97.9 0.12 Allowed Glycine 0 N--CA 1.42 -2.426 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -143.49 165.14 28.39 Favored 'General case' 0 N--CA 1.405 -2.696 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 -178.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -129.38 4.75 5.18 Favored 'General case' 0 C--N 1.272 -2.776 0 CA-C-O 121.421 0.629 . . . . 0.0 111.524 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -105.28 104.56 48.15 Favored Pre-proline 0 C--N 1.299 -1.592 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 174.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.44 -31.82 86.97 Favored 'Trans proline' 0 C--O 1.24 0.598 0 C-N-CA 123.47 2.78 . . . . 0.0 113.822 -174.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.629 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 2.5 mpt_? -99.85 -50.03 4.16 Favored 'General case' 0 CA--C 1.488 -1.412 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.65 34.27 9.37 Favored Glycine 0 CA--C 1.465 -3.065 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 -178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 64.0 m -63.41 137.46 58.17 Favored 'General case' 0 N--CA 1.417 -2.117 0 CA-C-N 113.95 -1.125 . . . . 0.0 110.146 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -101.7 121.96 43.02 Favored 'General case' 0 N--CA 1.417 -2.124 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 173.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mp -122.26 134.41 65.58 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.395 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 -178.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.476 ' HG2' HE21 ' A' ' 28' ' ' GLN . 14.1 ptp180 -66.75 121.98 16.64 Favored 'General case' 0 N--CA 1.426 -1.655 0 O-C-N 123.913 0.758 . . . . 0.0 110.203 -173.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -64.13 -17.13 20.2 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.267 -175.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -75.94 -13.62 60.25 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.219 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.476 HE21 ' HG2' ' A' ' 25' ' ' ARG . 5.0 pt20 -96.46 -10.53 27.25 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.124 178.07 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -98.7 4.95 47.93 Favored 'General case' 0 CA--C 1.488 -1.42 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.18 176.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 34' ' ' MET . 7.8 t30 -50.57 -36.6 35.39 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.27 -1.332 . . . . 0.0 113.099 -179.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -72.23 -53.61 12.06 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -178.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -54.72 -51.36 65.84 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 124.493 1.121 . . . . 0.0 108.809 -178.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -52.25 -56.03 17.39 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 124.201 1.001 . . . . 0.0 112.792 176.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.498 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 15.6 ptp -67.88 -43.63 78.91 Favored 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 119.849 -0.74 . . . . 0.0 112.788 -175.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.429 ' HB3' ' HD1' ' A' ' 55' ' ' HIS . 4.1 m-70 -65.29 -25.34 67.59 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.472 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.406 ' O ' ' HB3' ' A' ' 99' ' ' MET . 93.1 mt -85.53 -32.54 22.13 Favored 'General case' 0 C--O 1.209 -1.076 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.809 175.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.475 ' CG2' ' HB1' ' A' ' 82' ' ' ALA . 40.7 p -86.43 -21.13 27.26 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 118.645 -1.222 . . . . 0.0 112.621 -177.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.5 m -89.6 121.11 31.48 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 113.037 0.755 . . . . 0.0 113.037 -177.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -102.34 89.52 3.59 Favored 'General case' 0 C--N 1.29 -2.019 0 N-CA-C 103.436 -2.801 . . . . 0.0 103.436 165.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -74.32 172.69 11.4 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.688 -1.142 . . . . 0.0 112.076 -167.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -98.49 -32.05 11.67 Favored 'General case' 0 C--N 1.295 -1.77 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -168.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.07 5.07 31.13 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 119.003 -1.079 . . . . 0.0 111.554 -176.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 53.1 mt -77.87 86.51 4.1 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 174.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.9 mtt180 -110.32 -56.71 2.3 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.365 -174.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 66.6 mtt -98.14 -12.48 21.71 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 121.648 0.737 . . . . 0.0 110.051 177.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.42 90.73 8.48 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.469 176.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.46 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 49.1 t -124.82 -58.56 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 177.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -121.93 79.51 1.59 Allowed 'General case' 0 N--CA 1.433 -1.3 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 175.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -134.8 161.58 62.87 Favored Pre-proline 0 C--N 1.308 -1.196 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -59.56 -28.03 86.43 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.445 2.097 . . . . 0.0 110.492 173.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -66.59 -12.99 60.46 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.67 -0.695 . . . . 0.0 112.053 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' A' ' 47' ' ' VAL . 15.9 mm100 -85.41 -11.58 54.1 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.476 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -117.14 11.94 14.31 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 121.114 0.483 . . . . 0.0 110.094 177.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.547 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 11.1 pt20 -59.3 -33.16 70.75 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.91 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.429 ' HD1' ' HB3' ' A' ' 35' ' ' HIS . 0.8 OUTLIER -66.11 -22.26 66.39 Favored 'General case' 0 C--O 1.204 -1.309 0 CA-C-N 114.823 -1.081 . . . . 0.0 111.433 -178.478 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -81.1 -44.94 17.21 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.1 m -56.99 -32.09 65.76 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 124.052 0.845 . . . . 0.0 109.671 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 54.7 mt -87.83 -49.52 7.05 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.213 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 52.5 t -61.09 -49.77 75.96 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.294 0.237 . . . . 0.0 111.383 -179.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.526 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 53.1 t -58.78 -32.27 69.16 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.581 0.352 . . . . 0.0 110.586 178.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -80.4 -26.04 38.74 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.489 0.661 . . . . 0.0 110.687 -177.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -82.85 -46.13 13.41 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.281 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.526 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.6 pp -67.36 -32.45 73.38 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.554 -177.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -70.85 -9.82 58.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.781 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -78.67 -17.69 55.56 Favored 'General case' 0 C--O 1.247 0.935 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 176.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 8.4 t -85.23 162.48 2.9 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 175.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.499 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 2.5 mm-40 -49.89 144.62 6.33 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 124.155 0.982 . . . . 0.0 112.405 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -58.63 -33.51 70.14 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.316 0.579 . . . . 0.0 111.599 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -79.61 -11.49 59.87 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.073 -178.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 62.6 m -116.47 -9.49 11.43 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.929 -175.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.499 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 71.7 mt-30 -57.45 -49.37 76.47 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.387 0.675 . . . . 0.0 112.229 178.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 25.4 p -76.57 -23.7 53.52 Favored 'General case' 0 CA--C 1.499 -1.012 0 C-N-CA 119.494 -0.882 . . . . 0.0 111.841 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -66.56 -35.2 79.64 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 178.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.505 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -60.49 -26.66 66.98 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.372 0.669 . . . . 0.0 111.185 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.459 ' O ' HG21 ' A' ' 79' ' ' VAL . 19.8 mm -72.94 -26.45 23.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.341 0.591 . . . . 0.0 109.537 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -75.88 -38.87 57.42 Favored 'General case' 0 CA--C 1.495 -1.152 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 -174.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -58.09 -44.61 87.72 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 112.335 -2.212 . . . . 0.0 108.996 178.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 74' ' ' ALA . 22.4 t -56.63 -46.38 82.76 Favored 'Isoleucine or valine' 0 C--N 1.359 0.987 0 O-C-N 124.428 1.08 . . . . 0.0 109.601 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.459 HG21 ' O ' ' A' ' 75' ' ' ILE . 41.7 t -65.9 -47.32 85.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -175.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.14 -40.62 86.07 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.297 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -82.02 -31.45 30.98 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.266 0.555 . . . . 0.0 111.275 -178.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.475 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -77.83 -31.23 51.51 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.021 0.439 . . . . 0.0 111.877 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -80.33 -33.75 37.19 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -33.5 63.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.382 -176.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.402 ' HG3' HD21 ' A' ' 86' ' ' LEU . 15.7 pt20 -67.4 -32.52 73.47 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.125 0.488 . . . . 0.0 110.416 -178.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.453 ' HG ' HG22 ' A' ' 96' ' ' VAL . 4.0 mm? -84.29 -29.21 26.58 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.993 177.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -66.91 -38.35 86.05 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.423 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -79.41 -4.64 52.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.447 0.641 . . . . 0.0 111.084 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -95.5 -133.96 7.59 Favored Glycine 0 N--CA 1.426 -2.021 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -92.13 -49.64 6.09 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.633 0.73 . . . . 0.0 109.726 -178.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.426 ' O ' HD11 ' A' ' 86' ' ' LEU . . . 178.11 -152.7 11.92 Favored Glycine 0 CA--C 1.484 -1.861 0 N-CA-C 107.348 -2.301 . . . . 0.0 107.348 -176.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 111.53 -23.69 17.25 Favored Glycine 0 C--O 1.201 -1.925 0 C-N-CA 119.975 -1.107 . . . . 0.0 111.872 178.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.4 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 48.1 mt-30 -49.96 -34.65 21.5 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 124.297 1.039 . . . . 0.0 112.376 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -75.46 -40.83 56.95 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.56 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 20.8 pt20 -80.08 -45.13 18.81 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-O 121.231 0.539 . . . . 0.0 109.67 -175.521 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.453 HG22 ' HG ' ' A' ' 86' ' ' LEU . 88.1 t -63.04 -22.76 31.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 C-N-CA 124.893 1.277 . . . . 0.0 110.759 177.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 28.6 tt0 -54.25 -35.18 62.22 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.23 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.56 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 10.2 pt20 -69.41 -17.45 63.66 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.033 0.444 . . . . 0.0 111.199 -178.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.406 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 2.9 tpt -103.2 -44.03 5.3 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -177.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.2 p -66.82 -23.71 31.48 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 CA-C-O 121.079 0.466 . . . . 0.0 110.972 177.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -21.57 66.6 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 121.867 -0.52 . . . . 0.0 111.278 175.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -67.12 -28.07 67.85 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -68.93 -25.42 64.57 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-O 121.457 0.646 . . . . 0.0 110.131 176.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -70.71 -25.17 62.83 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 122.014 0.912 . . . . 0.0 108.883 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 38.8 mtp -92.3 -14.67 28.47 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.491 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.451 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.2 OUTLIER -52.07 -48.46 88.5 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 124.491 1.116 . . . . 0.0 111.305 -177.553 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 18.6 Cg_endo -59.28 -23.18 68.65 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 121.581 1.521 . . . . 0.0 113.494 177.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -89.19 -40.31 12.96 Favored 'General case' 0 N--CA 1.416 -2.139 0 C-N-CA 119.861 -0.735 . . . . 0.0 110.489 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -66.56 -41.73 88.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.276 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.401 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 30.3 t -88.49 -6.02 57.87 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.283 -176.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 60.56 61.45 1.73 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 123.116 1.436 . . . . 0.0 110.616 -178.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.401 ' HG ' ' HB3' ' A' ' 110' ' ' CYS . 54.8 mt -102.34 158.46 16.18 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 113.472 -1.695 . . . . 0.0 109.536 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -78.87 49.79 0.95 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.002 0.921 . . . . 0.0 111.391 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 18.2 m -158.19 159.08 35.73 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 123.939 0.896 . . . . 0.0 109.99 -176.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.5 p -147.78 116.83 6.82 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 176.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 72.0 mt . . . . . 0 C--N 1.305 -1.33 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 -176.387 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.317 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.7 mtp85 -94.93 147.98 22.8 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 81.0 m -143.03 149.38 38.18 Favored 'General case' 0 C--N 1.293 -1.85 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.4 p -74.37 160.85 30.48 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -94.3 71.91 3.85 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 120.112 -0.635 . . . . 0.0 110.707 -178.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.4 t -152.06 167.39 28.61 Favored 'General case' 0 N--CA 1.428 -1.53 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.5 mt -129.05 118.89 19.56 Favored Pre-proline 0 C--N 1.311 -1.104 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.95 148.41 90.73 Favored 'Cis proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.711 -1.37 . . . . 0.0 112.591 0.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -74.2 143.98 32.73 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.36 2.04 . . . . 0.0 112.555 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.6 mm -96.24 115.27 35.1 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 176.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 76.8 m -106.05 147.36 29.0 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -174.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -125.62 135.53 27.09 Favored Pre-proline 0 N--CA 1.433 -1.29 0 C-N-CA 124.238 1.015 . . . . 0.0 111.651 -176.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -64.97 -33.94 49.57 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 122.818 2.345 . . . . 0.0 112.078 -179.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -120.2 -78.85 0.6 Allowed 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.03 -178.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 62.25 29.25 72.5 Favored Glycine 0 N--CA 1.439 -1.121 0 O-C-N 123.772 0.67 . . . . 0.0 112.925 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.24 -44.26 1.15 Allowed 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 117.507 0.654 . . . . 0.0 110.721 -175.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -106.14 103.02 12.4 Favored 'General case' 0 C--N 1.288 -2.09 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -134.63 124.31 16.82 Favored Pre-proline 0 C--N 1.304 -1.375 0 CA-C-N 115.92 -0.582 . . . . 0.0 112.412 -173.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -71.1 -37.02 6.54 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.375 2.05 . . . . 0.0 110.864 172.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.551 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 0.3 OUTLIER -112.12 -57.01 2.33 Favored 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.899 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 149.15 -66.85 0.38 Allowed Glycine 0 CA--C 1.481 -2.055 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.774 -177.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.0 m -65.81 130.22 42.52 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 115.105 -0.548 . . . . 0.0 110.45 176.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -106.75 114.38 28.44 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-O 122.196 0.998 . . . . 0.0 109.252 175.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 mp -113.45 128.87 70.07 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.551 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 -177.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.552 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.6 ptp180 -67.29 124.2 22.46 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-O 121.467 0.651 . . . . 0.0 111.609 -174.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.73 -19.74 21.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.539 -176.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -76.33 -11.71 59.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.314 -178.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.552 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 3.4 pt20 -98.63 -10.47 23.28 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 119.616 -0.834 . . . . 0.0 110.575 178.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -105.94 3.83 28.87 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.556 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.502 ' O ' ' HG2' ' A' ' 34' ' ' MET . 3.7 t-20 -57.4 -34.81 69.26 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.492 0.495 . . . . 0.0 111.528 -176.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -69.13 -53.83 18.12 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.17 -52.57 62.89 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.578 -1.192 . . . . 0.0 108.46 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -51.16 -60.77 2.75 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 125.022 1.329 . . . . 0.0 112.415 176.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.502 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.6 ptm -66.21 -39.61 89.74 Favored 'General case' 0 C--O 1.208 -1.108 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -173.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.407 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 2.5 t-80 -68.47 -27.08 65.84 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.543 -175.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.8 mt -82.97 -34.74 26.35 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.578 176.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 41.4 p -82.52 -21.68 35.32 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 118.447 -1.301 . . . . 0.0 112.007 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -90.15 121.73 32.46 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.682 -178.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -98.92 96.79 8.09 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 168.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -67.99 176.76 2.46 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.702 0.763 . . . . 0.0 112.941 -170.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 28.9 p90 -105.29 -32.43 8.62 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 124.004 0.922 . . . . 0.0 112.583 -170.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.82 6.09 29.65 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.866 -175.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 52.8 mt -75.01 89.79 2.43 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.522 179.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 72.6 mtm180 -117.66 -39.35 3.15 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 178.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 22.7 mmt -99.52 15.72 25.61 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 114.59 -1.187 . . . . 0.0 108.475 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -134.2 88.89 2.5 Favored 'General case' 0 N--CA 1.434 -1.251 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.216 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 59.7 t -109.58 -59.83 3.12 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -139.69 28.34 2.19 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 122.363 1.077 . . . . 0.0 108.189 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -78.28 150.46 77.14 Favored Pre-proline 0 C--N 1.31 -1.117 0 CA-C-N 113.847 -1.524 . . . . 0.0 111.073 -175.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.06 -30.36 89.92 Favored 'Trans proline' 0 C--O 1.216 -0.611 0 C-N-CA 123.509 2.806 . . . . 0.0 112.467 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -64.84 -7.42 11.13 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -178.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -70.31 -14.56 62.64 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-O 120.947 0.403 . . . . 0.0 110.481 175.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -72.52 -2.09 18.38 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.879 176.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.48 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 20.3 pt20 -55.92 -43.62 77.51 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 122.908 0.483 . . . . 0.0 111.703 -178.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.407 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -71.19 -20.55 62.26 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-O 120.988 0.423 . . . . 0.0 110.972 -179.802 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -80.5 -41.86 23.53 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 179.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.4 m -57.83 -28.99 64.58 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.374 0.606 . . . . 0.0 110.312 176.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 60.1 mt -86.82 -55.73 3.72 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.801 178.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 51.9 t -59.57 -48.16 82.74 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.291 0.636 . . . . 0.0 111.827 -177.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.556 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 24.9 t -60.49 -33.64 72.89 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 122.835 0.454 . . . . 0.0 110.583 178.351 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.416 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 3.2 t-20 -78.31 -23.85 46.93 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.803 0.811 . . . . 0.0 110.035 -177.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -82.1 -47.93 11.97 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.774 178.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.556 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.8 pp -68.04 -30.71 69.99 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.508 -176.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.416 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 16.9 pt20 -69.05 -15.28 63.42 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.19 -176.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -82.42 -18.36 42.14 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.393 0.616 . . . . 0.0 110.306 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 12.0 t -76.76 163.27 3.97 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 175.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.466 ' HB2' ' SG ' ' A' ' 70' ' ' CYS . 46.0 mt-10 -47.73 147.48 1.88 Allowed 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 123.545 0.738 . . . . 0.0 112.295 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.456 ' HB2' HE22 ' A' ' 113' ' ' GLN . 22.0 ptmt -50.83 -38.62 50.02 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.068 0.947 . . . . 0.0 112.874 -176.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.504 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 4.1 pt20 -87.6 -19.55 27.64 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.504 0.669 . . . . 0.0 110.666 -177.372 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.504 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 44.6 m -96.97 -9.1 28.95 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.152 -171.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -57.11 -46.91 82.23 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-O 121.339 0.59 . . . . 0.0 109.844 175.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.5 p -76.87 -23.6 52.62 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.541 0.686 . . . . 0.0 111.546 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -72.87 -30.52 64.03 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.425 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.55 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -62.44 -27.42 69.1 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.398 176.415 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.497 ' O ' HG22 ' A' ' 79' ' ' VAL . 32.4 mm -70.21 -27.69 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.528 -179.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -74.78 -41.78 59.38 Favored 'General case' 0 CA--C 1.5 -0.963 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 -176.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.445 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 50.2 mm-40 -59.05 -42.33 90.04 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 112.227 -2.26 . . . . 0.0 110.374 -179.198 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 74' ' ' ALA . 30.5 t -60.39 -43.95 95.02 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.497 HG22 ' O ' ' A' ' 75' ' ' ILE . 48.0 t -64.4 -47.29 90.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.836 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -177.097 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.63 -59.46 4.81 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.505 -179.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 9.5 pt20 -66.41 -30.24 70.56 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 120.931 0.396 . . . . 0.0 112.024 -175.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.3 -40.45 62.25 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 121.019 -0.273 . . . . 0.0 110.905 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -76.67 -36.94 57.0 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 119.794 -0.762 . . . . 0.0 110.646 -177.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.25 -26.46 62.91 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.618 -0.265 . . . . 0.0 110.869 -177.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -77.63 -30.28 52.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.493 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.556 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.0 mm? -86.18 -40.81 15.24 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.809 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.44 -31.76 70.73 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.629 0.772 . . . . 0.0 112.12 -177.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -77.55 -12.9 60.01 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.782 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -129.09 -100.83 0.97 Allowed Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 119.766 -1.207 . . . . 0.0 113.894 -175.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -71.2 -22.46 62.02 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -173.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.556 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 106.45 -88.54 0.56 Allowed Glycine 0 CA--C 1.472 -2.62 0 N-CA-C 107.917 -2.073 . . . . 0.0 107.917 -174.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.416 ' HA3' HD11 ' A' ' 86' ' ' LEU . . . 79.03 -46.56 2.97 Favored Glycine 0 C--O 1.189 -2.712 0 CA-C-O 118.98 -0.9 . . . . 0.0 114.559 171.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.458 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 52.3 mt-30 -46.45 -27.62 1.14 Allowed 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 125.001 1.321 . . . . 0.0 114.399 -175.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 7.8 pt20 -71.98 -46.56 56.87 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.783 0.325 . . . . 0.0 111.019 176.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.462 ' N ' ' HG3' ' A' ' 94' ' ' GLN . 28.9 pt20 -85.63 -47.17 10.09 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.632 0.73 . . . . 0.0 110.265 -176.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 69.6 t -59.82 -22.56 24.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 C-N-CA 126.331 1.852 . . . . 0.0 110.679 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.458 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 8.6 tt0 -46.2 -44.73 16.34 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.085 0.554 . . . . 0.0 112.469 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -68.17 -18.74 64.69 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 3.9 tpt -100.33 -46.69 5.18 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -175.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.6 p -65.74 -25.85 37.44 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.194 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -24.54 67.93 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 121.93 -0.481 . . . . 0.0 111.335 176.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -65.46 -29.29 69.94 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 122.963 0.505 . . . . 0.0 110.447 178.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.405 ' HA ' HD12 ' A' ' 106' ' ' LEU . . . -58.26 -32.08 68.03 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-O 121.383 0.611 . . . . 0.0 110.556 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.546 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 37.1 mt-30 -68.78 -18.19 64.16 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.864 -178.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 42.9 mtp -91.56 -15.09 29.19 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.422 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 6.4 mp -53.44 -49.07 90.42 Favored Pre-proline 0 C--N 1.319 -0.728 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 25.5 Cg_endo -61.64 -22.31 74.14 Favored 'Trans proline' 0 C--N 1.364 1.39 0 C-N-CA 121.567 1.511 . . . . 0.0 113.077 177.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -85.09 -41.59 15.59 Favored 'General case' 0 N--CA 1.411 -2.385 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -75.88 -42.45 49.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.858 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.454 ' SG ' HD13 ' A' ' 63' ' ' LEU . 8.9 t -84.09 -2.08 56.08 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.649 -174.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 60.69 61.47 1.69 Allowed 'General case' 0 CA--C 1.508 -0.67 0 CA-C-O 122.991 1.377 . . . . 0.0 109.84 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.403 ' CG ' ' HA ' ' A' ' 107' ' ' PRO . 39.4 mt -96.86 158.03 15.62 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 114.106 -1.406 . . . . 0.0 109.53 178.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.456 HE22 ' HB2' ' A' ' 68' ' ' LYS . 70.7 mt-30 -81.37 43.74 0.75 Allowed 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 122.071 0.938 . . . . 0.0 111.57 -174.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 98.3 m -163.39 149.98 12.18 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 104.637 -2.357 . . . . 0.0 104.637 -177.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.7 m -142.38 139.48 31.73 Favored 'General case' 0 C--N 1.288 -2.072 0 CA-C-N 118.632 0.651 . . . . 0.0 109.602 178.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.546 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 55.1 mt . . . . . 0 C--N 1.3 -1.55 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -178.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.662 0 N-CA-C 111.321 -0.712 . . . . 0.0 111.321 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -76.81 127.79 33.4 Favored 'General case' 0 CA--C 1.49 -1.33 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 176.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.426 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 72.2 m -138.65 151.54 47.29 Favored 'General case' 0 C--N 1.282 -2.347 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.117 -176.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.9 p -81.79 172.37 13.43 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 120.96 0.409 . . . . 0.0 110.151 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -97.6 81.99 3.01 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.614 0.721 . . . . 0.0 109.87 176.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.1 t -156.27 164.56 38.18 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.4 mm -129.18 116.62 18.83 Favored Pre-proline 0 C--N 1.305 -1.358 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 177.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -72.65 146.53 86.9 Favored 'Cis proline' 0 C--O 1.244 0.778 0 C-N-CA 124.024 -1.24 . . . . 0.0 111.33 -1.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.426 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 61.2 Cg_endo -70.57 153.25 65.31 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.498 2.132 . . . . 0.0 112.263 -177.241 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.1 mm -95.66 107.92 20.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 N-CA-C 106.46 -1.682 . . . . 0.0 106.46 176.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 80.9 m -104.77 137.77 42.06 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-O 121.687 0.756 . . . . 0.0 112.144 -176.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.418 ' C ' ' H ' ' A' ' 14' ' ' ASP . 74.7 m-85 -81.28 162.38 59.16 Favored Pre-proline 0 C--N 1.295 -1.798 0 CA-C-N 114.185 -1.371 . . . . 0.0 109.811 178.103 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.0 42.58 1.13 Allowed 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 123.073 2.515 . . . . 0.0 111.266 178.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.418 ' H ' ' C ' ' A' ' 12' ' ' PHE . 13.6 t70 -78.83 79.43 5.23 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.453 -178.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -140.96 33.27 2.04 Favored Glycine 0 C--N 1.289 -2.072 0 N-CA-C 106.964 -2.454 . . . . 0.0 106.964 174.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 pp -135.92 -11.2 2.02 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.215 -1.493 . . . . 0.0 113.32 -172.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -92.76 87.22 5.78 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-O 121.979 0.895 . . . . 0.0 109.188 178.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -135.38 96.26 14.0 Favored Pre-proline 0 C--N 1.289 -2.038 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 -177.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.404 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . 85.8 Cg_exo -51.7 -51.55 10.94 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.344 2.696 . . . . 0.0 111.975 -175.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.681 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 1.3 mpt_? -104.58 -51.26 3.12 Favored 'General case' 0 CA--C 1.486 -1.493 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 176.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 170.94 -49.42 0.19 Allowed Glycine 0 N--CA 1.405 -3.432 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 88.4 m -84.19 130.09 34.85 Favored 'General case' 0 C--N 1.271 -2.807 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 173.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -106.43 94.07 4.94 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 122.11 0.957 . . . . 0.0 108.923 177.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.424 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.1 mp -98.05 130.62 46.55 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.606 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 -176.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.495 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 35.7 ptt180 -67.37 116.26 7.92 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-O 121.15 0.5 . . . . 0.0 111.402 -176.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.491 ' HB ' ' OE1' ' A' ' 81' ' ' GLN . 2.6 pp -60.82 -18.5 17.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.918 -176.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -73.67 -16.57 61.21 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.879 -178.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.9 pt20 -89.56 -15.86 31.95 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.439 ' HB3' HG23 ' A' ' 78' ' ' VAL . 2.7 mm? -97.67 6.37 48.07 Favored 'General case' 0 CA--C 1.485 -1.555 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.417 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -56.59 -34.15 66.89 Favored 'General case' 0 C--N 1.31 -1.136 0 O-C-N 124.068 0.855 . . . . 0.0 111.655 -178.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -70.58 -52.88 18.56 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.5 t -54.51 -50.57 67.52 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.759 -1.109 . . . . 0.0 108.166 -178.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -52.94 -58.49 6.77 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 124.401 1.08 . . . . 0.0 112.161 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -66.14 -39.04 89.55 Favored 'General case' 0 C--O 1.214 -0.788 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.607 -173.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.404 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 1.9 t-80 -73.05 -24.87 60.75 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.183 -175.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 99' ' ' MET . 95.7 mt -88.68 -23.44 23.0 Favored 'General case' 0 C--O 1.21 -0.979 0 C-N-CA 120.866 -0.333 . . . . 0.0 111.781 177.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.417 ' HA ' HG11 ' A' ' 96' ' ' VAL . 40.8 p -89.52 -21.61 22.83 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 118.382 -1.327 . . . . 0.0 111.338 178.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.5 m -90.29 152.96 20.81 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.846 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -129.88 -178.64 4.8 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.806 0.812 . . . . 0.0 111.658 179.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.757 ' OD1' ' HD3' ' A' ' 42' ' ' LYS . 11.8 t70 -127.86 -179.88 5.19 Favored 'General case' 0 N--CA 1.386 -3.666 0 N-CA-C 102.175 -3.269 . . . . 0.0 102.175 175.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -149.86 -33.61 0.19 Allowed 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 119.267 0.94 . . . . 0.0 110.728 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.757 ' HD3' ' OD1' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -86.21 7.43 25.13 Favored 'General case' 0 N--CA 1.425 -1.686 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.092 -177.094 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.494 ' HG ' ' OD1' ' A' ' 40' ' ' ASP . 95.7 mt -58.74 102.28 0.11 Allowed 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.48 0.712 . . . . 0.0 110.303 174.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -89.45 -26.67 20.84 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-O 121.774 0.797 . . . . 0.0 109.495 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 18.2 ptt? -148.01 87.31 1.6 Allowed 'General case' 0 N--CA 1.416 -2.147 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.81 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.44 ' HA ' ' ND2' ' A' ' 49' ' ' ASN . . . -100.95 19.79 16.68 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.338 177.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 46.2 t -68.69 -54.57 20.16 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.455 -176.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -142.64 91.33 2.3 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-O 121.75 0.786 . . . . 0.0 110.983 -177.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.485 ' HB2' ' HG2' ' A' ' 52' ' ' GLN . 73.7 m-20 -129.97 151.57 78.49 Favored Pre-proline 0 C--N 1.303 -1.452 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 178.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -58.6 -34.61 98.98 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.458 2.106 . . . . 0.0 109.802 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.596 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 55.1 mtmt -67.07 -16.57 64.42 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 114.167 -1.379 . . . . 0.0 113.175 -178.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.485 ' HG2' ' HB2' ' A' ' 49' ' ' ASN . 12.3 mm100 -74.96 -23.46 58.29 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 118.601 -1.24 . . . . 0.0 110.782 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -113.98 13.43 18.24 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 119.851 -0.74 . . . . 0.0 110.925 177.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.599 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 30.1 pt20 -63.78 -47.73 79.78 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.404 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 1.0 OUTLIER -66.91 -20.29 65.88 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.433 178.715 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.0 tp -72.71 -54.27 9.42 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 174.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.5 m -57.94 -21.03 41.99 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.057 -179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 58.4 mt -90.19 -57.79 2.72 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.507 176.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 50.7 t -67.3 -50.4 60.42 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.119 0.568 . . . . 0.0 111.849 -176.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.595 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 43.4 t -61.71 -34.94 76.68 Favored 'General case' 0 CA--C 1.495 -1.14 0 CA-C-O 121.645 0.736 . . . . 0.0 109.262 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.416 ' O ' ' HG2' ' A' ' 64' ' ' GLN . 8.9 t30 -72.49 -35.93 68.28 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.631 178.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -76.06 -38.99 56.44 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-O 120.875 0.369 . . . . 0.0 111.376 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.595 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.9 pp -71.83 -30.96 66.03 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 121.05 0.452 . . . . 0.0 110.617 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 24.2 pt20 -73.36 -4.27 32.36 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.189 0.518 . . . . 0.0 110.883 -177.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 7.9 mm-40 -84.94 -17.92 36.21 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 122.017 0.913 . . . . 0.0 108.578 176.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 10.2 t -85.07 164.19 2.56 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.464 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 4.9 mp0 -54.21 141.83 28.05 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 124.362 1.065 . . . . 0.0 110.616 177.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -57.6 -33.02 67.76 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -174.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.46 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 16.7 pt20 -80.22 -9.6 59.73 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.597 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.46 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.3 m -112.29 -9.57 13.87 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.215 -174.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 29.1 mt-30 -61.52 -40.24 93.92 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 121.123 0.487 . . . . 0.0 110.774 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 1.9 p -79.47 -27.24 41.58 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.317 0.579 . . . . 0.0 111.295 177.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -69.35 -33.46 73.13 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.584 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.51 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -59.06 -30.75 68.28 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.003 177.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.46 ' O ' HG21 ' A' ' 79' ' ' VAL . 31.6 mm -66.94 -34.81 72.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.045 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -71.84 -40.07 69.3 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 -172.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 7.2 mm100 -62.31 -37.12 84.35 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 112.579 -2.101 . . . . 0.0 109.439 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 74' ' ' ALA . 33.3 t -60.86 -48.48 88.71 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.46 HG21 ' O ' ' A' ' 75' ' ' ILE . 40.6 t -64.71 -46.82 91.09 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.724 -173.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -57.11 -49.67 75.19 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.614 -1.175 . . . . 0.0 112.129 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.491 ' OE1' ' HB ' ' A' ' 26' ' ' ILE . 28.8 pt20 -74.29 -30.33 62.04 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.359 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.41 ' HB3' ' CG2' ' A' ' 37' ' ' THR . . . -75.18 -40.0 59.78 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 120.95 0.405 . . . . 0.0 111.095 -178.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.428 ' HB2' HE22 ' A' ' 93' ' ' GLN . 13.8 pt20 -72.92 -30.3 63.79 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.244 -177.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -75.91 -31.07 59.0 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.484 -179.147 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -75.66 -28.37 58.7 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.202 0.525 . . . . 0.0 111.62 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.444 ' HG ' HG23 ' A' ' 96' ' ' VAL . 4.4 mm? -84.6 -35.04 23.0 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.802 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -67.09 -32.22 73.23 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.13 0.491 . . . . 0.0 110.526 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -77.81 -11.04 59.85 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.875 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -89.24 -134.27 5.15 Favored Glycine 0 N--CA 1.424 -2.112 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -103.92 -49.78 3.55 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 120.756 0.312 . . . . 0.0 110.67 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -157.02 -148.18 5.01 Favored Glycine 0 N--CA 1.446 -0.637 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 100.53 -31.95 7.94 Favored Glycine 0 C--O 1.205 -1.663 0 CA-C-O 118.918 -0.934 . . . . 0.0 114.185 176.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.428 HE22 ' HB2' ' A' ' 83' ' ' GLN . 14.8 mm100 -48.95 -33.88 11.81 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -177.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -77.26 -37.17 53.6 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.039 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.551 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 29.2 pt20 -82.58 -44.46 15.81 Favored 'General case' 0 CA--C 1.497 -1.072 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.243 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.444 HG23 ' HG ' ' A' ' 86' ' ' LEU . 95.8 t -58.55 -23.84 23.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.805 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -49.84 -44.11 49.3 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.912 178.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 3.7 pt20 -66.4 -18.24 65.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.854 0.359 . . . . 0.0 111.777 -177.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.421 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 6.4 tpt -101.37 -48.69 4.28 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -176.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.6 p -64.97 -24.21 35.05 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 CA-C-O 120.969 0.414 . . . . 0.0 111.499 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.444 ' HG3' ' N ' ' A' ' 102' ' ' LYS . 27.8 pttt -64.27 -23.77 67.42 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.918 -0.489 . . . . 0.0 110.578 176.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.444 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 24.6 mtpp -64.52 -32.71 74.46 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.56 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -64.0 -37.27 86.79 Favored 'General case' 0 C--O 1.196 -1.758 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.148 176.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -68.18 -18.62 64.65 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.226 0.536 . . . . 0.0 110.704 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 29.8 mtm -91.79 -14.8 29.24 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.56 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.6 OUTLIER -52.68 -44.32 95.09 Favored Pre-proline 0 N--CA 1.475 0.794 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -177.368 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.434 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 18.2 Cg_endo -60.34 -24.0 76.22 Favored 'Trans proline' 0 C--N 1.368 1.594 0 CA-C-N 120.935 1.37 . . . . 0.0 112.862 176.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -89.24 -37.67 14.8 Favored 'General case' 0 N--CA 1.408 -2.564 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.138 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -76.88 -34.09 57.79 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 12.4 t -91.97 -2.81 56.56 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 66.3 56.09 0.82 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 122.42 1.105 . . . . 0.0 109.696 178.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 36.8 mt -101.48 157.1 17.06 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.102 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -78.47 39.83 0.35 Allowed 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.876 0.87 . . . . 0.0 112.979 -173.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 86.3 m -154.8 158.48 39.51 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 -174.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 24.0 p -147.01 141.23 26.2 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 43.1 mm . . . . . 0 C--N 1.313 -1.012 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -179.898 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.057 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 49.3 mtm180 -91.7 127.05 37.01 Favored 'General case' 0 CA--C 1.472 -2.035 0 C-N-CA 119.392 -0.923 . . . . 0.0 108.775 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 60.6 m -124.74 140.5 52.87 Favored 'General case' 0 C--N 1.27 -2.878 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 177.224 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.6 p -69.0 140.38 55.0 Favored 'General case' 0 N--CA 1.415 -2.214 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -84.86 69.13 10.71 Favored 'General case' 0 N--CA 1.421 -1.907 0 CA-C-O 121.602 0.715 . . . . 0.0 109.912 -175.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 t -148.5 171.79 15.53 Favored 'General case' 0 N--CA 1.417 -2.094 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 39.7 mm -128.45 118.21 20.17 Favored Pre-proline 0 C--N 1.303 -1.451 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -72.93 145.75 84.95 Favored 'Cis proline' 0 C--O 1.245 0.835 0 C-N-CA 123.877 -1.301 . . . . 0.0 112.668 1.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -77.66 136.86 15.72 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 122.401 2.067 . . . . 0.0 112.154 -178.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.471 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 42.9 mm -95.88 110.03 23.69 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.126 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 79.0 m -105.38 135.95 45.83 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -176.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -111.37 154.93 43.53 Favored Pre-proline 0 C--N 1.305 -1.363 0 C-N-CA 125.59 1.556 . . . . 0.0 108.801 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -47.78 -56.51 3.03 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.868 3.045 . . . . 0.0 113.335 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -159.42 -153.34 0.35 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 105.222 -2.14 . . . . 0.0 105.222 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -157.58 -65.41 0.01 OUTLIER Glycine 0 CA--C 1.474 -2.514 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -137.49 -61.86 0.63 Allowed 'General case' 0 N--CA 1.422 -1.872 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -146.78 107.55 4.13 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.07 178.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -136.38 115.09 10.69 Favored Pre-proline 0 C--N 1.301 -1.502 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -62.32 -42.79 26.24 Favored 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 121.964 1.776 . . . . 0.0 110.195 177.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.537 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 2.9 mpt_? -126.08 -50.86 1.55 Allowed 'General case' 0 CA--C 1.491 -1.314 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 172.13 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.43 65.77 1.06 Allowed Glycine 0 N--CA 1.407 -3.284 0 N-CA-C 108.643 -1.783 . . . . 0.0 108.643 -174.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 m -91.43 150.39 21.28 Favored 'General case' 0 C--N 1.272 -2.763 0 CA-C-N 114.439 -0.881 . . . . 0.0 109.907 176.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -107.39 98.91 8.48 Favored 'General case' 0 C--N 1.276 -2.599 0 CA-C-O 122.144 0.973 . . . . 0.0 110.05 178.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.469 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 3.3 mp -105.29 138.99 27.73 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.813 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.608 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 16.8 ptt180 -68.51 117.41 10.24 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-O 121.171 0.51 . . . . 0.0 110.734 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.474 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -64.06 -13.53 13.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -176.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -77.36 -20.12 55.26 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.953 -178.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.608 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 14.9 pt20 -86.68 -15.91 38.16 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 119.884 -0.726 . . . . 0.0 109.382 -178.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -98.69 1.77 46.49 Favored 'General case' 0 CA--C 1.483 -1.623 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.79 177.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.473 ' O ' ' HG2' ' A' ' 34' ' ' MET . 27.7 t-20 -56.18 -32.96 64.82 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.898 -178.248 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -71.98 -52.9 14.87 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -177.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.414 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -54.72 -53.73 51.12 Favored 'General case' 0 CA--C 1.516 -0.353 0 O-C-N 123.682 0.613 . . . . 0.0 109.863 177.717 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.444 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.5 tt0 -49.42 -58.45 5.12 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 123.88 0.872 . . . . 0.0 112.63 176.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.473 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 11.8 ptp -65.96 -43.02 89.15 Favored 'General case' 0 CA--C 1.498 -1.055 0 C-N-CA 119.95 -0.7 . . . . 0.0 111.72 -175.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.401 ' CG ' ' HD1' ' A' ' 55' ' ' HIS . 3.0 t-80 -67.7 -32.79 73.67 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 123.835 0.71 . . . . 0.0 110.825 -174.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 99' ' ' MET . 94.7 mt -78.46 -25.69 45.91 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-O 121.135 0.493 . . . . 0.0 111.171 178.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.469 HG23 HE21 ' A' ' 85' ' ' GLN . 68.0 p -91.69 -0.27 57.55 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.709 174.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.8 t -88.29 121.79 31.08 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.747 -175.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -128.34 94.85 3.99 Favored 'General case' 0 N--CA 1.419 -2.017 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 169.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -77.37 178.28 7.28 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.624 -177.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -102.19 -30.95 10.81 Favored 'General case' 0 C--N 1.279 -2.457 0 C-N-CA 123.59 0.756 . . . . 0.0 111.657 -173.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.82 14.28 17.82 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.988 -175.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.5 mt -60.03 103.22 0.2 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.929 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -120.49 -14.92 8.61 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.171 0.51 . . . . 0.0 110.161 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 94.9 mmm -133.83 31.2 3.65 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.31 23.27 12.24 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.599 -176.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 46.9 t -76.76 -61.38 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 178.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -148.99 110.81 4.55 Favored 'General case' 0 CA--C 1.496 -1.131 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 174.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.7 t-20 -149.76 133.55 8.79 Favored Pre-proline 0 C--N 1.288 -2.083 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 -174.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -53.25 -35.61 74.76 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.056 2.504 . . . . 0.0 112.188 178.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -68.11 -20.17 64.9 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -65.43 -26.38 67.94 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.136 178.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -78.05 5.3 10.24 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -178.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.481 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 4.5 pt20 -57.31 -37.34 72.31 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.21 0.604 . . . . 0.0 110.48 177.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.401 ' HD1' ' CG ' ' A' ' 35' ' ' HIS . 0.8 OUTLIER -66.59 -22.59 66.13 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.838 -178.154 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -74.3 -43.82 55.21 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 177.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.2 m -61.66 -26.7 68.18 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.172 0.511 . . . . 0.0 110.783 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 59.3 mt -84.45 -53.37 5.48 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.397 177.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.5 t -65.4 -48.03 74.25 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.11 0.964 . . . . 0.0 111.16 -175.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.519 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.7 t -59.4 -33.3 71.04 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 122.97 0.508 . . . . 0.0 110.53 177.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -81.45 -23.43 37.48 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.712 0.767 . . . . 0.0 110.373 -178.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -83.13 -40.02 20.32 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.326 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.519 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.9 pp -67.5 -32.57 73.47 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 121.229 0.538 . . . . 0.0 110.522 -178.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -71.73 -7.25 46.94 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.656 -179.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -78.44 -22.31 47.83 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.747 0.784 . . . . 0.0 109.15 175.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 7.3 t -82.15 163.95 2.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.224 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -50.79 144.02 8.97 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.06 0.544 . . . . 0.0 110.579 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -62.19 -31.02 71.49 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -174.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -79.27 -10.57 59.85 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.545 0.688 . . . . 0.0 109.94 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 59.8 m -108.44 -10.48 15.28 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.943 -176.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -59.3 -40.61 86.74 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 178.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.435 ' HA ' HG12 ' A' ' 75' ' ' ILE . 8.7 p -83.93 -23.76 31.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 120.024 -0.67 . . . . 0.0 112.625 177.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.03 -36.03 82.15 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.697 0.76 . . . . 0.0 109.534 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.403 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.05 -29.54 65.45 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.265 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.435 HG12 ' HA ' ' A' ' 72' ' ' CYS . 28.5 mm -67.39 -35.79 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.09 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.377 -177.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.487 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 14.3 mmmm -69.05 -41.78 77.16 Favored 'General case' 0 CA--C 1.489 -1.385 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 -176.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 6.7 mt-30 -59.58 -39.35 83.81 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 113.689 -1.596 . . . . 0.0 111.425 -177.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 74' ' ' ALA . 21.9 t -56.99 -44.6 82.96 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 O-C-N 123.743 0.652 . . . . 0.0 109.52 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 23.7 t -65.55 -48.55 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 CA-C-N 115.507 -0.769 . . . . 0.0 108.966 -176.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 43.1 mt-10 -55.71 -52.68 63.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.558 -1.201 . . . . 0.0 111.054 -177.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -71.29 -34.82 71.0 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -177.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.417 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -71.8 -37.64 70.36 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -177.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -76.95 -37.01 56.1 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.753 -179.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.412 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -69.38 -30.62 68.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.693 0.282 . . . . 0.0 111.309 -177.75 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.469 HE21 HG23 ' A' ' 37' ' ' THR . 24.4 pt20 -73.23 -31.47 64.16 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.141 0.496 . . . . 0.0 110.058 -177.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.444 ' HG ' HG22 ' A' ' 96' ' ' VAL . 4.1 mm? -82.7 -30.48 29.14 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.929 175.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -59.95 -40.1 87.86 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 123.36 0.664 . . . . 0.0 110.045 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -83.34 -5.75 59.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.701 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -94.58 -136.71 8.46 Favored Glycine 0 N--CA 1.418 -2.515 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.839 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -93.35 -19.02 21.74 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -175.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 148.17 -118.48 0.99 Allowed Glycine 0 CA--C 1.483 -1.924 0 N-CA-C 108.444 -1.863 . . . . 0.0 108.444 -175.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.56 -33.29 2.32 Favored Glycine 0 C--O 1.201 -1.93 0 CA-C-O 118.683 -1.065 . . . . 0.0 114.903 173.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -47.2 -33.08 4.97 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 -177.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -77.15 -37.0 54.83 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 120.797 0.332 . . . . 0.0 111.361 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.552 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 14.0 pt20 -85.59 -41.29 15.38 Favored 'General case' 0 C--O 1.212 -0.905 0 CA-C-O 121.452 0.644 . . . . 0.0 110.038 -177.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.444 HG22 ' HG ' ' A' ' 86' ' ' LEU . 73.2 t -62.32 -23.48 32.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 C-N-CA 124.9 1.28 . . . . 0.0 111.045 176.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -53.22 -37.32 61.94 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -177.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.552 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.6 pt20 -68.96 -18.6 64.1 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.89 0.376 . . . . 0.0 111.629 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.417 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 6.3 tpt -106.04 -45.13 4.42 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -174.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.72 -24.9 36.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.987 178.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -61.31 -22.97 65.37 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.862 -0.524 . . . . 0.0 111.173 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -67.58 -23.59 65.41 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 122.055 -0.403 . . . . 0.0 110.484 177.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.454 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -63.92 -34.92 79.05 Favored 'General case' 0 C--O 1.202 -1.429 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 174.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.471 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 44.7 mt-30 -75.39 -19.41 59.55 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.547 -179.095 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 48.2 mtt -86.92 -15.65 38.29 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.796 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.464 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 95.8 mt -52.37 -50.7 78.26 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -178.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 29.9 Cg_endo -62.96 -22.63 73.92 Favored 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 121.981 1.788 . . . . 0.0 112.524 178.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -83.72 -41.79 17.3 Favored 'General case' 0 N--CA 1.408 -2.546 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -176.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -81.41 -33.84 31.97 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.303 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 23.2 t -87.52 -1.51 57.98 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -178.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 53.34 60.22 3.87 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.146 1.378 . . . . 0.0 110.33 -179.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.428 ' C ' ' H ' ' A' ' 114' ' ' CYS . 79.5 mt -91.19 159.73 15.91 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-N 113.984 -1.462 . . . . 0.0 110.087 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -74.37 35.83 0.1 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.088 0.955 . . . . 0.0 112.221 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.428 ' H ' ' C ' ' A' ' 112' ' ' LEU . 57.3 m -157.62 149.27 21.95 Favored 'General case' 0 N--CA 1.417 -2.097 0 C-N-CA 125.702 1.601 . . . . 0.0 107.645 -175.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 4.5 p -134.59 131.96 38.48 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-O 120.99 0.424 . . . . 0.0 110.45 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.471 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 62.0 mt . . . . . 0 C--N 1.303 -1.451 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 178.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -1.001 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -75.23 149.6 38.84 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 61.8 m -127.89 148.19 50.48 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.7 p -68.29 154.99 40.65 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 176.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -92.04 71.41 5.49 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.713 0.768 . . . . 0.0 109.246 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.0 t -147.12 169.71 18.71 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.4 mp -128.82 114.72 19.09 Favored Pre-proline 0 C--N 1.31 -1.138 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -75.53 147.09 87.63 Favored 'Cis proline' 0 C--O 1.237 0.426 0 C-N-CA 124.075 -1.219 . . . . 0.0 111.816 0.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.414 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 59.1 Cg_endo -72.74 141.46 33.98 Favored 'Trans proline' 0 N--CA 1.446 -1.293 0 C-N-CA 122.118 1.878 . . . . 0.0 111.941 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.7 mm -92.03 113.1 26.77 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 177.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 84.4 m -104.28 133.8 48.57 Favored 'General case' 0 C--N 1.284 -2.241 0 CA-C-O 121.373 0.606 . . . . 0.0 111.798 -174.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -90.28 149.49 41.32 Favored Pre-proline 0 N--CA 1.413 -2.309 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.688 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -56.97 -31.15 88.9 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.887 2.391 . . . . 0.0 110.299 175.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -152.86 -67.4 0.16 Allowed 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 114.082 -1.417 . . . . 0.0 108.15 174.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 142.61 -35.67 1.7 Allowed Glycine 0 CA--C 1.482 -2.019 0 CA-C-N 114.428 -1.26 . . . . 0.0 110.532 -177.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.9 tp -147.3 -28.84 0.36 Allowed 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -175.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.466 ' HA ' ' NZ ' ' A' ' 76' ' ' LYS . 30.2 t70 -135.6 95.24 3.22 Favored 'General case' 0 C--N 1.296 -1.734 0 C-N-CA 119.408 -0.917 . . . . 0.0 113.137 -174.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -144.07 72.54 16.53 Favored Pre-proline 0 C--N 1.302 -1.493 0 CA-C-O 121.567 0.699 . . . . 0.0 112.124 174.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.453 ' HD2' ' NH1' ' A' ' 20' ' ' ARG . 83.9 Cg_endo -82.01 7.7 4.92 Favored 'Trans proline' 0 CA--C 1.534 0.484 0 C-N-CA 122.439 2.092 . . . . 0.0 111.641 176.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.453 ' NH1' ' HD2' ' A' ' 19' ' ' PRO . 2.6 mpt_? -91.64 -42.94 9.9 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 177.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -73.06 -47.04 25.8 Favored Glycine 0 N--CA 1.426 -2.028 0 CA-C-N 114.313 -1.312 . . . . 0.0 110.398 177.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 56.0 m -78.05 113.24 15.79 Favored 'General case' 0 N--CA 1.406 -2.63 0 CA-C-O 121.316 0.579 . . . . 0.0 110.69 176.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -96.68 102.43 14.21 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.967 0.889 . . . . 0.0 109.827 177.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.2 mp -109.91 138.53 37.13 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.262 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 178.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.479 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 39.8 ptt180 -79.03 122.19 25.88 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.536 -177.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.506 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.5 pp -62.7 -15.82 15.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -176.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -79.3 -15.89 57.24 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.927 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.1 pt20 -84.88 -27.93 26.35 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 119.265 -0.974 . . . . 0.0 108.531 178.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.409 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.6 mm? -87.31 1.74 52.32 Favored 'General case' 0 CA--C 1.481 -1.707 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.41 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.467 ' HA ' HE21 ' A' ' 33' ' ' GLN . 26.1 t-20 -53.26 -34.72 58.39 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.171 0.919 . . . . 0.0 110.591 -179.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -69.47 -53.41 19.34 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.855 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.8 OUTLIER -55.96 -51.69 66.8 Favored 'General case' 0 CA--C 1.503 -0.843 0 O-C-N 123.164 0.29 . . . . 0.0 110.309 178.442 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.467 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.7 tt0 -49.51 -55.74 12.27 Favored 'General case' 0 N--CA 1.426 -1.658 0 C-N-CA 123.667 0.787 . . . . 0.0 111.713 176.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.7 ptm -68.69 -38.09 80.05 Favored 'General case' 0 C--O 1.209 -1.028 0 C-N-CA 121.088 -0.245 . . . . 0.0 111.497 -176.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.855 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -70.89 -19.45 62.61 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.009 0.433 . . . . 0.0 111.158 -177.444 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 84.6 mt -88.5 -34.09 17.55 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.902 175.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 82.8 p -85.94 -21.04 28.11 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 119.344 -0.942 . . . . 0.0 111.211 -178.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -89.26 127.07 35.74 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.31 -178.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -102.74 109.4 20.98 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 171.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.401 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 4.7 t70 -68.35 165.83 17.88 Favored 'General case' 0 C--N 1.319 -0.728 0 O-C-N 123.454 0.471 . . . . 0.0 110.346 -173.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 31.6 p90 -102.54 -33.6 9.43 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.628 -169.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.36 5.53 17.14 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 119.678 -0.809 . . . . 0.0 111.596 -173.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.401 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 24.7 mt -76.13 80.08 2.95 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.222 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -107.08 -61.83 1.49 Allowed 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 173.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 16.3 mmt -105.65 -17.28 14.45 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 114.08 -1.418 . . . . 0.0 107.847 178.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.19 97.53 6.96 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.195 -1.366 . . . . 0.0 109.958 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 54.1 t -127.67 -73.14 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 179.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -101.74 107.19 18.33 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -160.66 149.06 13.12 Favored Pre-proline 0 C--N 1.308 -1.231 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 -176.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -48.86 -41.16 39.62 Favored 'Trans proline' 0 C--N 1.361 1.19 0 C-N-CA 123.223 2.615 . . . . 0.0 112.454 176.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -73.95 -11.14 60.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.885 0.374 . . . . 0.0 111.533 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -97.11 -15.31 21.02 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.541 179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -110.32 6.27 22.28 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.157 0.503 . . . . 0.0 110.138 178.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.534 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 3.7 pt20 -51.79 -39.76 59.2 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.059 -178.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.489 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 0.8 OUTLIER -66.37 -23.76 66.39 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 114.903 -1.044 . . . . 0.0 113.158 -176.152 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -75.31 -43.34 51.45 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.1 m -62.93 -25.71 68.46 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 123.658 0.599 . . . . 0.0 110.539 179.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 63.9 mt -84.83 -46.99 10.81 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.538 177.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -68.83 -50.63 48.41 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -176.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.509 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.2 t -58.27 -34.29 70.34 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 120.921 0.391 . . . . 0.0 110.169 178.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.411 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 9.7 t30 -76.22 -27.21 56.73 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.294 0.568 . . . . 0.0 111.506 -178.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -82.78 -41.81 18.71 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.796 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.509 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.6 pp -70.64 -33.59 71.15 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.026 -178.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.411 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 3.4 pt20 -70.23 -14.97 62.85 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -176.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -79.74 -13.12 59.68 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.514 177.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 18.5 t -77.45 163.68 3.75 Favored 'Isoleucine or valine' 0 C--O 1.254 1.338 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 174.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -48.38 142.44 5.66 Favored 'General case' 0 CA--C 1.508 -0.654 0 C-N-CA 123.566 0.746 . . . . 0.0 110.782 176.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -61.17 -29.13 69.61 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -173.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.477 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 12.1 pt20 -80.31 -22.15 41.85 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-O 121.487 0.66 . . . . 0.0 109.96 178.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.477 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.4 m -99.77 -8.32 24.38 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.051 -172.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 76.1 mt-30 -60.93 -41.62 96.56 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.197 0.522 . . . . 0.0 110.869 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.3 p -78.31 -23.79 46.93 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.637 176.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.404 ' HA ' ' OE2' ' A' ' 73' ' ' GLU . 33.5 mm-40 -69.85 -30.79 68.36 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.935 177.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.459 ' O ' HG21 ' A' ' 78' ' ' VAL . . . -62.7 -27.33 69.18 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.83 176.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.424 ' O ' HG22 ' A' ' 79' ' ' VAL . 28.3 mm -73.36 -24.61 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.052 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.466 ' NZ ' ' HA ' ' A' ' 17' ' ' ASP . 32.1 mmtp -74.49 -41.94 59.83 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 -176.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.46 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 64.7 mm-40 -56.12 -46.4 79.19 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 111.818 -2.446 . . . . 0.0 110.052 -179.38 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.459 HG21 ' O ' ' A' ' 74' ' ' ALA . 22.9 t -54.94 -46.05 76.32 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 O-C-N 124.204 0.94 . . . . 0.0 110.152 -179.172 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.424 HG22 ' O ' ' A' ' 75' ' ' ILE . 26.0 t -67.78 -47.87 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.748 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -175.157 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.76 -45.85 85.33 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.104 -1.407 . . . . 0.0 111.945 -176.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.506 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.7 pt20 -77.29 -35.24 55.25 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 111.448 0.166 . . . . 0.0 111.448 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.07 -38.87 72.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.884 0.373 . . . . 0.0 111.483 -177.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -72.35 -36.74 68.86 Favored 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.059 -178.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.418 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -73.19 -32.47 64.84 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.761 -0.375 . . . . 0.0 111.231 -176.971 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.418 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 2.2 pt20 -71.9 -28.96 63.85 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.745 -176.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.463 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.2 mm? -85.27 -33.79 22.08 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.208 174.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -59.69 -35.73 75.08 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.552 0.741 . . . . 0.0 111.251 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -73.14 -11.72 60.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.137 -178.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -92.79 -126.69 4.15 Favored Glycine 0 N--CA 1.427 -1.96 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.016 -177.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -107.56 -22.4 12.54 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 120.929 0.395 . . . . 0.0 110.588 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 165.91 -128.78 1.82 Allowed Glycine 0 N--CA 1.434 -1.446 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 91.12 -28.86 7.52 Favored Glycine 0 C--O 1.202 -1.848 0 CA-C-O 119.549 -0.584 . . . . 0.0 112.479 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -52.76 -34.38 52.83 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 123.97 0.908 . . . . 0.0 111.714 -176.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.44 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 8.7 pt20 -75.57 -37.2 60.09 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.579 -179.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.569 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 13.1 pt20 -82.59 -45.71 14.24 Favored 'General case' 0 CA--C 1.498 -1.047 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.033 -177.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.463 HG21 ' HG ' ' A' ' 86' ' ' LEU . 96.0 t -57.66 -23.2 19.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 124.376 1.07 . . . . 0.0 110.725 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.419 ' HA ' HG11 ' A' ' 100' ' ' VAL . 53.0 tt0 -50.73 -40.36 54.18 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.803 0.441 . . . . 0.0 111.78 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.2 pt20 -68.76 -18.36 64.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.633 -176.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.446 ' O ' HD22 ' A' ' 36' ' ' LEU . 8.1 tpt -102.44 -48.55 4.12 Favored 'General case' 0 CA--C 1.485 -1.546 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -177.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.419 HG11 ' HA ' ' A' ' 97' ' ' GLN . 14.3 p -60.37 -24.27 30.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.747 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.81 -24.86 64.5 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.851 -0.531 . . . . 0.0 111.688 174.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -64.46 -30.39 71.43 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 120.773 0.321 . . . . 0.0 110.188 177.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.494 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -62.8 -28.79 70.24 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-O 121.418 0.628 . . . . 0.0 109.989 177.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -73.58 -18.6 61.04 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.163 -178.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 42.3 mtt -92.11 -18.28 23.78 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.808 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.494 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.9 OUTLIER -48.18 -48.28 64.74 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 123.884 0.873 . . . . 0.0 113.121 -178.326 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.422 ' HG2' HG12 ' A' ' 116' ' ' ILE . 22.5 Cg_exo -61.35 -26.09 81.08 Favored 'Trans proline' 0 C--N 1.359 1.104 0 C-N-CA 121.533 1.488 . . . . 0.0 113.355 178.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -89.17 -37.44 15.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.812 177.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -74.68 -34.17 62.61 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 12.8 t -93.75 -2.7 53.38 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 64.1 t30 57.27 63.64 1.83 Allowed 'General case' 0 C--O 1.244 0.785 0 CA-C-O 123.01 1.386 . . . . 0.0 110.885 -179.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.7 mt -100.36 157.88 16.3 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 113.039 -1.891 . . . . 0.0 109.401 178.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -78.22 31.25 0.18 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.747 1.219 . . . . 0.0 112.944 -173.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 91.8 m -150.3 167.84 25.81 Favored 'General case' 0 C--N 1.269 -2.923 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -174.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 69.6 m -150.79 133.72 15.93 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 175.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.422 HG12 ' HG2' ' A' ' 107' ' ' PRO . 46.1 mm . . . . . 0 C--O 1.263 1.764 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -177.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.901 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.0 mmm180 -76.68 141.46 40.93 Favored 'General case' 0 CA--C 1.494 -1.193 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.9 m -137.33 150.87 48.05 Favored 'General case' 0 C--N 1.276 -2.61 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.6 p -69.27 155.4 40.48 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.291 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -87.75 73.61 9.27 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 175.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.2 t -150.04 167.23 27.36 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.9 mm -128.49 118.79 20.25 Favored Pre-proline 0 C--N 1.306 -1.311 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.76 147.63 89.91 Favored 'Cis proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.763 -1.349 . . . . 0.0 111.876 -1.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.28 136.08 25.94 Favored 'Trans proline' 0 C--O 1.247 0.94 0 C-N-CA 122.184 1.923 . . . . 0.0 112.063 -178.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.8 mm -96.15 124.01 48.65 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 178.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.1 m -109.82 141.21 42.81 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-O 121.579 0.704 . . . . 0.0 112.06 -175.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -107.15 158.47 32.93 Favored Pre-proline 0 C--N 1.298 -1.659 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.019 -177.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -82.81 54.5 4.86 Favored 'Trans proline' 0 C--O 1.248 1.007 0 C-N-CA 122.857 2.372 . . . . 0.0 109.253 174.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -143.39 153.56 42.82 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 114.071 -1.422 . . . . 0.0 107.291 -176.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 118.09 -82.68 0.33 Allowed Glycine 0 CA--C 1.468 -2.88 0 N-CA-C 107.931 -2.067 . . . . 0.0 107.931 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.0 pp -175.4 146.24 0.79 Allowed 'General case' 0 N--CA 1.423 -1.794 0 CA-C-N 114.822 -0.689 . . . . 0.0 109.35 175.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.599 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 5.6 p-10 -135.02 16.89 3.49 Favored 'General case' 0 C--N 1.281 -2.383 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 170.044 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.576 ' ND2' ' HA2' ' A' ' 21' ' ' GLY . 54.4 t30 -99.33 91.23 1.36 Allowed Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 113.645 -1.616 . . . . 0.0 107.012 176.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.599 ' HD3' ' O ' ' A' ' 17' ' ' ASP . 33.5 Cg_exo -58.17 -54.8 2.73 Favored 'Trans proline' 0 C--N 1.357 1.005 0 C-N-CA 123.89 3.06 . . . . 0.0 115.016 -171.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.509 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 5.4 mpt_? -85.8 -48.29 8.93 Favored 'General case' 0 CA--C 1.47 -2.114 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 -177.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.576 ' HA2' ' ND2' ' A' ' 18' ' ' ASN . . . 99.05 42.58 2.78 Favored Glycine 0 CA--C 1.458 -3.485 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -174.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.6 m -73.15 140.15 46.86 Favored 'General case' 0 N--CA 1.405 -2.68 0 CA-C-N 114.201 -1.0 . . . . 0.0 110.116 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -99.84 124.48 45.18 Favored 'General case' 0 N--CA 1.415 -2.193 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 173.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.1 mp -119.93 145.47 26.15 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -176.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.485 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 35.1 ptt180 -66.14 120.68 13.63 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-O 121.599 0.714 . . . . 0.0 110.06 -178.231 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.47 -14.99 19.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.261 0.553 . . . . 0.0 111.97 -175.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -75.53 -20.84 58.43 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.54 -177.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 6.8 pt20 -85.41 -34.95 21.59 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 119.334 -0.946 . . . . 0.0 109.828 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -79.54 -7.81 58.74 Favored 'General case' 0 CA--C 1.475 -1.921 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.21 -177.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.503 ' HA ' HE21 ' A' ' 33' ' ' GLN . 55.6 t30 -54.08 -33.82 58.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 124.246 0.966 . . . . 0.0 110.192 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -69.52 -57.63 4.98 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -56.1 -47.5 77.95 Favored 'General case' 0 C--O 1.215 -0.718 0 O-C-N 123.909 0.756 . . . . 0.0 110.392 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.503 HE21 ' HA ' ' A' ' 30' ' ' ASN . 6.8 tt0 -52.76 -57.95 8.45 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 124.316 1.046 . . . . 0.0 111.842 176.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -67.41 -38.24 84.33 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.818 -175.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 -74.0 -28.74 61.6 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.3 mt -78.53 -24.33 45.76 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 120.176 -0.609 . . . . 0.0 110.757 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 73.6 p -89.87 -12.77 38.04 Favored 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 118.734 -1.186 . . . . 0.0 111.25 176.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.6 t -88.71 144.9 25.96 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.403 178.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -120.59 129.23 53.67 Favored 'General case' 0 N--CA 1.438 -1.041 0 CA-C-O 121.247 0.546 . . . . 0.0 111.206 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.403 ' OD2' HD12 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -70.89 107.41 4.02 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 122.669 1.224 . . . . 0.0 112.885 178.946 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -105.16 -15.67 15.0 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 112.538 -2.119 . . . . 0.0 109.508 -177.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.81 13.76 3.66 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.581 -178.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.583 ' HB3' ' O ' ' A' ' 46' ' ' ALA . 90.6 mt -66.88 105.99 1.76 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.904 177.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -98.96 -68.27 0.81 Allowed 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.362 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 88.8 mtp -109.31 5.77 23.91 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.462 0.649 . . . . 0.0 110.068 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.583 ' O ' ' HB3' ' A' ' 43' ' ' LEU . . . -109.35 131.91 54.62 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.461 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 43.6 t -106.36 -51.0 8.0 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.994 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 171.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -131.93 139.35 48.68 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 104.939 -2.245 . . . . 0.0 104.939 172.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -158.97 143.54 11.47 Favored Pre-proline 0 C--N 1.303 -1.421 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -176.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -49.46 -38.13 43.14 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 123.835 3.023 . . . . 0.0 113.248 178.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -72.18 -12.11 61.03 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -177.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -81.91 -24.55 35.58 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -94.09 14.27 20.46 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.489 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.539 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 3.7 pt20 -52.5 -38.41 59.47 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.464 0.706 . . . . 0.0 110.17 177.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.422 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 0.8 OUTLIER -56.46 -29.59 61.87 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-N 114.702 -1.136 . . . . 0.0 112.523 -178.842 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -82.5 -42.36 18.54 Favored 'General case' 0 CA--C 1.49 -1.357 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.3 m -60.42 -31.09 70.07 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.399 0.619 . . . . 0.0 109.93 178.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 44.9 mt -81.8 -53.13 6.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.116 177.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 25.3 t -59.13 -49.72 76.78 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 123.443 0.697 . . . . 0.0 111.731 -177.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.527 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.0 t -58.55 -35.56 72.52 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.45 0.643 . . . . 0.0 110.419 179.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -82.05 -23.69 35.71 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.874 0.845 . . . . 0.0 110.762 -176.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -86.84 -38.63 16.62 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.7 179.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.527 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 4.1 pp -68.76 -32.33 72.01 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.11 0.481 . . . . 0.0 109.865 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.456 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 14.6 pt20 -68.61 -10.32 55.28 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.903 -178.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.42 -15.49 59.31 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.516 0.674 . . . . 0.0 109.223 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.6 t -86.49 163.37 2.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 174.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.506 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.6 mt-10 -49.38 143.05 6.88 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 122.938 0.495 . . . . 0.0 110.675 175.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -59.8 -32.46 70.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -175.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.499 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 27.8 pt20 -72.89 -24.01 60.79 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.612 0.72 . . . . 0.0 109.972 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.499 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.0 m -100.22 -9.14 22.75 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.047 -174.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.506 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 28.0 mt-30 -61.5 -39.17 90.0 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.894 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.0 p -83.55 -23.99 31.79 Favored 'General case' 0 CA--C 1.502 -0.874 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.692 177.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.597 ' OE1' ' HD2' ' A' ' 19' ' ' PRO . 7.0 mm-40 -66.03 -34.36 77.91 Favored 'General case' 0 C--O 1.248 1.024 0 CA-C-O 122.073 0.939 . . . . 0.0 108.763 178.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.21 -31.52 71.29 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.7 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.419 HD13 HD23 ' A' ' 63' ' ' LEU . 31.0 mm -69.62 -33.62 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.638 -176.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.526 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 30.7 mmtp -67.88 -41.15 83.22 Favored 'General case' 0 CA--C 1.487 -1.445 0 CA-C-N 115.234 -0.894 . . . . 0.0 108.871 -178.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.442 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 6.6 mt-30 -61.05 -36.37 79.41 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.161 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 23.6 t -57.8 -46.57 87.08 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.702 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 178.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 45.1 t -62.51 -45.49 98.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.359 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 35.6 mt-10 -57.87 -52.23 66.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.236 -177.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 3.5 pt20 -75.06 -31.95 61.4 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.102 -175.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.16 -37.34 58.07 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -177.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -73.85 -32.86 63.86 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.575 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.421 ' HD3' ' C ' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -75.95 -32.28 59.45 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.578 -175.913 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -71.83 -27.49 62.94 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.246 0.546 . . . . 0.0 110.261 -178.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.424 ' HG ' HG22 ' A' ' 96' ' ' VAL . 3.8 mm? -83.94 -35.11 24.26 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.988 174.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.45 ' HA ' ' NE2' ' A' ' 93' ' ' GLN . 29.6 tt0 -60.59 -33.5 72.83 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.515 0.726 . . . . 0.0 111.647 178.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -86.8 -1.55 57.86 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.258 0.551 . . . . 0.0 111.329 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -95.86 -144.83 17.72 Favored Glycine 0 N--CA 1.419 -2.434 0 CA-C-O 121.753 0.641 . . . . 0.0 113.023 -177.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -100.23 -41.28 7.16 Favored 'General case' 0 C--N 1.279 -2.458 0 CA-C-N 114.84 -0.68 . . . . 0.0 111.045 -174.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 179.69 -176.84 47.86 Favored Glycine 0 N--CA 1.418 -2.547 0 N-CA-C 108.919 -1.672 . . . . 0.0 108.919 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.438 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 119.66 -25.14 7.75 Favored Glycine 0 N--CA 1.408 -3.205 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.27 -177.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.45 ' NE2' ' HA ' ' A' ' 87' ' ' GLN . 19.4 mp0 -47.35 -40.3 17.02 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.931 0.892 . . . . 0.0 112.092 -178.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -77.11 -37.31 54.48 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.583 -176.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.653 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 4.1 pt20 -80.66 -43.52 20.29 Favored 'General case' 0 C--O 1.209 -1.065 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.147 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.424 HG22 ' HG ' ' A' ' 86' ' ' LEU . 69.0 t -61.06 -23.51 30.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 C-N-CA 124.594 1.158 . . . . 0.0 110.541 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -54.57 -37.62 65.69 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.873 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.653 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 30.0 pt20 -71.8 -18.35 62.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.866 0.365 . . . . 0.0 111.143 -178.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.2 tpt -96.78 -47.26 5.94 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 -176.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -62.45 -27.75 43.37 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.319 178.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.1 pptp? -63.85 -21.2 66.33 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.912 -0.492 . . . . 0.0 111.286 176.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -65.36 -28.82 69.55 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.383 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.43 -30.92 69.94 Favored 'General case' 0 C--O 1.207 -1.135 0 CA-C-O 121.186 0.517 . . . . 0.0 110.313 178.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.44 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 38.6 mt-30 -68.83 -19.31 64.26 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.253 0.549 . . . . 0.0 109.887 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 49.4 mtp -91.97 -19.94 21.89 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 7.0 mp -53.55 -47.5 96.2 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.59 -22.32 73.86 Favored 'Trans proline' 0 C--N 1.362 1.243 0 CA-C-N 120.74 1.3 . . . . 0.0 112.658 176.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -85.09 -49.5 8.21 Favored 'General case' 0 N--CA 1.411 -2.399 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -73.46 -38.92 65.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.062 -175.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.443 ' SG ' HD21 ' A' ' 112' ' ' LEU . 34.0 t -82.82 -0.83 49.78 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 63.12 40.71 8.75 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.886 1.274 . . . . 0.0 110.477 173.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.443 HD21 ' SG ' ' A' ' 110' ' ' CYS . 48.8 mt -80.97 159.55 24.87 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.314 -177.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -69.36 41.55 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 C-N-CA 125.062 1.345 . . . . 0.0 112.657 -176.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 56.7 m -158.06 146.13 18.67 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -176.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 40.1 m -134.03 119.25 18.74 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-O 121.062 0.458 . . . . 0.0 110.063 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.44 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 67.1 mt . . . . . 0 C--N 1.304 -1.404 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.11 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 44.3 mtp180 -95.96 131.95 41.79 Favored 'General case' 0 CA--C 1.492 -1.262 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 74.3 m -134.15 146.36 50.13 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 175.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.6 p -75.87 160.85 29.51 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 121.087 0.47 . . . . 0.0 110.357 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -91.29 66.33 5.56 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.8 t -152.44 172.35 16.65 Favored 'General case' 0 N--CA 1.421 -1.901 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -177.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.8 mm -128.35 118.29 20.31 Favored Pre-proline 0 C--N 1.313 -1.009 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 177.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.62 146.41 86.51 Favored 'Cis proline' 0 C--O 1.244 0.796 0 C-N-CA 123.817 -1.326 . . . . 0.0 111.608 0.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -68.45 126.82 14.71 Favored 'Trans proline' 0 N--CA 1.446 -1.304 0 C-N-CA 121.799 1.666 . . . . 0.0 110.126 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 46.4 mm -89.58 112.37 24.35 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.187 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -178.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 63.2 m -104.46 136.71 43.53 Favored 'General case' 0 C--N 1.287 -2.147 0 CA-C-O 121.581 0.705 . . . . 0.0 110.82 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.434 ' C ' ' H ' ' A' ' 14' ' ' ASP . 71.5 m-85 -93.16 159.13 36.08 Favored Pre-proline 0 C--N 1.287 -2.126 0 CA-C-N 114.401 -1.272 . . . . 0.0 110.321 -178.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -73.65 36.49 0.39 Allowed 'Trans proline' 0 N--CA 1.486 1.038 0 C-N-CA 123.555 2.837 . . . . 0.0 112.057 178.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.434 ' H ' ' C ' ' A' ' 12' ' ' PHE . 14.8 t70 -90.59 130.46 36.61 Favored 'General case' 0 N--CA 1.424 -1.767 0 C-N-CA 125.275 1.43 . . . . 0.0 110.015 -176.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 167.14 -53.11 0.24 Allowed Glycine 0 C--N 1.281 -2.489 0 N-CA-C 110.324 -1.111 . . . . 0.0 110.324 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.75 -60.39 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 179.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -156.45 155.86 32.79 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -161.25 87.03 1.66 Allowed Pre-proline 0 C--N 1.303 -1.413 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -173.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -65.99 -31.81 45.84 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 123.62 2.88 . . . . 0.0 116.572 -171.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.574 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 2.5 mpt_? -83.82 -34.03 24.77 Favored 'General case' 0 CA--C 1.473 -1.997 0 C-N-CA 119.172 -1.011 . . . . 0.0 109.802 -175.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.97 24.63 27.69 Favored Glycine 0 C--N 1.277 -2.712 0 CA-C-N 114.098 -1.41 . . . . 0.0 113.21 -178.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.1 m -60.92 124.58 20.9 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 123.827 0.369 . . . . 0.0 111.273 174.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -106.73 116.82 32.58 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.867 0.842 . . . . 0.0 109.727 177.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -120.49 132.58 69.71 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 -177.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.525 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 21.7 ptt180 -67.49 117.06 8.94 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 121.148 0.499 . . . . 0.0 111.484 -177.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.559 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.7 pp -61.98 -14.37 11.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -177.424 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -79.24 -17.33 54.97 Favored 'General case' 0 N--CA 1.423 -1.8 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.257 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.0 pt20 -79.98 -23.57 41.5 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.489 ' HB2' ' OE1' ' A' ' 81' ' ' GLN . 2.5 mm? -93.73 4.46 53.9 Favored 'General case' 0 CA--C 1.489 -1.381 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.048 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -55.02 -31.95 61.45 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 123.624 0.577 . . . . 0.0 111.595 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.416 ' O ' ' HB3' ' A' ' 35' ' ' HIS . 5.1 t60 -71.67 -53.11 14.63 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 107.84 -1.171 . . . . 0.0 107.84 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.503 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -55.86 -50.29 71.02 Favored 'General case' 0 C--N 1.314 -0.97 0 O-C-N 124.357 1.036 . . . . 0.0 109.188 -177.988 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -49.92 -58.26 5.79 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 125.148 1.379 . . . . 0.0 111.83 174.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.2 ptm -66.8 -37.88 85.41 Favored 'General case' 0 C--O 1.192 -1.972 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.03 -177.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.416 ' HB3' ' O ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -58.66 -33.87 70.58 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 123.555 0.742 . . . . 0.0 111.246 179.0 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 89.4 mt -81.48 -41.27 22.0 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.147 178.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 45.8 p -85.24 -21.33 29.13 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.108 -175.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.6 t -90.76 121.23 32.47 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.214 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -98.67 98.92 10.01 Favored 'General case' 0 C--N 1.282 -2.355 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 170.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.406 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 6.7 t70 -73.18 174.59 7.77 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.931 -1.032 . . . . 0.0 109.516 -176.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 28.2 p90 -95.31 -36.52 11.37 Favored 'General case' 0 C--N 1.282 -2.351 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -167.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.4 -0.27 32.15 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-O 121.621 0.724 . . . . 0.0 110.952 -175.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.406 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 47.3 mt -77.55 2.44 16.41 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.419 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.8 ptt180 -62.14 -13.95 32.25 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 124.375 1.07 . . . . 0.0 111.823 178.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 22.1 ptp -151.7 11.68 0.59 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.475 ' HA ' ' OD1' ' A' ' 49' ' ' ASN . . . -139.82 91.75 2.5 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.783 -170.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 45.2 t -130.11 -65.1 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 177.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -98.84 69.56 1.81 Allowed 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.774 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.475 ' OD1' ' HA ' ' A' ' 46' ' ' ALA . 11.2 m120 -130.37 150.48 76.34 Favored Pre-proline 0 C--N 1.303 -1.454 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -49.78 -50.77 12.29 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 123.453 2.769 . . . . 0.0 114.312 -176.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -80.02 -8.54 59.42 Favored 'General case' 0 CA--C 1.5 -0.947 0 C-N-CA 120.44 -0.504 . . . . 0.0 112.05 -176.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -84.94 -24.87 28.19 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 176.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -69.45 -4.69 19.7 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.252 -179.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.627 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 11.1 pt20 -49.89 -41.18 45.11 Favored 'General case' 0 C--O 1.199 -1.558 0 C-N-CA 123.942 0.897 . . . . 0.0 110.844 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.436 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 0.7 OUTLIER -61.17 -30.19 70.25 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.405 0.621 . . . . 0.0 112.431 -177.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -86.21 -40.11 15.92 Favored 'General case' 0 CA--C 1.496 -1.111 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 -179.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 t -59.27 -24.0 62.86 Favored 'General case' 0 C--O 1.209 -1.054 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.693 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 88.6 mt -87.63 -56.04 3.52 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.769 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 27.4 t -57.88 -51.75 68.32 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.454 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 11.0 t -59.31 -33.42 71.08 Favored 'General case' 0 N--CA 1.428 -1.542 0 C-N-CA 124.197 0.999 . . . . 0.0 110.748 178.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.472 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 2.8 t-20 -81.25 -23.19 38.18 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.129 -176.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 21.2 tp60 -80.06 -46.38 16.65 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.28 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.544 ' O ' ' HG2' ' A' ' 71' ' ' GLN . 3.6 pp -69.14 -35.44 76.37 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.291 -175.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.453 ' NE2' HD21 ' A' ' 61' ' ' ASN . 11.1 pt20 -68.88 -17.38 63.97 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 122.991 0.516 . . . . 0.0 111.735 -175.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 63.6 mm-40 -83.61 -13.31 54.61 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 121.377 0.608 . . . . 0.0 109.713 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.3 t -79.63 162.68 3.77 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -50.52 141.59 12.06 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 123.492 0.717 . . . . 0.0 110.98 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.409 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 18.8 ptpt -57.83 -31.77 66.96 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -174.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.429 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 4.1 pt20 -82.11 -12.71 58.05 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.26 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.429 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 42.7 m -110.75 -12.6 14.28 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.584 -174.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.544 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 67.4 mt-30 -56.28 -46.47 79.73 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.434 0.694 . . . . 0.0 110.796 176.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.0 p -75.09 -23.86 58.05 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.324 0.583 . . . . 0.0 111.468 178.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -73.98 -29.52 62.02 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.402 0.62 . . . . 0.0 110.287 177.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.464 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -64.24 -23.13 67.2 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.586 176.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.482 ' O ' HG23 ' A' ' 79' ' ' VAL . 35.2 mm -72.87 -27.75 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.362 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -73.03 -41.0 64.67 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 -175.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.462 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 12.1 mm100 -56.6 -47.95 78.49 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 111.676 -2.511 . . . . 0.0 110.133 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.464 HG22 ' O ' ' A' ' 74' ' ' ALA . 20.0 t -56.23 -44.59 79.8 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 O-C-N 124.03 0.832 . . . . 0.0 109.771 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 75' ' ' ILE . 31.0 t -68.09 -42.34 85.01 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.686 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -174.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -61.95 -53.0 61.7 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.597 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.559 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.7 pt20 -71.55 -31.05 66.58 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.791 0.329 . . . . 0.0 111.852 -176.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.2 -40.97 64.32 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.881 -0.327 . . . . 0.0 110.954 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -70.55 -41.38 72.56 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.154 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.51 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -65.33 -35.99 82.67 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.299 -176.168 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.51 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 17.4 pt20 -71.94 -33.6 68.35 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.604 -174.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.437 HD13 ' HA3' ' A' ' 92' ' ' GLY . 2.7 mm? -84.46 -39.29 19.1 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.391 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -57.48 -41.28 80.37 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 123.804 0.842 . . . . 0.0 111.06 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 84' ' ' LYS . 4.2 pt20 -90.98 -8.67 48.55 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.322 0.582 . . . . 0.0 110.737 -178.081 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -89.9 -78.88 1.34 Allowed Glycine 0 N--CA 1.426 -1.996 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.846 -176.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -132.76 -12.54 2.96 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.74 -106.79 1.42 Allowed Glycine 0 C--N 1.285 -2.254 0 N-CA-C 106.865 -2.494 . . . . 0.0 106.865 -173.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.437 ' HA3' HD13 ' A' ' 86' ' ' LEU . . . 77.26 -37.29 1.55 Allowed Glycine 0 C--O 1.185 -2.908 0 CA-C-O 119.039 -0.867 . . . . 0.0 115.04 172.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 14.0 mm100 -52.29 -21.06 3.12 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -175.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -79.2 -39.72 32.56 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.084 0.469 . . . . 0.0 110.877 174.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -86.0 -38.95 17.37 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 121.625 0.726 . . . . 0.0 110.217 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 72.2 t -69.71 -22.52 25.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.207 0 C-N-CA 125.631 1.572 . . . . 0.0 110.633 176.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.415 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 53.6 tt0 -45.91 -44.75 14.89 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -59.87 -28.13 67.27 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 123.069 0.548 . . . . 0.0 112.04 178.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.406 ' O ' HD22 ' A' ' 36' ' ' LEU . 5.2 tpt -96.59 -48.08 5.67 Favored 'General case' 0 CA--C 1.494 -1.206 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -174.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.2 p -60.38 -27.98 41.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.603 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -25.16 68.18 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.958 -0.464 . . . . 0.0 111.265 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -64.54 -25.58 68.04 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 122.661 0.384 . . . . 0.0 110.855 177.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.432 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -60.36 -36.26 77.59 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-O 121.495 0.664 . . . . 0.0 110.032 176.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -73.24 -16.51 61.4 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.74 0.781 . . . . 0.0 110.297 -177.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 54.3 mtp -92.67 -15.85 26.27 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.978 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.451 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 92.6 mt -55.1 -47.07 99.4 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.927 -177.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 12.3 Cg_endo -58.78 -22.28 60.95 Favored 'Trans proline' 0 C--N 1.366 1.497 0 C-N-CA 121.759 1.639 . . . . 0.0 113.127 175.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -84.82 -47.83 9.98 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -68.49 -47.41 67.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.1 -176.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 97.8 m -81.3 2.05 29.83 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 47.9 t30 53.58 64.48 1.83 Allowed 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 122.97 1.367 . . . . 0.0 110.697 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.9 mt -98.59 158.19 15.76 Favored 'General case' 0 C--N 1.275 -2.673 0 CA-C-N 113.396 -1.729 . . . . 0.0 108.659 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -81.08 45.1 0.81 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.814 0.816 . . . . 0.0 111.068 -175.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 57.2 m -160.88 155.3 23.3 Favored 'General case' 0 C--N 1.285 -2.226 0 C-N-CA 125.722 1.609 . . . . 0.0 106.712 -176.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 41.5 m -150.32 136.76 18.88 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 38.0 mm . . . . . 0 C--N 1.309 -1.158 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.001 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.488 -1.63 0 N-CA-C 110.705 -0.958 . . . . 0.0 110.705 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.7 mmm180 -94.63 139.87 30.63 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 -178.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 58.1 m -116.47 150.75 37.35 Favored 'General case' 0 C--N 1.277 -2.582 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.607 -176.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.6 p -82.53 166.1 19.57 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.781 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -90.55 76.98 6.51 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 175.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t -152.67 163.95 38.67 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.1 mm -128.79 115.91 19.26 Favored Pre-proline 0 C--N 1.305 -1.334 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 176.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.59 147.18 88.98 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.869 -1.305 . . . . 0.0 111.692 -1.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.85 140.16 45.46 Favored 'Trans proline' 0 C--O 1.247 0.959 0 C-N-CA 122.661 2.241 . . . . 0.0 111.789 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.3 mm -95.32 116.99 38.22 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 65.8 m -104.85 131.3 52.5 Favored 'General case' 0 C--N 1.284 -2.281 0 CA-C-O 121.462 0.649 . . . . 0.0 110.893 -177.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -98.53 142.03 23.92 Favored Pre-proline 0 N--CA 1.426 -1.666 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.477 -178.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.9 -17.51 36.87 Favored 'Trans proline' 0 C--O 1.242 0.708 0 C-N-CA 123.359 2.706 . . . . 0.0 114.79 -175.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -158.36 162.25 37.64 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 -177.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.39 66.06 0.59 Allowed Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 121.569 -0.348 . . . . 0.0 113.026 176.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.413 HD12 ' N ' ' A' ' 17' ' ' ASP . 1.8 pp -99.69 -16.61 18.11 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.723 0.773 . . . . 0.0 110.83 177.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.413 ' N ' HD12 ' A' ' 16' ' ' LEU . 27.4 t70 -100.99 103.74 14.89 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.807 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -124.4 104.33 31.63 Favored Pre-proline 0 C--N 1.292 -1.906 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -178.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.448 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . 53.1 Cg_exo -56.56 -41.02 80.37 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 123.034 2.49 . . . . 0.0 112.342 -178.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.516 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 2.1 mpt_? -123.04 -49.32 1.96 Allowed 'General case' 0 CA--C 1.496 -1.112 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 175.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 90.29 48.95 3.38 Favored Glycine 0 CA--C 1.468 -2.901 0 N-CA-C 109.013 -1.635 . . . . 0.0 109.013 -176.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 86.3 m -75.98 138.87 41.22 Favored 'General case' 0 C--N 1.279 -2.468 0 CA-C-N 114.159 -1.02 . . . . 0.0 110.088 179.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -101.83 102.95 13.62 Favored 'General case' 0 N--CA 1.423 -1.81 0 CA-C-O 122.269 1.033 . . . . 0.0 109.2 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.479 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 3.1 mp -102.08 144.16 13.75 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.568 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -178.074 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.43 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.8 ptt180 -70.58 115.28 9.57 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.161 0.505 . . . . 0.0 110.736 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.404 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -65.64 -10.9 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -78.08 -21.02 51.16 Favored 'General case' 0 N--CA 1.427 -1.609 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.098 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.0 OUTLIER -82.06 -26.54 33.63 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 119.492 -0.883 . . . . 0.0 108.813 -179.98 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.442 ' HB3' HG21 ' A' ' 78' ' ' VAL . 2.4 mm? -86.58 -1.7 57.87 Favored 'General case' 0 CA--C 1.487 -1.474 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.152 -178.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.569 ' O ' ' HG2' ' A' ' 34' ' ' MET . 8.2 t30 -51.65 -32.65 30.19 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 124.265 0.978 . . . . 0.0 111.692 179.791 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -70.31 -56.42 6.78 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.444 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -53.84 -53.28 54.67 Favored 'General case' 0 CA--C 1.507 -0.709 0 O-C-N 123.918 0.761 . . . . 0.0 110.052 178.717 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -47.88 -56.14 8.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.201 1.001 . . . . 0.0 112.283 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.569 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 14.3 ptp -70.66 -44.11 67.78 Favored 'General case' 0 C--O 1.202 -1.402 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.261 -176.11 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -68.28 -22.88 64.71 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -178.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 89.0 mt -81.7 -34.24 30.74 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.663 174.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 62.0 p -84.2 -22.16 31.0 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 117.84 -1.544 . . . . 0.0 112.212 179.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.6 p -90.69 145.95 24.41 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-O 121.735 0.779 . . . . 0.0 112.559 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -122.12 124.49 44.02 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 104.645 -2.354 . . . . 0.0 104.645 169.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.441 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 6.9 t0 -78.46 160.54 27.65 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.912 -174.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -95.08 -31.79 13.41 Favored 'General case' 0 C--N 1.27 -2.872 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.772 -167.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.5 6.35 38.22 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 118.911 -1.116 . . . . 0.0 111.462 -175.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.441 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 56.2 mt -72.23 84.9 1.05 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.408 177.206 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 82.5 mtp180 -119.7 -22.53 6.84 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 121.22 0.533 . . . . 0.0 109.683 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.4 mmm -117.23 15.68 14.89 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.497 ' HA ' ' CG ' ' A' ' 49' ' ' ASN . . . -137.27 28.03 2.82 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.523 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 59.5 t -56.24 -46.34 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 O-C-N 123.934 0.771 . . . . 0.0 109.029 -178.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -133.39 102.08 5.4 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 169.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.497 ' CG ' ' HA ' ' A' ' 46' ' ' ALA . 0.7 OUTLIER -139.39 151.83 67.83 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.101 -175.746 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.518 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 58.5 Cg_endo -69.6 -15.44 37.69 Favored 'Trans proline' 0 N--CA 1.476 0.487 0 C-N-CA 122.891 2.394 . . . . 0.0 111.019 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -68.49 -15.76 63.65 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.162 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -66.01 -25.74 67.21 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' A' ' 50' ' ' PRO . 11.3 pt20 -80.45 8.8 6.92 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 120.466 -0.494 . . . . 0.0 111.556 -178.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.496 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 25.5 pt20 -51.15 -46.1 61.9 Favored 'General case' 0 C--O 1.245 0.818 0 C-N-CA 124.34 1.056 . . . . 0.0 111.273 178.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.465 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.6 p-80 -72.3 -21.64 61.31 Favored 'General case' 0 N--CA 1.426 -1.627 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.561 -176.031 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -80.22 -42.69 22.79 Favored 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.3 m -59.82 -27.23 66.43 Favored 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.732 0.645 . . . . 0.0 110.718 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 47.0 mt -88.15 -51.17 5.93 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.775 176.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.7 t -59.72 -48.14 82.85 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.429 0.692 . . . . 0.0 111.895 -177.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.511 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 42.1 t -57.86 -35.94 71.65 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.269 0.557 . . . . 0.0 110.091 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.54 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 4.1 t-20 -76.56 -25.67 54.29 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.16 -176.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -85.57 -44.9 12.26 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.954 178.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.511 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.7 pp -66.26 -31.9 73.0 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.365 0.603 . . . . 0.0 110.24 -177.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.54 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 3.3 pt20 -71.97 -9.24 58.08 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.684 -178.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -78.29 -15.91 58.28 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.416 0.627 . . . . 0.0 109.819 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.0 t -84.05 161.61 3.22 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 174.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 33.7 mt-10 -49.31 142.2 7.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.287 0.635 . . . . 0.0 111.306 177.095 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.454 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 15.5 ptpt -56.38 -33.42 65.72 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -174.06 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.476 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.8 pt20 -77.57 -22.81 50.38 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 121.758 0.79 . . . . 0.0 110.176 -179.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.476 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 66.3 m -98.57 -13.15 20.56 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.672 -173.142 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 76.8 mt-30 -57.04 -40.69 77.25 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 123.234 0.614 . . . . 0.0 111.802 178.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 20.4 p -83.47 -24.06 31.95 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 119.409 -0.917 . . . . 0.0 111.981 179.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -64.92 -36.8 85.55 Favored 'General case' 0 CA--C 1.553 1.091 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 177.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.412 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.12 -31.79 67.52 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.093 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 28.2 mm -69.91 -32.6 52.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.322 -176.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 14.6 mmmm -68.92 -41.07 78.66 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 -178.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.479 ' NE2' ' HB ' ' A' ' 24' ' ' ILE . 5.9 mt-30 -61.01 -37.87 84.07 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 113.598 -1.637 . . . . 0.0 110.639 -179.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.442 HG21 ' HB3' ' A' ' 29' ' ' LEU . 40.3 t -55.91 -46.85 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 123.94 0.775 . . . . 0.0 109.233 178.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 38.4 t -62.95 -46.08 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.357 -175.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 38.6 mt-10 -56.88 -52.3 65.7 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.307 -178.093 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -73.33 -32.12 64.38 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.816 -176.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.35 -39.69 71.14 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.045 -179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -72.56 -41.08 66.15 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.545 -179.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -27.92 68.04 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 120.841 0.353 . . . . 0.0 111.62 -176.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.424 ' HA ' ' NE2' ' A' ' 88' ' ' GLN . 17.1 pt20 -77.67 -30.33 51.95 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.824 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.482 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.2 mm? -87.04 -41.64 13.7 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.165 0.507 . . . . 0.0 111.982 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -58.66 -32.13 68.81 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.727 1.211 . . . . 0.0 112.412 -177.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.424 ' NE2' ' HA ' ' A' ' 85' ' ' GLN . 11.4 pt20 -73.72 -9.48 58.7 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -174.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -154.86 -73.6 0.01 OUTLIER Glycine 0 C--N 1.304 -1.206 0 C-N-CA 118.649 -1.738 . . . . 0.0 113.975 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -61.18 -43.03 99.52 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -175.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.482 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 101.49 -106.1 2.98 Favored Glycine 0 CA--C 1.473 -2.54 0 N-CA-C 105.728 -2.949 . . . . 0.0 105.728 -170.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.61 -24.94 1.44 Allowed Glycine 0 C--O 1.186 -2.892 0 N-CA-C 115.555 0.982 . . . . 0.0 115.555 169.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -58.61 -21.6 53.97 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 118.887 1.344 . . . . 0.0 113.719 -174.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -77.65 -38.11 48.49 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.503 174.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -85.19 -43.0 14.2 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 122.025 0.917 . . . . 0.0 109.38 -178.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 72.1 t -63.2 -22.71 31.42 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 C-N-CA 125.821 1.648 . . . . 0.0 110.146 177.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -45.14 -47.45 12.26 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.436 0.694 . . . . 0.0 112.527 -179.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -69.32 -17.6 63.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.041 -177.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 4.9 tpt -100.14 -45.45 5.64 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -178.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.7 p -66.55 -25.85 36.07 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.186 179.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.88 -26.26 67.28 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 122.025 -0.422 . . . . 0.0 111.395 175.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -63.0 -31.9 73.14 Favored 'General case' 0 C--O 1.208 -1.08 0 C-N-CA 122.802 0.441 . . . . 0.0 110.015 178.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.58 -31.81 71.88 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-O 121.147 0.499 . . . . 0.0 110.486 178.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -72.62 -20.91 61.2 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.728 0.775 . . . . 0.0 109.629 -179.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' MET . . . . . 0.444 ' O ' ' HB2' ' A' ' 108' ' ' ASN . 48.2 mtp -92.4 -17.3 24.8 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.563 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.43 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 3.6 mp -53.17 -46.52 97.75 Favored Pre-proline 0 N--CA 1.471 0.603 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 16.3 Cg_endo -60.94 -22.31 74.01 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 121.216 1.278 . . . . 0.0 112.577 176.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 105' ' ' MET . 16.0 m120 -84.71 -49.42 8.51 Favored 'General case' 0 N--CA 1.415 -2.196 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -74.2 -33.3 63.36 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.757 -174.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . 0.487 ' SG ' HD22 ' A' ' 112' ' ' LEU . 34.8 t -89.32 -6.98 56.25 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 60.0 64.33 1.29 Allowed 'General case' 0 C--O 1.241 0.633 0 CA-C-O 123.499 1.619 . . . . 0.0 110.653 -178.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.487 HD22 ' SG ' ' A' ' 110' ' ' CYS . 40.4 mt -101.83 159.24 15.51 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 112.412 -2.176 . . . . 0.0 109.555 178.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -74.32 45.28 0.22 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.092 0.957 . . . . 0.0 111.952 -175.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 56.0 m -162.12 164.49 27.97 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 124.046 0.938 . . . . 0.0 109.297 -175.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 55.0 m -150.64 123.74 8.8 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 66.4 mt . . . . . 0 C--N 1.311 -1.085 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -178.329 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.52 0 N-CA-C 109.195 -1.562 . . . . 0.0 109.195 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 49.7 mtm105 -76.79 127.63 33.11 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 117.698 0.749 . . . . 0.0 109.738 179.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 64.5 m -136.48 144.97 44.64 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.209 -175.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.1 p -73.48 148.25 43.34 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -87.75 79.47 8.18 Favored 'General case' 0 N--CA 1.42 -1.93 0 CA-C-O 121.799 0.809 . . . . 0.0 108.876 177.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.4 p -140.98 164.91 28.99 Favored 'General case' 0 N--CA 1.417 -2.108 0 CA-C-N 113.984 -1.462 . . . . 0.0 107.99 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 34.1 mm -128.72 110.93 18.89 Favored Pre-proline 0 C--N 1.3 -1.578 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -73.06 151.49 97.14 Favored 'Cis proline' 0 C--O 1.248 1.004 0 C-N-CA 124.341 -1.108 . . . . 0.0 112.192 -0.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -74.02 156.98 47.3 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.258 1.972 . . . . 0.0 111.998 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.7 mm -114.65 117.2 54.87 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 N-CA-C 107.03 -1.471 . . . . 0.0 107.03 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 85.8 m -106.59 145.15 32.26 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-O 121.826 0.822 . . . . 0.0 111.879 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -98.89 152.09 37.67 Favored Pre-proline 0 N--CA 1.416 -2.151 0 CA-C-N 114.0 -1.455 . . . . 0.0 110.155 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.38 45.32 1.55 Allowed 'Trans proline' 0 C--O 1.247 0.949 0 C-N-CA 123.139 2.559 . . . . 0.0 111.541 179.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -153.52 132.57 12.56 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.972 -178.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -161.09 -119.66 0.52 Allowed Glycine 0 N--CA 1.425 -2.034 0 N-CA-C 109.273 -1.531 . . . . 0.0 109.273 177.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -151.4 -52.48 0.13 Allowed 'General case' 0 C--N 1.296 -1.731 0 CA-C-O 121.222 0.534 . . . . 0.0 110.937 177.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -95.86 17.13 15.86 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-O 121.788 0.804 . . . . 0.0 110.199 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -130.01 121.45 19.8 Favored Pre-proline 0 C--N 1.295 -1.772 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.767 -178.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -57.03 -48.01 20.24 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.692 2.261 . . . . 0.0 110.421 174.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.487 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 1.7 mpt_? -109.21 -59.16 1.93 Allowed 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 107.996 -1.112 . . . . 0.0 107.996 174.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.45 58.25 0.96 Allowed Glycine 0 CA--C 1.466 -2.983 0 N-CA-C 108.739 -1.744 . . . . 0.0 108.739 -173.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.1 m -83.31 134.69 34.91 Favored 'General case' 0 N--CA 1.404 -2.736 0 CA-C-N 114.362 -0.919 . . . . 0.0 112.08 -177.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.461 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 3.3 pt20 -101.12 101.05 11.7 Favored 'General case' 0 N--CA 1.416 -2.143 0 CA-C-O 122.443 1.116 . . . . 0.0 110.276 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.426 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 2.4 mp -115.08 132.37 64.54 Favored 'Isoleucine or valine' 0 C--N 1.261 -3.241 0 N-CA-C 105.628 -1.99 . . . . 0.0 105.628 176.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.521 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.6 ptt180 -68.55 118.13 11.18 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -65.67 -16.42 20.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.226 0.536 . . . . 0.0 111.926 -176.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -74.87 -16.52 60.67 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.254 -178.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 7.0 pt20 -89.18 -19.63 25.22 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.277 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.88 -0.23 57.44 Favored 'General case' 0 CA--C 1.477 -1.859 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.743 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.411 ' O ' ' HG2' ' A' ' 34' ' ' MET . 7.8 t30 -50.38 -37.66 38.49 Favored 'General case' 0 C--O 1.218 -0.598 0 O-C-N 124.413 1.071 . . . . 0.0 111.146 178.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -66.81 -52.98 37.43 Favored 'General case' 0 C--O 1.215 -0.747 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.843 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.7 OUTLIER -58.28 -51.94 67.68 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 123.274 0.359 . . . . 0.0 110.639 179.523 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -50.05 -52.34 35.2 Favored 'General case' 0 N--CA 1.434 -1.233 0 C-N-CA 124.162 0.985 . . . . 0.0 111.608 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.411 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.1 ptm -71.71 -41.05 69.06 Favored 'General case' 0 C--O 1.211 -0.946 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.521 -177.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.843 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 1.4 p80 -68.16 -24.68 65.0 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.995 0.426 . . . . 0.0 111.954 -176.228 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 99' ' ' MET . 95.2 mt -83.39 -40.61 19.15 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.81 176.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.428 HG23 HG13 ' A' ' 96' ' ' VAL . 58.5 p -83.7 -21.0 32.49 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 118.947 -1.101 . . . . 0.0 112.929 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.6 m -90.66 121.54 32.66 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -100.94 97.91 8.44 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 169.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.421 ' HB3' ' CD1' ' A' ' 43' ' ' LEU . 8.0 t70 -80.78 174.31 11.74 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.843 -170.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 43.7 p90 -98.15 -37.84 9.55 Favored 'General case' 0 C--N 1.29 -2.022 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -167.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.74 2.19 43.17 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 119.446 -0.901 . . . . 0.0 111.043 -174.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.421 ' CD1' ' HB3' ' A' ' 40' ' ' ASP . 54.2 mt -81.12 86.67 6.13 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.773 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 37.9 ptt180 -110.36 -32.95 6.77 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.194 178.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 66.1 mtt -109.47 27.52 9.46 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -141.08 87.13 2.07 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.572 -1.195 . . . . 0.0 109.918 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 45.2 t -132.33 -57.78 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 177.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -136.58 87.12 2.27 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 104.718 -2.327 . . . . 0.0 104.718 172.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -153.12 164.27 20.92 Favored Pre-proline 0 C--N 1.299 -1.619 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 -172.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.89 -24.22 37.91 Favored 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 123.116 2.544 . . . . 0.0 111.6 174.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.554 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 31.3 mmmt -71.07 -10.97 60.66 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.831 178.758 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -88.92 -10.93 46.01 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 122.069 0.938 . . . . 0.0 108.929 176.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -93.93 -10.08 34.96 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.19 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.56 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 4.0 pt20 -60.39 -48.33 82.22 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.347 0.594 . . . . 0.0 110.502 -176.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -74.78 -20.26 59.87 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.05 -179.33 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -72.88 -45.45 58.2 Favored 'General case' 0 C--O 1.214 -0.796 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 174.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.2 m -58.05 -26.89 63.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 122.876 0.471 . . . . 0.0 111.282 177.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 59.3 mt -81.71 -56.39 4.03 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.319 175.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.9 t -62.37 -48.52 79.4 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.2 0.6 . . . . 0.0 112.408 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.541 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.0 t -59.03 -32.27 69.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.444 0.698 . . . . 0.0 110.117 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.432 ' O ' ' HG2' ' A' ' 64' ' ' GLN . 8.1 t30 -76.88 -41.32 44.31 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.89 0.852 . . . . 0.0 110.322 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -65.13 -36.44 84.26 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.12 -179.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.541 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.6 pp -80.21 -33.24 38.29 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.161 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 4.0 pt20 -68.68 -23.11 64.35 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -174.706 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.93 -22.85 63.15 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.227 0.537 . . . . 0.0 110.053 176.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.8 t -74.66 158.16 5.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 177.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 1.3 mp0 -42.69 140.67 1.23 Allowed 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 125.03 1.332 . . . . 0.0 111.818 177.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -58.82 -32.97 69.87 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -173.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.579 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.5 pt20 -81.62 -11.8 58.97 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.579 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.3 m -112.5 -8.23 13.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.891 -172.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 99.1 mt-30 -60.64 -43.37 97.63 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.776 0.798 . . . . 0.0 109.819 177.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 2.9 p -77.71 -25.24 49.2 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.144 179.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -73.62 -29.27 62.26 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.08 179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.528 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.03 -32.92 70.17 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.497 176.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 22.5 mm -70.22 -32.15 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.926 -176.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -70.16 -40.52 74.67 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 -175.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.459 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 7.2 mt-30 -64.04 -36.86 85.37 Favored 'General case' 0 CA--C 1.497 -1.071 0 CA-C-N 113.681 -1.599 . . . . 0.0 109.968 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.528 HG23 ' O ' ' A' ' 74' ' ' ALA . 43.7 t -56.73 -46.86 83.24 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.812 0 O-C-N 124.649 1.218 . . . . 0.0 108.569 178.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 41.2 t -64.29 -46.77 92.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.275 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -57.91 -50.33 73.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.942 -178.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.459 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -73.89 -28.3 61.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.94 0.4 . . . . 0.0 111.635 -178.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.467 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.67 -38.54 58.67 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 120.962 0.41 . . . . 0.0 111.135 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -71.11 -38.17 72.35 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -30.72 65.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.685 -176.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 3.3 pt20 -74.68 -31.19 61.83 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.24 0.543 . . . . 0.0 110.499 -178.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.467 HD12 ' HA3' ' A' ' 92' ' ' GLY . 2.7 mm? -86.4 -37.31 18.51 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.172 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.18 -35.78 76.14 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.395 -178.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -83.35 -3.24 57.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.26 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -91.51 -70.99 1.19 Allowed Glycine 0 N--CA 1.437 -1.266 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.631 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.42 -37.56 0.14 Allowed 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.483 0.658 . . . . 0.0 110.29 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.411 ' C ' ' H ' ' A' ' 93' ' ' GLN . . . 166.2 -93.86 0.11 Allowed Glycine 0 N--CA 1.419 -2.448 0 N-CA-C 107.101 -2.4 . . . . 0.0 107.101 -178.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.467 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 75.42 -31.35 1.18 Allowed Glycine 0 C--O 1.2 -1.999 0 CA-C-O 119.413 -0.66 . . . . 0.0 114.721 173.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.411 ' H ' ' C ' ' A' ' 91' ' ' GLY . 26.9 mt-30 -47.83 -35.38 10.12 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 124.681 1.192 . . . . 0.0 112.201 -178.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -74.17 -42.16 60.35 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.428 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 19.4 pt20 -77.45 -44.71 28.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.48 0.657 . . . . 0.0 110.133 -178.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.428 HG13 HG23 ' A' ' 37' ' ' THR . 94.1 t -64.5 -22.85 32.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 C-N-CA 124.789 1.236 . . . . 0.0 110.355 177.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -45.83 -46.0 15.29 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.004 0.522 . . . . 0.0 112.407 -178.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -65.08 -18.22 65.11 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.914 0.388 . . . . 0.0 111.957 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.414 ' O ' ' HB2' ' A' ' 102' ' ' LYS . 7.6 tpt -101.65 -49.25 4.06 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.3 p -63.02 -23.95 34.67 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.824 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -23.07 66.93 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 121.827 -0.546 . . . . 0.0 110.565 175.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 99' ' ' MET . 22.7 mtpp -67.56 -26.43 66.29 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.301 176.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.95 -32.26 73.65 Favored 'General case' 0 C--O 1.211 -0.949 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -69.69 -19.98 63.56 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 122.079 0.943 . . . . 0.0 109.243 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' MET . . . . . 0.437 ' HA ' HD21 ' A' ' 108' ' ' ASN . 52.9 mtp -92.15 -19.12 22.6 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.03 179.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.3 mp -54.1 -45.52 99.05 Favored Pre-proline 0 N--CA 1.47 0.543 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -176.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.19 -22.23 74.02 Favored 'Trans proline' 0 C--N 1.366 1.471 0 CA-C-N 120.791 1.318 . . . . 0.0 112.552 176.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . 0.437 HD21 ' HA ' ' A' ' 105' ' ' MET . 32.0 m-80 -86.84 -45.19 11.1 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -69.53 -43.39 73.1 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.303 -177.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 13.9 t -86.36 -0.82 56.75 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -176.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 56.88 59.5 3.46 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 122.957 1.361 . . . . 0.0 109.973 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 57.5 mt -96.87 157.42 15.91 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 113.638 -1.619 . . . . 0.0 110.344 -178.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -78.77 43.87 0.51 Allowed 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 124.825 1.25 . . . . 0.0 112.492 -173.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 54.2 m -156.96 157.1 34.14 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 -176.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.0 m -136.83 140.88 42.75 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 38.4 mm . . . . . 0 N--CA 1.434 -1.253 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 175.498 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.432 ' HA3' ' HA ' ' A' ' 14' ' ' ASP . . . . . . . . 0 CA--C 1.49 -1.527 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -81.46 165.7 21.01 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.425 0.155 . . . . 0.0 110.78 179.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.812 ' SG ' ' HB2' ' A' ' 9' ' ' PRO . 4.1 t -152.78 153.85 34.01 Favored 'General case' 0 N--CA 1.427 -1.602 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 177.154 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 74.9 p -77.37 149.57 35.2 Favored 'General case' 0 C--N 1.271 -2.816 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.94 71.12 5.57 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 119.372 -0.931 . . . . 0.0 109.655 178.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 t -143.65 168.37 20.06 Favored 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 74.3 mt -129.7 115.35 18.07 Favored Pre-proline 0 C--N 1.308 -1.222 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.71 146.38 86.56 Favored 'Cis proline' 0 C--O 1.246 0.887 0 C-N-CA 123.863 -1.307 . . . . 0.0 111.981 0.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.812 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 91.1 Cg_endo -77.22 152.66 31.12 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.371 2.047 . . . . 0.0 112.802 -178.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 mm -109.36 111.64 37.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.0 m -104.05 149.34 25.28 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.229 -173.38 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -106.15 151.76 40.23 Favored Pre-proline 0 C--N 1.293 -1.867 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.972 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -51.73 -53.89 6.26 Favored 'Trans proline' 0 C--N 1.364 1.388 0 C-N-CA 123.085 2.523 . . . . 0.0 110.146 178.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.432 ' HA ' ' HA3' ' A' ' 1' ' ' GLY . 26.5 t70 -140.92 -77.41 0.29 Allowed 'General case' 0 N--CA 1.419 -1.99 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 174.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -113.62 -124.96 4.19 Favored Glycine 0 CA--C 1.471 -2.691 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 177.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.38 -50.99 3.1 Favored 'General case' 0 C--N 1.284 -2.245 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.291 -175.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.483 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 32.6 t70 -137.95 96.46 3.22 Favored 'General case' 0 C--N 1.278 -2.532 0 CA-C-N 115.061 -0.972 . . . . 0.0 108.973 -178.18 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -105.61 94.63 8.89 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.483 ' HD3' ' O ' ' A' ' 17' ' ' ASP . 6.6 Cg_exo -74.82 -32.12 5.95 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.053 1.835 . . . . 0.0 114.098 -176.32 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.435 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 1.0 OUTLIER -99.74 -54.98 2.77 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-O 121.896 0.855 . . . . 0.0 108.955 -176.655 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.29 46.7 0.91 Allowed Glycine 0 N--CA 1.43 -1.759 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -172.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 67.4 m -84.48 131.91 34.61 Favored 'General case' 0 N--CA 1.419 -1.977 0 CA-C-N 114.124 -1.038 . . . . 0.0 112.338 -177.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -106.95 101.83 11.23 Favored 'General case' 0 N--CA 1.42 -1.975 0 CA-C-O 122.176 0.989 . . . . 0.0 109.186 176.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -108.39 132.56 55.91 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.452 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.533 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.7 ptt-85 -67.58 114.19 6.02 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 121.832 0.825 . . . . 0.0 109.432 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.468 ' HB ' HE22 ' A' ' 81' ' ' GLN . 2.5 pp -68.0 -9.65 11.25 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 CA-C-N 115.254 -0.885 . . . . 0.0 113.203 -174.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -77.42 -20.52 54.46 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.519 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.3 pt20 -81.52 -20.98 38.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -89.27 -4.86 58.0 Favored 'General case' 0 CA--C 1.477 -1.84 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.623 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -55.92 -32.71 64.03 Favored 'General case' 0 C--O 1.218 -0.597 0 O-C-N 124.03 0.831 . . . . 0.0 110.808 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -66.28 -56.66 10.14 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -54.22 -51.21 65.17 Favored 'General case' 0 C--O 1.218 -0.59 0 O-C-N 123.827 0.704 . . . . 0.0 109.715 178.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -50.68 -60.52 2.95 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 124.062 0.945 . . . . 0.0 112.422 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -67.84 -35.33 78.4 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.736 -173.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -73.99 -30.27 62.39 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.681 -177.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.9 mt -84.54 -24.64 29.21 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 71.3 p -84.76 -12.93 52.69 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.196 -1.402 . . . . 0.0 110.129 175.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.0 t -88.49 149.97 23.37 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.645 177.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.43 ' CZ ' ' HA ' ' A' ' 96' ' ' VAL . 50.7 m-85 -130.07 153.77 48.13 Favored 'General case' 0 N--CA 1.434 -1.264 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.513 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -108.82 174.9 5.66 Favored 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -178.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -101.32 -34.75 9.5 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -170.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.43 7.47 16.75 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 119.397 -0.921 . . . . 0.0 111.672 -175.29 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 39.6 mt -73.52 68.79 1.18 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.379 177.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 20.8 mmt180 -123.35 -5.43 8.28 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.81 0.814 . . . . 0.0 108.817 178.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -148.93 16.15 0.96 Allowed 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.623 -1.171 . . . . 0.0 109.237 -179.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.456 ' HB2' HE22 ' A' ' 52' ' ' GLN . . . -130.71 135.92 48.28 Favored 'General case' 0 N--CA 1.424 -1.767 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.609 -172.695 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 41.9 t -130.01 -68.17 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.361 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -129.74 96.13 4.16 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.418 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 16.0 m120 -120.39 144.48 38.32 Favored Pre-proline 0 C--N 1.293 -1.88 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -43.95 -50.82 7.07 Favored 'Trans proline' 0 C--N 1.355 0.921 0 C-N-CA 123.978 3.119 . . . . 0.0 114.849 -174.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -76.65 -7.22 54.85 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -175.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.456 HE22 ' HB2' ' A' ' 46' ' ' ALA . 75.8 mt-30 -96.26 -28.05 14.71 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 176.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' A' ' 49' ' ' ASN . 50.3 mt-30 -84.31 11.87 7.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.946 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.505 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 4.1 pt20 -61.21 -32.33 72.1 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.404 178.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -64.51 -24.61 67.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.422 178.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -73.76 -45.05 54.22 Favored 'General case' 0 CA--C 1.491 -1.294 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.2 m -56.63 -36.38 69.41 Favored 'General case' 0 C--O 1.213 -0.837 0 O-C-N 123.907 0.754 . . . . 0.0 110.333 179.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 40.2 mt -79.3 -47.35 16.0 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.955 -178.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.6 t -69.28 -50.39 47.35 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.765 -175.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 7.5 t -52.36 -43.43 64.67 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 124.178 0.991 . . . . 0.0 110.048 175.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.437 ' HA ' ' CD ' ' A' ' 64' ' ' GLN . 8.1 t30 -72.06 -23.76 61.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.373 -176.275 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -83.83 -48.18 10.33 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.255 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.525 ' O ' ' HG2' ' A' ' 71' ' ' GLN . 3.7 pp -65.21 -34.0 77.34 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-O 121.214 0.531 . . . . 0.0 111.037 -177.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.437 ' CD ' ' HA ' ' A' ' 61' ' ' ASN . 13.4 pt20 -69.31 -15.57 63.37 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.178 0.591 . . . . 0.0 111.865 -176.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -84.58 -11.44 56.01 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.479 0.657 . . . . 0.0 110.301 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 11.6 t -82.74 163.45 3.03 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 174.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 46.0 mt-10 -47.47 144.06 3.25 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.408 0.683 . . . . 0.0 111.657 176.213 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -63.19 -28.93 70.39 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -175.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.501 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 4.0 pt20 -80.0 -14.86 58.25 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.507 0.67 . . . . 0.0 110.399 177.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.501 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.7 m -110.94 -7.09 14.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.156 -173.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 72.0 mt-30 -62.95 -40.33 97.36 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.092 0.472 . . . . 0.0 110.347 177.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.402 ' O ' ' HB ' ' A' ' 75' ' ' ILE . 32.1 p -77.34 -23.83 50.86 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.419 176.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -71.0 -32.03 68.73 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.328 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.08 -27.01 68.81 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.815 177.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.416 ' O ' HG21 ' A' ' 79' ' ' VAL . 31.0 mm -69.55 -32.5 53.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.734 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -70.8 -41.64 71.37 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 106.465 -1.679 . . . . 0.0 106.465 -174.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.418 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 0.1 OUTLIER -56.99 -44.07 82.34 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 112.492 -2.14 . . . . 0.0 110.584 -179.025 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 15.8 t -59.41 -45.96 93.09 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.584 0 O-C-N 124.079 0.862 . . . . 0.0 109.59 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.416 HG21 ' O ' ' A' ' 75' ' ' ILE . 40.1 t -65.53 -46.25 90.27 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.89 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -175.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -54.64 -51.85 64.12 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.196 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.468 HE22 ' HB ' ' A' ' 26' ' ' ILE . 3.6 pt20 -76.43 -34.46 58.77 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -175.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.54 -33.89 67.15 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.834 0.349 . . . . 0.0 111.098 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 3.9 pt20 -76.37 -35.69 58.55 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.892 179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -71.1 -35.87 71.97 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.088 -176.984 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -68.63 -30.04 68.67 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 121.221 0.534 . . . . 0.0 110.7 -176.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.455 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.1 mm? -86.28 -37.48 18.51 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.982 175.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -60.91 -34.81 75.24 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.983 0.913 . . . . 0.0 111.868 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -75.62 -4.83 42.32 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.507 0.67 . . . . 0.0 111.738 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -105.24 -132.52 7.38 Favored Glycine 0 N--CA 1.428 -1.837 0 N-CA-C 110.984 -0.847 . . . . 0.0 110.984 178.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -88.62 -23.78 22.98 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 120.781 0.325 . . . . 0.0 111.686 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 157.98 -94.44 0.14 Allowed Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.45 ' HA3' HD11 ' A' ' 86' ' ' LEU . . . 73.05 -36.91 0.76 Allowed Glycine 0 C--O 1.202 -1.847 0 N-CA-C 115.421 0.929 . . . . 0.0 115.421 176.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -49.32 -29.23 5.74 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 124.118 0.967 . . . . 0.0 113.462 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -77.03 -40.1 47.71 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 122.227 0.211 . . . . 0.0 111.204 178.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -79.63 -45.88 18.25 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.455 HG21 ' HG ' ' A' ' 86' ' ' LEU . 84.4 t -62.22 -23.03 30.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 C-N-CA 125.29 1.436 . . . . 0.0 111.07 177.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -42.58 -52.34 4.82 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.427 1.091 . . . . 0.0 112.732 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -60.12 -18.21 45.65 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.752 0.821 . . . . 0.0 112.778 -178.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 5.6 tpt -106.01 -47.09 3.93 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -177.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.1 p -64.78 -23.78 34.15 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-O 120.899 0.381 . . . . 0.0 111.527 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' A' ' 105' ' ' MET . 0.0 OUTLIER -61.69 -25.31 67.33 Favored 'General case' 0 C--O 1.218 -0.599 0 O-C-N 121.791 -0.568 . . . . 0.0 110.966 173.567 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -65.47 -27.93 68.85 Favored 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 122.499 0.32 . . . . 0.0 110.207 177.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.462 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -63.36 -36.18 82.87 Favored 'General case' 0 C--O 1.202 -1.401 0 CA-C-O 121.948 0.88 . . . . 0.0 109.001 175.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -76.82 -16.06 59.55 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.3 -178.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' MET . . . . . 0.505 ' HG3' ' O ' ' A' ' 101' ' ' LYS . 68.4 mtp -91.57 -14.7 29.83 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.057 178.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.462 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 96.9 mt -51.46 -50.09 78.61 Favored Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 123.559 0.537 . . . . 0.0 112.351 -178.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 19.5 Cg_endo -61.38 -26.3 81.28 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.817 1.678 . . . . 0.0 112.663 177.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -83.1 -28.3 29.58 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-O 121.358 0.599 . . . . 0.0 109.616 -177.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -84.33 -47.85 10.31 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.452 0.644 . . . . 0.0 111.022 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 88.4 m -82.63 0.58 42.44 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -175.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 60.2 t30 56.87 61.68 2.53 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 122.175 0.988 . . . . 0.0 109.963 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.415 ' C ' ' H ' ' A' ' 114' ' ' CYS . 74.9 mt -95.09 158.52 15.43 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.735 -178.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -72.55 17.65 0.11 Allowed 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.93 0.892 . . . . 0.0 113.318 -172.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.415 ' H ' ' C ' ' A' ' 112' ' ' LEU . 83.1 m -148.31 158.01 43.83 Favored 'General case' 0 C--N 1.268 -2.949 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 -169.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 31.9 p -134.69 146.88 49.9 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 33.6 mm . . . . . 0 C--N 1.303 -1.431 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 177.646 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 66.7 m . . . . . 0 N--CA 1.427 -1.603 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 51.8 p -83.38 154.71 23.88 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.85 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -85.86 69.58 10.58 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.5 m -158.6 168.23 27.45 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 81.5 mt -128.22 123.16 22.38 Favored Pre-proline 0 C--N 1.309 -1.192 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -71.53 142.76 74.42 Favored 'Cis proline' 0 C--O 1.244 0.809 0 C-N-CA 123.642 -1.399 . . . . 0.0 112.61 0.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.88 142.49 39.15 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 122.353 2.035 . . . . 0.0 110.857 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.496 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 44.8 mm -101.68 107.72 22.13 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.262 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.5 m . . . . . 0 C--N 1.301 -1.521 0 CA-C-O 121.899 0.856 . . . . 0.0 111.618 -178.479 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.431 -1.39 0 CA-C-O 120.952 0.406 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -101.73 112.46 25.06 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 122.092 0.948 . . . . 0.0 109.994 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.406 HG21 ' CB ' ' A' ' 74' ' ' ALA . 3.0 mp -120.08 131.22 73.02 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.284 0 N-CA-C 105.637 -1.986 . . . . 0.0 105.637 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.471 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 24.4 ptt-85 -73.03 123.52 23.69 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 121.099 0.476 . . . . 0.0 109.744 -176.148 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.75 -16.65 21.38 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -174.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.437 ' CD ' ' HB2' ' A' ' 25' ' ' ARG . 17.8 pm0 -75.77 -18.31 59.57 Favored 'General case' 0 N--CA 1.421 -1.915 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.973 -178.172 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.6 pt20 -83.83 -19.53 34.8 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.408 HD22 ' HG2' ' A' ' 28' ' ' GLN . 2.4 mm? -91.75 3.26 55.52 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.624 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -59.11 -34.47 72.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 123.762 0.664 . . . . 0.0 109.317 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -69.73 -50.35 44.35 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.057 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.613 ' HA ' ' ND1' ' A' ' 35' ' ' HIS . 0.5 OUTLIER -58.11 -48.73 79.31 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 120.772 0.32 . . . . 0.0 110.338 178.408 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -52.52 -52.15 56.05 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 123.44 0.696 . . . . 0.0 111.651 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.4 ptm -70.64 -38.41 73.86 Favored 'General case' 0 C--O 1.205 -1.288 0 C-N-CA 120.676 -0.41 . . . . 0.0 111.062 -177.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.613 ' ND1' ' HA ' ' A' ' 32' ' ' CYS . 0.9 OUTLIER -70.83 -23.36 62.34 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.371 -0.532 . . . . 0.0 111.926 -176.147 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.449 HD22 ' O ' ' A' ' 99' ' ' MET . 91.5 mt -88.86 -39.08 14.09 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.218 174.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.529 ' HA ' HG13 ' A' ' 96' ' ' VAL . 41.1 p -83.61 -22.79 32.13 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 118.21 -1.396 . . . . 0.0 112.31 -175.203 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 t -92.5 121.74 34.25 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.903 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 . . . . . 0 C--N 1.296 -1.719 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 169.619 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.446 -0.647 0 CA-C-O 121.365 0.602 . . . . 0.0 111.344 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -83.13 -41.6 18.34 Favored 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.8 m -56.67 -31.52 64.51 Favored 'General case' 0 C--O 1.212 -0.882 0 O-C-N 123.708 0.63 . . . . 0.0 110.121 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.8 mt -82.99 -48.06 11.06 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.232 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.2 t -65.94 -50.07 65.72 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -178.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.536 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.7 t -59.31 -30.8 68.61 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.101 0.56 . . . . 0.0 110.29 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -78.7 -25.04 44.69 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.43 0.633 . . . . 0.0 111.471 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -84.9 -42.9 14.58 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.198 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.569 HD22 HD11 ' A' ' 75' ' ' ILE . 3.7 pp -68.49 -31.99 71.65 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.647 -177.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -71.2 -10.36 59.63 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -177.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -86.11 -12.43 50.04 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 121.816 0.817 . . . . 0.0 109.424 176.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 15.6 t -83.46 163.28 2.97 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.24 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 174.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.439 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 1.6 mp0 -48.2 142.23 5.58 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 124.187 0.995 . . . . 0.0 111.738 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -53.65 -35.58 61.15 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 124.767 1.227 . . . . 0.0 112.915 -174.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -87.49 -20.81 26.02 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.221 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 59.5 m -95.17 -8.84 35.16 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.681 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.554 ' HB3' HD22 ' A' ' 112' ' ' LEU . 23.0 mt-30 -57.33 -43.12 83.1 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.87 176.458 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 6.5 p -80.87 -24.21 38.49 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.163 0.506 . . . . 0.0 111.177 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -67.92 -33.18 74.19 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.483 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.441 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.72 -31.29 68.15 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.459 177.569 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.569 HD11 HD22 ' A' ' 63' ' ' LEU . 21.1 mm -73.18 -27.57 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.238 0 CA-C-N 115.095 -0.957 . . . . 0.0 109.94 -177.07 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -74.54 -39.81 62.11 Favored 'General case' 0 CA--C 1.484 -1.589 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 -175.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -56.22 -40.42 74.04 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 112.626 -2.079 . . . . 0.0 109.215 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 74' ' ' ALA . 25.9 t -60.64 -47.9 90.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.929 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 42.3 t -61.6 -48.71 87.51 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.198 -174.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -61.75 -41.53 97.79 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.655 -175.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -79.97 -28.82 39.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.634 0.254 . . . . 0.0 111.163 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.98 -41.12 60.15 Favored 'General case' 0 C--N 1.311 -1.077 0 O-C-N 122.19 -0.319 . . . . 0.0 111.314 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -69.48 -35.63 75.78 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.126 -178.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.434 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -72.01 -36.23 69.66 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.178 -178.388 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.434 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 5.8 pt20 -72.8 -34.51 66.94 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.355 -174.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.472 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 2.4 mm? -76.79 -36.62 56.85 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.62 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -66.39 -40.35 89.62 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.623 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -75.12 -17.46 60.42 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.367 0.604 . . . . 0.0 110.157 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -83.08 -65.52 1.59 Allowed Glycine 0 N--CA 1.421 -2.357 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 28.4 pt20 -158.43 -26.2 0.08 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -175.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.472 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 146.38 -114.97 0.77 Allowed Glycine 0 CA--C 1.492 -1.397 0 N-CA-C 108.476 -1.85 . . . . 0.0 108.476 -174.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.23 -32.17 2.3 Favored Glycine 0 C--O 1.196 -2.252 0 CA-C-O 118.909 -0.94 . . . . 0.0 114.488 172.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -48.1 -32.66 7.11 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.921 0.888 . . . . 0.0 113.396 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -72.87 -38.12 67.11 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.964 0.412 . . . . 0.0 111.429 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.46 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 20.0 pt20 -85.43 -44.19 12.96 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 121.475 0.655 . . . . 0.0 109.662 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.529 HG13 ' HA ' ' A' ' 37' ' ' THR . 92.0 t -61.19 -22.53 27.55 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 C-N-CA 125.412 1.485 . . . . 0.0 110.933 176.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.41 ' HA ' HG12 ' A' ' 100' ' ' VAL . 53.3 tt0 -46.44 -46.23 18.63 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 20.1 pt20 -63.55 -18.5 63.92 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -178.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.449 ' O ' HD22 ' A' ' 36' ' ' LEU . 4.7 tpt -100.43 -46.83 5.11 Favored 'General case' 0 N--CA 1.438 -1.072 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -177.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' A' ' 97' ' ' GLN . 7.9 p -62.08 -26.17 39.38 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-O 120.834 0.35 . . . . 0.0 111.771 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -23.42 67.34 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.805 -0.559 . . . . 0.0 111.345 177.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -65.93 -25.59 67.21 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.024 178.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.22 -28.82 69.04 Favored 'General case' 0 C--O 1.203 -1.385 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.332 176.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -71.17 -24.52 62.26 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.265 1.031 . . . . 0.0 109.083 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 49.0 mtm -92.37 -13.02 30.78 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.528 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.46 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.1 OUTLIER -54.0 -46.75 98.52 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.226 0.61 . . . . 0.0 111.06 -177.965 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.597 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 20.3 Cg_endo -60.72 -26.89 83.88 Favored 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 121.382 1.388 . . . . 0.0 112.666 175.378 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -77.97 -46.98 19.62 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -64.64 -47.96 76.61 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.305 -0.862 . . . . 0.0 112.44 -177.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.4 ' SG ' HD11 ' A' ' 63' ' ' LEU . 10.2 t -84.08 -3.32 57.99 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.2 0.524 . . . . 0.0 109.701 -175.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.2 t30 58.17 64.23 1.55 Allowed 'General case' 0 C--O 1.247 0.944 0 CA-C-O 123.072 1.415 . . . . 0.0 110.717 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 71' ' ' GLN . 31.6 mt -101.63 158.52 16.03 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 112.992 -1.913 . . . . 0.0 109.015 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -72.92 44.68 0.14 Allowed 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 124.368 1.067 . . . . 0.0 112.988 -176.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.597 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 67.0 m -160.47 152.14 19.75 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -175.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.8 m -151.33 114.92 4.87 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 6.3 pt . . . . . 0 N--CA 1.428 -1.547 0 CA-C-O 118.459 -0.781 . . . . 0.0 112.546 -177.448 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 72.6 m . . . . . 0 N--CA 1.434 -1.256 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.4 p -75.65 142.43 42.58 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 176.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.66 68.88 10.55 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.825 0.821 . . . . 0.0 109.976 178.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.1 t -150.5 170.96 17.86 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 105.936 -1.875 . . . . 0.0 105.936 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.3 mp -127.39 125.35 23.91 Favored Pre-proline 0 C--N 1.298 -1.635 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.29 143.26 76.7 Favored 'Cis proline' 0 C--O 1.243 0.76 0 C-N-CA 123.722 -1.366 . . . . 0.0 111.985 -1.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.77 129.76 21.72 Favored 'Trans proline' 0 C--O 1.254 1.282 0 C-N-CA 122.122 1.882 . . . . 0.0 111.43 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.416 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 37.6 mm -92.41 111.69 24.75 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 75.9 m . . . . . 0 C--N 1.29 -2.003 0 CA-C-O 121.449 0.642 . . . . 0.0 111.305 -175.325 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 60.0 m . . . . . 0 N--CA 1.409 -2.494 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -107.6 117.07 33.12 Favored 'General case' 0 N--CA 1.416 -2.137 0 CA-C-O 121.871 0.843 . . . . 0.0 108.948 172.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.408 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.3 mp -111.69 143.34 21.69 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.64 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 -177.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.524 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.2 ptt180 -69.72 116.27 9.92 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 118.399 0.545 . . . . 0.0 110.382 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 pp -63.66 -14.8 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.395 0.617 . . . . 0.0 112.393 -175.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -73.43 -22.9 60.09 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.698 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.524 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.0 pt20 -83.73 -18.5 37.67 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.431 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.4 mm? -94.87 -0.7 53.8 Favored 'General case' 0 CA--C 1.48 -1.715 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.441 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -59.14 -30.97 68.53 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 123.751 0.657 . . . . 0.0 111.273 -178.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.404 ' O ' ' HG2' ' A' ' 34' ' ' MET . 3.4 t-160 -71.08 -52.56 18.68 Favored 'General case' 0 C--O 1.216 -0.662 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.825 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 1.6 t -56.47 -46.79 80.22 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 124.173 0.989 . . . . 0.0 109.032 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -53.11 -56.02 19.48 Favored 'General case' 0 N--CA 1.425 -1.692 0 C-N-CA 124.926 1.291 . . . . 0.0 111.349 174.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 31' ' ' HIS . 24.7 ptm -70.29 -33.66 71.82 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.397 -173.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.825 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -69.89 -23.42 63.25 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.631 -178.72 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.9 mt -88.54 -36.14 16.54 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.862 175.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.414 ' HB ' HD21 ' A' ' 86' ' ' LEU . 72.4 p -80.15 -19.78 46.41 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 119.161 -1.016 . . . . 0.0 112.809 -176.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 66.4 p -89.57 135.43 33.61 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -178.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 . . . . . 0 C--N 1.305 -1.344 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 172.489 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.413 ' HB2' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER . . . . . 0 N--CA 1.443 -0.81 0 CA-C-O 121.736 0.779 . . . . 0.0 110.252 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.92 -38.73 61.74 Favored 'General case' 0 CA--C 1.495 -1.166 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.082 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 m -56.97 -35.59 69.33 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 42.4 mt -73.41 -51.67 16.45 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.247 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.6 t -60.78 -50.5 73.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 122.776 0.43 . . . . 0.0 111.277 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.542 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.4 t -59.44 -33.63 71.51 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 124.168 0.987 . . . . 0.0 110.161 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.43 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 16.9 t-20 -79.22 -23.21 43.93 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.517 0.675 . . . . 0.0 110.411 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -82.26 -48.26 11.44 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.857 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.593 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -67.41 -33.36 75.02 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.431 -177.299 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -69.59 -12.77 61.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.982 -176.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 68.6 mm-40 -89.39 -11.01 44.43 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.464 0.649 . . . . 0.0 109.569 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -80.84 164.45 3.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 174.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -45.6 136.5 5.81 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.828 0.451 . . . . 0.0 110.9 173.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.602 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 17.2 ptpt -57.9 -33.99 69.33 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -174.136 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.429 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 24.5 pt20 -76.11 -20.46 57.62 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.835 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.429 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 58.8 m -102.29 -9.38 20.44 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.776 -174.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.602 ' NE2' ' HA ' ' A' ' 68' ' ' LYS . 79.5 mt-30 -59.45 -42.62 92.38 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 121.17 0.509 . . . . 0.0 110.773 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.2 p -78.82 -24.22 44.62 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.279 0.562 . . . . 0.0 111.406 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -71.43 -32.54 68.49 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.442 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.477 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.84 -29.85 69.75 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.766 176.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.593 HD11 HD22 ' A' ' 63' ' ' LEU . 28.2 mm -68.9 -35.64 70.27 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.654 -178.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -63.48 -44.62 93.88 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -176.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 4.6 mt-30 -61.65 -41.92 98.18 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 113.322 -1.763 . . . . 0.0 110.32 -177.591 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 74' ' ' ALA . 38.2 t -53.31 -47.56 57.23 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.082 0 O-C-N 124.413 1.07 . . . . 0.0 109.359 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 75' ' ' ILE . 41.4 t -67.76 -45.83 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.091 0 CA-C-N 115.476 -0.783 . . . . 0.0 108.939 -174.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -56.94 -51.61 68.48 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.208 -178.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.465 ' HA ' ' HG3' ' A' ' 84' ' ' LYS . 20.3 pt20 -72.61 -31.74 65.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.648 -177.44 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.18 -38.46 66.15 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.871 0.367 . . . . 0.0 111.37 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -75.72 -34.75 60.37 Favored 'General case' 0 C--N 1.312 -1.043 0 C-N-CA 120.014 -0.674 . . . . 0.0 110.144 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.465 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -72.82 -31.7 65.0 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.14 -178.415 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -71.32 -33.33 69.57 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.579 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.591 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 4.1 mm? -78.66 -37.04 42.87 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.009 175.26 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -58.03 -41.73 83.85 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.924 0.89 . . . . 0.0 110.732 179.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -79.28 -14.41 59.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.777 -176.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -96.75 -105.88 2.3 Favored Glycine 0 N--CA 1.425 -2.04 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.988 -176.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -102.92 -17.35 15.53 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.145 0.498 . . . . 0.0 111.649 -175.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.591 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 128.08 -93.12 0.36 Allowed Glycine 0 N--CA 1.428 -1.889 0 N-CA-C 108.601 -1.8 . . . . 0.0 108.601 -173.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.576 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 72.25 -37.37 0.67 Allowed Glycine 0 C--O 1.193 -2.46 0 N-CA-C 115.77 1.068 . . . . 0.0 115.77 172.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -49.63 -27.7 4.93 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 118.538 1.169 . . . . 0.0 113.111 -178.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.439 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 29.1 pt20 -67.3 -45.0 77.84 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 120.67 0.271 . . . . 0.0 110.477 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 19.2 pt20 -86.51 -42.64 13.37 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 121.521 0.677 . . . . 0.0 111.075 -175.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.449 HG21 ' HG ' ' A' ' 86' ' ' LEU . 91.0 t -64.57 -22.95 32.33 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.191 0 C-N-CA 125.108 1.363 . . . . 0.0 111.766 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -48.1 -45.09 32.37 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 28.8 pt20 -61.3 -21.79 64.29 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 122.961 0.504 . . . . 0.0 112.322 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 3.3 tpt -100.42 -44.89 5.75 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -175.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.95 -24.13 34.88 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.516 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -23.66 67.38 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.755 -0.59 . . . . 0.0 110.578 176.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -63.26 -29.25 70.61 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -63.71 -29.88 71.05 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 121.191 0.52 . . . . 0.0 110.266 177.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -73.14 -17.23 61.41 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.792 0.806 . . . . 0.0 109.511 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 50.7 mtp -92.14 -20.61 21.06 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.331 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 5.0 mp -52.15 -45.51 93.84 Favored Pre-proline 0 N--CA 1.468 0.43 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.425 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 14.1 Cg_endo -59.79 -22.5 68.3 Favored 'Trans proline' 0 C--N 1.369 1.624 0 C-N-CA 121.141 1.227 . . . . 0.0 112.862 176.083 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -89.45 -45.82 9.16 Favored 'General case' 0 N--CA 1.411 -2.39 0 CA-C-O 121.126 0.488 . . . . 0.0 109.971 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -68.31 -38.95 82.09 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.868 -176.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.456 ' SG ' HD21 ' A' ' 112' ' ' LEU . 16.7 t -87.3 -6.46 58.51 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -179.01 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.1 t30 57.74 64.4 1.57 Allowed 'General case' 0 CA--C 1.508 -0.638 0 C-N-CA 124.91 1.284 . . . . 0.0 110.082 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.456 HD21 ' SG ' ' A' ' 110' ' ' CYS . 47.5 mt -96.04 159.46 14.95 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 113.372 -1.74 . . . . 0.0 109.935 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -71.7 37.53 0.06 Allowed 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 123.612 0.765 . . . . 0.0 112.709 -177.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 74.4 m -157.15 154.58 29.55 Favored 'General case' 0 C--N 1.28 -2.416 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -175.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 12.0 p -149.74 134.14 17.42 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 43.0 mm . . . . . 0 C--N 1.307 -1.241 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -178.872 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 63.7 m . . . . . 0 N--CA 1.431 -1.414 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 77.5 p -86.96 157.74 19.41 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.865 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -91.98 76.81 5.46 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.305 0.574 . . . . 0.0 109.594 176.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.9 t -152.01 172.0 16.96 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.6 mp -128.33 117.77 20.22 Favored Pre-proline 0 N--CA 1.435 -1.206 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.34 147.74 90.18 Favored 'Cis proline' 0 C--O 1.246 0.908 0 C-N-CA 123.596 -1.418 . . . . 0.0 111.801 -0.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -69.92 139.57 39.98 Favored 'Trans proline' 0 C--O 1.247 0.952 0 C-N-CA 122.164 1.909 . . . . 0.0 111.094 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.53 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 44.3 mm -97.44 111.44 27.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.955 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 73.6 m . . . . . 0 C--N 1.288 -2.082 0 CA-C-O 121.491 0.662 . . . . 0.0 110.235 -179.548 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 67.8 m . . . . . 0 N--CA 1.418 -2.05 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -107.11 108.54 20.05 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-O 121.869 0.843 . . . . 0.0 108.893 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.446 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.0 mp -102.49 141.3 18.84 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.691 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -175.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.5 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 20.6 ptt180 -67.11 114.14 5.63 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 121.672 0.749 . . . . 0.0 111.12 -177.121 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.23 -15.65 12.95 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -73.75 -23.19 59.7 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.835 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.5 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.3 pt20 -83.37 -33.31 25.83 Favored 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.721 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.472 HD11 ' HB1' ' A' ' 74' ' ' ALA . 2.0 mm? -82.15 -8.64 59.66 Favored 'General case' 0 CA--C 1.474 -1.971 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.021 -177.348 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -58.09 -30.27 66.11 Favored 'General case' 0 C--N 1.314 -0.937 0 O-C-N 124.17 0.919 . . . . 0.0 110.855 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -70.18 -54.66 11.9 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -54.08 -50.52 66.6 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.396 1.079 . . . . 0.0 108.524 -178.461 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -53.86 -61.15 2.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 125.504 1.522 . . . . 0.0 112.581 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -67.17 -34.87 78.46 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.831 0.348 . . . . 0.0 111.825 -172.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.433 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 8.9 t-80 -67.51 -33.13 74.46 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.804 -177.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 91.4 mt -84.64 -34.68 23.03 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.539 ' HB ' HD21 ' A' ' 86' ' ' LEU . 41.8 p -79.71 -21.01 45.14 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 118.83 -1.148 . . . . 0.0 113.165 -176.303 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 57.2 p -88.68 154.73 20.07 Favored 'General case' 0 N--CA 1.424 -1.727 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.829 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 . . . . . 0 C--N 1.297 -1.713 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 173.91 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.433 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER . . . . . 0 C--O 1.21 -0.998 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.3 tp -74.97 -52.27 11.57 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 175.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.7 m -55.31 -27.66 48.41 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.929 -178.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 50.1 mt -88.34 -51.37 5.78 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.958 178.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.44 -50.19 60.35 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.94 0.496 . . . . 0.0 112.129 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.542 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 10.1 t -59.37 -41.43 89.29 Favored 'General case' 0 CA--C 1.492 -1.274 0 C-N-CA 123.412 0.685 . . . . 0.0 109.664 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -72.08 -26.67 62.25 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.944 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.465 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 7.0 tp60 -78.27 -48.92 14.67 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.474 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.644 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -67.61 -31.64 71.82 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.651 -177.095 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.404 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 11.7 pt20 -74.23 -6.96 50.92 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.693 -178.366 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.7 -24.12 56.2 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 174.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.9 t -81.19 161.84 3.68 Favored 'Isoleucine or valine' 0 C--O 1.248 1.025 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.302 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.452 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 47.7 mt-10 -50.2 141.48 11.3 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.984 0.914 . . . . 0.0 112.263 176.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -62.57 -24.79 67.73 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -174.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.465 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 12.4 pt20 -82.55 -15.36 52.59 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.458 0.647 . . . . 0.0 110.533 178.137 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.465 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 64.2 m -107.81 -9.34 15.78 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.167 -174.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 76.9 mt-30 -59.33 -40.83 87.57 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.42 ' HA ' HG12 ' A' ' 75' ' ' ILE . 14.5 p -81.2 -24.54 37.4 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.488 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.415 ' O ' ' HG3' ' A' ' 77' ' ' GLN . 7.7 mm-40 -67.74 -32.97 73.95 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.145 179.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.513 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -61.57 -34.89 76.37 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.361 177.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.644 HD11 HD22 ' A' ' 63' ' ' LEU . 30.8 mm -65.12 -37.18 79.57 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.787 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.274 -178.364 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -66.0 -43.18 88.45 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 -175.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.491 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.4 mt-30 -62.7 -41.22 99.01 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 113.47 -1.696 . . . . 0.0 109.402 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 74' ' ' ALA . 27.8 t -55.17 -46.82 77.87 Favored 'Isoleucine or valine' 0 C--N 1.356 0.859 0 O-C-N 123.769 0.668 . . . . 0.0 109.845 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 75' ' ' ILE . 21.2 t -70.07 -46.7 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.101 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -173.324 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -64.85 -35.25 80.53 Favored 'General case' 0 N--CA 1.424 -1.734 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.183 -174.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 13.7 pt20 -85.61 -26.35 26.13 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.979 0.419 . . . . 0.0 111.607 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.476 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -72.27 -44.94 62.07 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.105 0.478 . . . . 0.0 110.22 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -69.21 -29.55 67.54 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.413 ' HB3' ' HA ' ' A' ' 81' ' ' GLN . 7.4 tttt -65.04 -46.26 81.98 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 124.477 1.111 . . . . 0.0 111.332 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 2.7 pt20 -69.07 -23.29 64.01 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-O 121.339 0.59 . . . . 0.0 110.791 -175.104 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.539 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.4 mm? -86.13 -36.0 19.83 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.918 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -65.13 -37.4 87.32 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 123.327 0.651 . . . . 0.0 110.981 177.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -82.02 0.47 40.13 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.677 0.751 . . . . 0.0 111.069 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -96.68 -120.15 3.83 Favored Glycine 0 N--CA 1.424 -2.119 0 N-CA-C 108.986 -1.646 . . . . 0.0 108.986 175.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -116.45 -56.56 2.28 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-O 121.114 0.483 . . . . 0.0 109.961 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -155.62 -141.07 3.13 Favored Glycine 0 CA--C 1.493 -1.29 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 -178.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 95.09 -30.3 8.27 Favored Glycine 0 C--O 1.202 -1.886 0 CA-C-O 119.128 -0.818 . . . . 0.0 113.227 177.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -49.44 -34.62 17.06 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 123.513 0.725 . . . . 0.0 112.812 -175.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -78.8 -33.24 46.38 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -85.45 -39.24 17.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.854 0.835 . . . . 0.0 110.092 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.514 HG13 ' HA ' ' A' ' 37' ' ' THR . 84.5 t -63.72 -22.67 31.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.328 -1.305 . . . . 0.0 110.501 174.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -46.15 -47.34 17.55 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 123.429 0.455 . . . . 0.0 112.128 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -59.46 -21.55 60.24 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.159 0.504 . . . . 0.0 112.028 -178.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.9 tpt -104.07 -45.22 4.79 Favored 'General case' 0 N--CA 1.423 -1.79 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.747 -173.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.26 -24.01 31.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 CA-C-O 121.077 0.465 . . . . 0.0 110.765 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -22.66 66.48 Favored 'General case' 0 C--N 1.333 -0.118 0 O-C-N 121.91 -0.494 . . . . 0.0 111.017 176.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -66.2 -28.24 68.61 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.37 177.182 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.536 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -62.85 -35.34 79.65 Favored 'General case' 0 C--O 1.201 -1.476 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 176.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -68.01 -18.87 64.84 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.565 0.698 . . . . 0.0 110.026 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 36.1 mtp -92.67 -13.97 28.73 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.317 -178.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 1.7 mm? -51.15 -44.97 88.82 Favored Pre-proline 0 N--CA 1.476 0.839 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.616 ' HD3' HG21 ' A' ' 75' ' ' ILE . 18.5 Cg_endo -60.67 -31.04 91.61 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 121.387 1.391 . . . . 0.0 112.417 176.123 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -77.26 -36.02 54.76 Favored 'General case' 0 N--CA 1.427 -1.608 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -178.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -75.11 -49.57 19.19 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.454 0.645 . . . . 0.0 111.254 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 38.8 t -82.19 -2.24 51.65 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.456 -173.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 66.46 42.93 2.74 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 122.765 1.269 . . . . 0.0 110.19 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 68.4 mt -82.4 157.67 23.61 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.057 -178.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -74.74 31.44 0.09 Allowed 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.587 1.155 . . . . 0.0 112.895 -175.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 99.3 m -154.5 160.04 41.32 Favored 'General case' 0 C--N 1.28 -2.419 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -173.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 27.1 p -146.4 144.57 29.82 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 70.8 mt . . . . . 0 C--N 1.301 -1.528 0 CA-C-O 118.243 -0.884 . . . . 0.0 109.076 -178.159 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 50.5 m . . . . . 0 N--CA 1.444 -0.743 0 CA-C-O 120.828 0.347 . . . . 0.0 111.631 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.4 p -79.01 161.33 26.69 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.438 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -85.37 69.71 10.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.438 0.637 . . . . 0.0 109.765 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.8 t -143.01 169.66 17.15 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 34.7 mm -129.15 112.61 18.39 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 178.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 7' ' ' ILE . 3.9 Cg_exo -76.92 146.48 84.0 Favored 'Cis proline' 0 C--O 1.246 0.891 0 C-N-CA 123.969 -1.263 . . . . 0.0 109.919 -2.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.44 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 43.4 Cg_endo -64.46 142.51 78.69 Favored 'Trans proline' 0 C--N 1.328 -0.549 0 C-N-CA 122.56 2.173 . . . . 0.0 112.065 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.431 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 42.0 mm -92.35 116.15 32.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.6 m . . . . . 0 C--N 1.285 -2.198 0 CA-C-O 121.609 0.718 . . . . 0.0 110.736 -177.667 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 68.1 m . . . . . 0 N--CA 1.421 -1.903 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -100.61 112.83 25.27 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-O 121.714 0.769 . . . . 0.0 109.216 175.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.4 HG21 ' HB2' ' A' ' 74' ' ' ALA . 3.9 mp -114.33 139.03 42.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.969 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 -175.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.462 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 21.4 ptt-85 -67.12 121.77 16.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.487 0.66 . . . . 0.0 111.616 -175.11 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.38 -18.91 19.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 115.536 -0.757 . . . . 0.0 112.717 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -74.0 -17.23 61.02 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.192 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.518 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 1.2 pt20 -91.85 -19.05 22.93 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.157 -177.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.411 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.3 mm? -96.45 2.33 52.45 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.306 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.538 ' O ' ' HG2' ' A' ' 34' ' ' MET . 43.5 t30 -52.05 -39.72 60.06 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 124.754 1.283 . . . . 0.0 111.488 -178.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -70.61 -52.77 19.2 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -175.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.511 ' HB3' HG11 ' A' ' 78' ' ' VAL . 1.2 m -55.26 -50.2 70.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 123.866 0.729 . . . . 0.0 110.32 178.103 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -54.01 -59.84 4.12 Favored 'General case' 0 N--CA 1.433 -1.286 0 C-N-CA 123.707 0.803 . . . . 0.0 112.319 176.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.538 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.4 ptm -65.39 -41.05 94.12 Favored 'General case' 0 C--O 1.204 -1.322 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -66.8 -26.23 66.84 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 120.904 0.383 . . . . 0.0 110.302 -176.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 91.7 mt -88.32 -26.5 22.22 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.416 ' HA ' HG13 ' A' ' 96' ' ' VAL . 69.8 p -88.51 -19.25 26.66 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.587 -1.245 . . . . 0.0 111.578 176.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 74.3 p -90.01 139.4 30.64 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 . . . . . 0 C--N 1.293 -1.865 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 172.411 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.438 -1.065 0 CA-C-O 120.455 0.169 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -75.08 -43.69 51.69 Favored 'General case' 0 C--O 1.209 -1.071 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.6 m -57.87 -30.64 65.98 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.31 0.576 . . . . 0.0 110.79 178.508 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.5 mt -84.77 -56.16 3.73 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.506 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.3 t -62.1 -48.98 77.77 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.637 1.175 . . . . 0.0 111.397 -176.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.496 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 43.5 t -59.27 -36.53 75.7 Favored 'General case' 0 C--O 1.215 -0.755 0 C-N-CA 122.397 0.279 . . . . 0.0 110.456 178.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.532 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 8.6 t30 -71.71 -36.56 70.57 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-O 121.217 0.532 . . . . 0.0 110.466 -178.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.518 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 8.2 tp-100 -71.72 -44.24 64.49 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.914 -179.346 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.496 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.3 pp -72.8 -30.7 64.28 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 121.178 0.513 . . . . 0.0 110.961 -177.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.531 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 11.9 pt20 -72.36 -14.33 61.7 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -176.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.532 ' HG3' ' O ' ' A' ' 61' ' ' ASN . 44.3 mt-10 -80.22 -16.41 54.83 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-O 121.758 0.79 . . . . 0.0 109.363 177.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.423 HG12 ' HB2' ' A' ' 70' ' ' CYS . 18.8 t -79.61 163.13 3.65 Favored 'Isoleucine or valine' 0 C--O 1.25 1.128 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 175.208 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -51.03 145.09 7.89 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 123.856 0.862 . . . . 0.0 111.334 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.607 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 8.9 ptpp? -58.9 -32.53 69.6 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -176.079 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.429 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 13.1 pt20 -80.05 -21.61 43.26 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.637 0.732 . . . . 0.0 109.785 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.429 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.8 m -97.66 -13.07 21.72 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.653 -173.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.607 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 50.6 mt-30 -57.29 -46.62 82.97 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 121.175 0.512 . . . . 0.0 110.363 175.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.527 ' HA ' HG12 ' A' ' 75' ' ' ILE . 14.9 p -79.35 -23.63 43.27 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.924 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.551 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 10.2 mm-40 -66.62 -35.59 80.55 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 175.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.443 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.83 -25.25 66.49 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 123.551 0.74 . . . . 0.0 110.526 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.699 HG21 ' HD3' ' A' ' 107' ' ' PRO . 30.0 mm -73.8 -27.02 22.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.945 -178.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -75.89 -38.91 57.33 Favored 'General case' 0 CA--C 1.486 -1.494 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -175.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 73' ' ' GLU . 67.6 mm-40 -59.46 -44.15 93.05 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 111.56 -2.563 . . . . 0.0 109.711 -178.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.511 HG11 ' HB3' ' A' ' 32' ' ' CYS . 21.4 t -57.79 -45.72 87.13 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.708 0 O-C-N 123.627 0.579 . . . . 0.0 109.996 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 25.9 t -68.05 -47.04 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.317 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -174.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -55.28 -57.34 12.19 Favored 'General case' 0 N--CA 1.428 -1.571 0 O-C-N 124.836 1.335 . . . . 0.0 110.081 -178.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 19.4 pt20 -68.63 -30.02 68.65 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.02 -39.68 60.96 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 120.917 0.389 . . . . 0.0 111.093 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.448 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 13.7 pt20 -77.58 -37.02 51.42 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.649 -178.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.488 ' CG ' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -70.83 -30.45 66.88 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.34 0.126 . . . . 0.0 111.34 -177.794 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 2.8 pt20 -69.03 -28.68 66.78 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.229 0.537 . . . . 0.0 109.749 -178.435 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.433 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.3 mm? -87.8 -44.03 11.42 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.935 174.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -66.26 -22.48 66.32 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.47 1.108 . . . . 0.0 113.404 -176.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -66.5 -12.52 57.89 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -179.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 138.48 67.14 0.05 OUTLIER Glycine 0 CA--C 1.48 -2.138 0 C-N-CA 119.676 -1.25 . . . . 0.0 112.171 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -145.96 -58.11 0.31 Allowed 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 129.83 -134.91 8.09 Favored Glycine 0 N--CA 1.427 -1.963 0 N-CA-C 106.152 -2.779 . . . . 0.0 106.152 -174.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.63 -34.82 1.6 Allowed Glycine 0 C--O 1.196 -2.278 0 N-CA-C 115.352 0.901 . . . . 0.0 115.352 171.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -48.06 -29.52 3.62 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.651 1.18 . . . . 0.0 114.118 -176.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.479 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 26.5 pt20 -80.88 -43.72 19.45 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.287 0.565 . . . . 0.0 111.054 177.392 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.529 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 25.8 pt20 -84.08 -44.27 14.24 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 121.254 0.55 . . . . 0.0 111.649 -173.391 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.433 HG21 ' HG ' ' A' ' 86' ' ' LEU . 64.3 t -64.53 -23.48 33.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 C-N-CA 124.86 1.264 . . . . 0.0 110.418 178.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -51.11 -47.41 61.96 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 19.4 pt20 -67.82 -16.92 64.33 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.351 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 7.3 tpt -100.1 -49.07 4.41 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.5 p -59.95 -28.12 40.23 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.673 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.426 ' HE3' ' O ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -58.7 -25.05 62.49 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 175.468 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -65.13 -28.94 69.78 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 122.64 0.376 . . . . 0.0 110.529 177.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.423 ' HB2' ' CD1' ' A' ' 36' ' ' LEU . . . -60.78 -28.73 68.97 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.465 0.65 . . . . 0.0 110.987 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -73.16 -15.76 61.45 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.561 0.696 . . . . 0.0 110.988 -177.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 46.1 mtt -91.69 -13.97 30.83 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.878 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.474 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 98.3 mt -50.67 -48.09 83.54 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.452 -177.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.699 ' HD3' HG21 ' A' ' 75' ' ' ILE . 19.7 Cg_endo -59.19 -26.95 83.62 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 122.105 1.87 . . . . 0.0 113.113 177.152 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -83.59 -44.41 14.63 Favored 'General case' 0 N--CA 1.41 -2.438 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -74.93 -24.87 58.56 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.303 -175.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.416 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 25.6 t -98.8 -7.49 27.4 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.915 -178.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.3 t30 58.75 64.82 1.35 Allowed 'General case' 0 C--O 1.239 0.534 0 CA-C-O 122.819 1.295 . . . . 0.0 110.732 -176.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 107' ' ' PRO . 60.8 mt -99.67 158.95 15.41 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 113.272 -1.786 . . . . 0.0 110.07 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 -72.7 35.26 0.07 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.806 1.242 . . . . 0.0 112.608 -177.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 40.3 m -157.3 159.71 37.82 Favored 'General case' 0 C--N 1.276 -2.598 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 30.6 m -148.47 143.79 26.96 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 39.7 mm . . . . . 0 C--N 1.311 -1.091 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.316 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 5.4 m . . . . . 0 N--CA 1.421 -1.893 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.8 p -73.68 156.26 38.13 Favored 'General case' 0 C--O 1.253 1.267 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -84.1 70.21 10.48 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.9 t -153.14 163.34 40.04 Favored 'General case' 0 N--CA 1.419 -1.996 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -178.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 78.2 mt -129.15 119.01 19.51 Favored Pre-proline 0 C--N 1.301 -1.539 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.26 144.18 72.34 Favored 'Cis proline' 0 C--O 1.246 0.878 0 C-N-CA 123.921 -1.283 . . . . 0.0 112.417 -1.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -71.45 133.74 23.11 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.1 1.866 . . . . 0.0 111.459 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.3 mm -92.01 113.58 27.58 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 178.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.2 t . . . . . 0 N--CA 1.41 -2.442 0 C-N-CA 118.771 -1.171 . . . . 0.0 111.872 -172.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.9 m . . . . . 0 N--CA 1.415 -2.186 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -106.75 120.37 41.81 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.42 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.3 mp -114.51 143.8 23.46 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.631 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 -178.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.504 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 39.1 ptt180 -66.79 116.54 7.79 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -67.51 -15.54 19.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.363 -173.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -84.5 -9.74 58.08 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.6 -177.493 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 7.7 pt20 -87.23 -20.68 26.58 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 118.963 -1.095 . . . . 0.0 108.157 176.207 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.404 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.7 mm? -89.25 -5.24 57.78 Favored 'General case' 0 CA--C 1.474 -1.959 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.203 179.401 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -53.31 -31.99 46.74 Favored 'General case' 0 C--O 1.209 -1.061 0 O-C-N 124.525 1.141 . . . . 0.0 111.101 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 42.7 t-80 -67.23 -58.33 5.03 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.774 -0.371 . . . . 0.0 110.122 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -54.1 -49.98 67.9 Favored 'General case' 0 C--O 1.22 -0.451 0 O-C-N 123.752 0.657 . . . . 0.0 109.71 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -50.18 -58.66 5.09 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 124.579 1.151 . . . . 0.0 112.321 174.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -67.85 -43.46 79.42 Favored 'General case' 0 C--O 1.208 -1.118 0 O-C-N 121.992 -0.443 . . . . 0.0 112.136 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 28.7 m80 -66.21 -26.22 67.28 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.418 ' CD1' ' HB2' ' A' ' 103' ' ' ALA . 98.7 mt -88.58 -28.32 20.79 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 176.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.463 HG22 HG11 ' A' ' 96' ' ' VAL . 66.1 p -86.31 -11.69 51.49 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 119.305 -0.958 . . . . 0.0 111.341 178.222 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.5 p -89.08 121.88 31.85 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 . . . . . 0 N--CA 1.423 -1.796 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 168.898 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.435 -1.198 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -79.75 -43.6 22.27 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.2 m -57.64 -33.26 68.1 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 123.702 0.626 . . . . 0.0 110.562 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 51.0 mt -84.52 -50.77 7.43 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.734 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.4 t -62.56 -49.56 74.81 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 123.243 0.617 . . . . 0.0 111.574 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.472 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 33.0 t -58.3 -38.62 77.42 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 122.597 0.359 . . . . 0.0 110.115 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.56 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 7.5 t30 -73.35 -29.97 63.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.317 0.58 . . . . 0.0 110.686 -177.146 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -77.15 -43.61 33.33 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.277 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.491 HD22 HD11 ' A' ' 75' ' ' ILE . 3.5 pp -72.23 -34.18 68.12 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.514 -177.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -70.65 -12.97 61.89 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -176.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 61' ' ' ASN . 37.0 mt-10 -84.5 -8.95 58.76 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-O 121.643 0.735 . . . . 0.0 110.294 177.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.405 HG12 ' HB2' ' A' ' 70' ' ' CYS . 39.9 t -83.92 163.23 2.92 Favored 'Isoleucine or valine' 0 C--O 1.247 0.971 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 173.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.464 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.1 mt-10 -51.51 142.69 13.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.072 0.549 . . . . 0.0 111.36 177.333 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -56.91 -33.79 67.3 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -175.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.44 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 19.7 pt20 -78.96 -21.3 47.36 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 121.381 0.61 . . . . 0.0 110.42 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.44 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 49.7 m -100.4 -11.02 20.58 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.473 -174.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 74.2 mt-30 -59.21 -43.81 92.29 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 123.241 0.617 . . . . 0.0 110.881 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.474 ' HA ' HG12 ' A' ' 75' ' ' ILE . 10.9 p -78.32 -23.39 47.07 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 120.258 -0.577 . . . . 0.0 111.728 177.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -68.37 -34.08 75.41 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.472 0.653 . . . . 0.0 110.323 177.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.67 -27.83 66.74 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.367 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.55 HG21 ' HD3' ' A' ' 107' ' ' PRO . 28.9 mm -71.64 -34.96 54.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.973 -178.098 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -64.29 -44.73 90.76 Favored 'General case' 0 C--O 1.249 1.052 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.8 mt-30 -58.28 -45.52 87.75 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 112.682 -2.054 . . . . 0.0 110.914 -176.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.404 HG22 ' HB3' ' A' ' 29' ' ' LEU . 19.6 t -52.45 -44.87 45.08 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.954 0 O-C-N 124.103 0.877 . . . . 0.0 110.06 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.19 -48.88 71.84 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -174.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.97 -39.26 94.15 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.632 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 20.2 pt20 -78.66 -32.65 47.29 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 120.751 0.31 . . . . 0.0 111.698 -179.014 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.6 -35.06 60.63 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.105 0.479 . . . . 0.0 111.642 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -76.03 -36.0 59.27 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.373 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.7 -32.2 65.57 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.059 -176.626 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 17.7 pt20 -69.4 -38.15 77.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.038 0.447 . . . . 0.0 110.176 -178.502 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.512 ' HG ' HG21 ' A' ' 96' ' ' VAL . 3.7 mm? -74.91 -33.34 61.99 Favored 'General case' 0 C--O 1.246 0.903 0 CA-C-O 121.074 0.464 . . . . 0.0 110.713 178.272 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -60.0 -43.59 95.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.948 -1.023 . . . . 0.0 110.511 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -88.92 -2.45 58.6 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.773 -176.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -98.57 -82.09 1.64 Allowed Glycine 0 N--CA 1.425 -2.053 0 CA-C-N 115.424 -0.807 . . . . 0.0 113.041 -177.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -134.95 -23.4 1.54 Allowed 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -172.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 132.98 -127.89 4.92 Favored Glycine 0 CA--C 1.473 -2.556 0 N-CA-C 105.966 -2.854 . . . . 0.0 105.966 -170.077 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.542 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 78.86 -20.66 4.36 Favored Glycine 0 C--O 1.192 -2.487 0 CA-C-N 118.605 1.202 . . . . 0.0 114.151 174.376 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.415 ' HG3' ' H ' ' A' ' 93' ' ' GLN . 13.9 mt-30 -50.73 -37.95 44.63 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 125.551 1.541 . . . . 0.0 110.71 -175.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -78.57 -37.6 42.27 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.843 -178.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.542 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 10.5 pt20 -81.02 -42.55 20.93 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.345 0.593 . . . . 0.0 110.025 -178.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.512 HG21 ' HG ' ' A' ' 86' ' ' LEU . 90.3 t -63.96 -24.57 36.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 CA-C-N 114.823 -1.081 . . . . 0.0 110.205 177.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.429 ' HA ' HG12 ' A' ' 100' ' ' VAL . 28.3 tt0 -49.0 -44.5 41.28 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.05 0.54 . . . . 0.0 112.003 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 13.9 pt20 -69.4 -17.84 63.7 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -176.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 7.3 tpt -98.87 -47.18 5.38 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.429 HG12 ' HA ' ' A' ' 97' ' ' GLN . 14.6 p -62.76 -25.0 37.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.396 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -20.17 65.4 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.644 -0.66 . . . . 0.0 112.089 175.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -66.41 -28.59 68.74 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.483 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -64.25 -24.41 67.65 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-O 121.353 0.597 . . . . 0.0 110.562 178.117 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -75.17 -16.4 60.51 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.526 0.679 . . . . 0.0 110.38 -179.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' MET . . . . . 0.459 ' O ' ' HG2' ' A' ' 109' ' ' GLN . 46.0 mtt -88.18 -14.91 37.42 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.423 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.483 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 93.4 mt -49.46 -49.96 68.35 Favored Pre-proline 0 C--N 1.322 -0.589 0 O-C-N 123.654 0.596 . . . . 0.0 112.537 -177.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.55 ' HD3' HG21 ' A' ' 75' ' ' ILE . 20.8 Cg_endo -62.22 -23.97 75.79 Favored 'Trans proline' 0 C--N 1.365 1.421 0 C-N-CA 121.734 1.623 . . . . 0.0 113.267 177.405 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -82.75 -45.67 14.09 Favored 'General case' 0 N--CA 1.417 -2.119 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.459 ' HG2' ' O ' ' A' ' 105' ' ' MET . 10.6 mm100 -74.15 -39.15 63.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.958 -175.506 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 10.2 t -86.16 -3.62 59.0 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -177.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 58.33 61.79 2.18 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 124.701 1.2 . . . . 0.0 109.884 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.445 ' C ' ' H ' ' A' ' 114' ' ' CYS . 52.7 mt -94.59 160.16 14.76 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.591 -178.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -67.2 30.66 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.494 0 C-N-CA 124.935 1.294 . . . . 0.0 113.218 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.445 ' H ' ' C ' ' A' ' 112' ' ' LEU . 67.7 m -155.25 143.77 20.44 Favored 'General case' 0 C--N 1.274 -2.69 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -176.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 38.0 m -133.08 116.9 16.9 Favored 'General case' 0 C--N 1.286 -2.16 0 CA-C-O 120.873 0.368 . . . . 0.0 110.152 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.9 mm . . . . . 0 C--N 1.31 -1.126 0 N-CA-C 107.035 -1.469 . . . . 0.0 107.035 178.368 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.795 ' SG ' ' HB2' ' A' ' 9' ' ' PRO . 4.0 t . . . . . 0 N--CA 1.434 -1.231 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.5 p -85.47 157.2 20.52 Favored 'General case' 0 C--N 1.283 -2.312 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.304 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -87.74 76.58 8.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 177.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.7 m -147.41 160.26 42.76 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.153 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 69.4 mt -129.54 111.6 17.75 Favored Pre-proline 0 C--N 1.309 -1.156 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -73.65 143.83 79.08 Favored 'Cis proline' 0 C--O 1.241 0.648 0 C-N-CA 124.362 -1.099 . . . . 0.0 111.78 -0.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.795 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 74.5 Cg_endo -72.75 155.9 53.55 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.586 2.191 . . . . 0.0 112.681 -178.114 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.8 mm -110.96 112.0 38.65 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.493 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 64.6 m . . . . . 0 C--N 1.298 -1.653 0 C-N-CA 119.124 -1.03 . . . . 0.0 110.285 -174.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 N--CA 1.415 -2.188 0 CA-C-O 121.139 0.495 . . . . 0.0 110.487 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 -106.92 103.28 12.66 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.415 177.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.408 HG21 ' HB2' ' A' ' 74' ' ' ALA . 2.9 mp -108.54 132.34 56.7 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.557 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 -179.069 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.47 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 18.9 ptt-85 -67.42 121.42 15.73 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 123.799 0.687 . . . . 0.0 110.607 -177.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -64.58 -15.81 18.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.403 ' HG2' ' HB2' ' A' ' 25' ' ' ARG . 20.9 pt20 -75.56 -8.89 57.91 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.523 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.596 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 1.4 pt20 -98.49 -18.2 18.33 Favored 'General case' 0 N--CA 1.42 -1.959 0 C-N-CA 118.861 -1.136 . . . . 0.0 109.989 178.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -99.33 -3.84 33.07 Favored 'General case' 0 CA--C 1.476 -1.874 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.68 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.478 ' O ' ' HG2' ' A' ' 34' ' ' MET . 26.7 p30 -54.24 -32.24 55.5 Favored 'General case' 0 C--N 1.311 -1.1 0 O-C-N 124.022 0.826 . . . . 0.0 112.938 -178.454 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -68.8 -56.82 6.8 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.455 ' HB3' HG11 ' A' ' 78' ' ' VAL . 1.2 m -55.35 -49.82 71.25 Favored 'General case' 0 C--O 1.213 -0.827 0 O-C-N 123.869 0.731 . . . . 0.0 110.172 178.531 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -51.93 -57.2 10.13 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 123.489 0.716 . . . . 0.0 112.425 176.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 26.3 ptt? -68.31 -41.44 80.85 Favored 'General case' 0 CA--C 1.507 -0.709 0 C-N-CA 120.242 -0.583 . . . . 0.0 112.418 -174.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -72.05 -24.41 61.52 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.436 ' O ' ' HB3' ' A' ' 99' ' ' MET . 99.3 mt -88.65 -21.76 23.79 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 119.916 -0.713 . . . . 0.0 111.988 177.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.465 ' HA ' HG13 ' A' ' 96' ' ' VAL . 32.1 p -85.73 -21.15 28.4 Favored 'General case' 0 C--N 1.298 -1.651 0 C-N-CA 118.177 -1.409 . . . . 0.0 111.548 176.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.8 m -89.8 122.97 33.38 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.648 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 . . . . . 0 N--CA 1.437 -1.108 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 171.349 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 . . . . . 0 N--CA 1.441 -0.922 0 CA-C-O 121.102 0.477 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.83 -44.12 56.63 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 176.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.0 m -56.43 -34.72 67.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.069 0.461 . . . . 0.0 110.317 177.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 45.9 mt -78.49 -51.55 9.83 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.233 0.54 . . . . 0.0 110.838 178.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.9 t -63.57 -49.75 72.19 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.417 1.087 . . . . 0.0 111.076 -176.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.483 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 12.8 t -58.02 -37.99 75.35 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.613 0.765 . . . . 0.0 110.479 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -75.31 -25.05 57.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.514 0.673 . . . . 0.0 110.789 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.596 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 8.2 tp-100 -83.22 -42.91 16.7 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.321 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.483 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 4.0 pp -68.92 -28.29 66.53 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.609 0.718 . . . . 0.0 110.572 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.444 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 12.0 pt20 -75.77 -6.83 52.51 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.265 -177.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -84.03 -11.75 56.26 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-O 121.721 0.772 . . . . 0.0 109.12 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 12.4 t -89.25 164.5 2.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 CA-C-N 114.902 -1.045 . . . . 0.0 108.767 177.129 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -46.79 144.49 2.35 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.628 0.771 . . . . 0.0 111.031 173.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.539 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -61.3 -33.47 73.64 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.017 1.118 . . . . 0.0 114.017 -176.348 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.458 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 28.4 pt20 -75.53 -25.12 56.92 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.764 0.792 . . . . 0.0 110.004 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.458 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 60.1 m -94.27 -13.63 26.32 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.099 -174.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.539 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 54.3 mt-30 -56.87 -43.86 81.63 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 121.211 0.529 . . . . 0.0 110.202 175.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.476 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.8 p -79.9 -23.81 41.57 Favored 'General case' 0 N--CA 1.435 -1.213 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.414 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -68.88 -32.0 71.34 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.251 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 77' ' ' GLN . . . -62.28 -26.17 68.25 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 123.59 0.756 . . . . 0.0 110.183 177.744 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.527 HG21 ' HD3' ' A' ' 107' ' ' PRO . 31.0 mm -72.63 -31.2 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.356 -178.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -72.66 -40.81 66.05 Favored 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -175.36 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 53.2 mm-40 -57.6 -42.33 83.02 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 112.256 -2.247 . . . . 0.0 110.927 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.455 HG11 ' HB3' ' A' ' 32' ' ' CYS . 23.4 t -58.94 -46.49 91.39 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.79 0 O-C-N 123.833 0.708 . . . . 0.0 109.255 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.424 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 19.7 t -69.17 -42.24 81.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -58.88 -48.4 81.53 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.677 -178.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 9.1 pt20 -76.26 -35.55 58.89 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 123.122 0.264 . . . . 0.0 111.386 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.412 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -69.97 -35.92 74.81 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.901 0.381 . . . . 0.0 111.681 -178.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 28.9 pt20 -79.06 -35.46 42.48 Favored 'General case' 0 C--N 1.308 -1.215 0 C-N-CA 118.798 -1.161 . . . . 0.0 110.537 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.46 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -69.39 -30.16 68.08 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.097 -177.314 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -71.35 -37.99 71.66 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 121.216 0.531 . . . . 0.0 109.621 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.496 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 2.6 mm? -78.44 -35.45 46.82 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.471 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 52.4 tp60 -58.16 -43.39 87.38 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.222 0.609 . . . . 0.0 111.547 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.1 pt20 -81.85 -14.42 56.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.311 0.577 . . . . 0.0 110.141 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -84.87 -88.82 0.87 Allowed Glycine 0 N--CA 1.428 -1.848 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.262 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -125.79 -18.34 5.18 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.28 0.562 . . . . 0.0 111.873 -175.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.496 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 127.45 -104.2 0.68 Allowed Glycine 0 CA--C 1.476 -2.355 0 N-CA-C 106.713 -2.555 . . . . 0.0 106.713 -171.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.408 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 75.33 -32.21 1.15 Allowed Glycine 0 C--O 1.196 -2.247 0 N-CA-C 115.634 1.013 . . . . 0.0 115.634 170.045 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -47.36 -34.27 6.77 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.504 1.122 . . . . 0.0 112.291 -178.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -68.91 -45.08 71.8 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.528 178.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 11.9 pt20 -82.93 -47.18 12.07 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 121.074 0.464 . . . . 0.0 110.171 -176.156 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.465 HG13 ' HA ' ' A' ' 37' ' ' THR . 91.5 t -59.41 -22.69 23.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 125.66 1.584 . . . . 0.0 110.224 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -43.02 -45.12 5.02 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.165 0.986 . . . . 0.0 112.67 178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 13.6 pt20 -68.63 -17.77 64.17 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 7.7 tpt -101.96 -47.34 4.6 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.8 p -65.05 -24.13 34.79 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 120.831 0.348 . . . . 0.0 111.354 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.413 ' HG3' ' N ' ' A' ' 102' ' ' LYS . 15.2 ptpt -62.3 -24.82 67.52 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.748 -0.595 . . . . 0.0 110.956 174.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.413 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 26.3 mtpp -63.55 -30.9 71.95 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.49 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -59.9 -38.72 83.06 Favored 'General case' 0 C--O 1.204 -1.34 0 O-C-N 123.722 0.638 . . . . 0.0 109.861 176.09 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.45 ' HB3' HG21 ' A' ' 116' ' ' ILE . 41.2 mt-30 -72.79 -16.9 61.62 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.632 -177.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 43.4 mtt -82.23 -21.2 36.47 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.879 -0.513 . . . . 0.0 110.517 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 7.5 mp -47.43 -46.59 58.59 Favored Pre-proline 0 N--CA 1.481 1.076 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.527 ' HD3' HG21 ' A' ' 75' ' ' ILE . 18.8 Cg_endo -62.3 -22.38 74.03 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 120.897 1.356 . . . . 0.0 112.871 178.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 61.7 m-80 -89.35 -42.79 11.35 Favored 'General case' 0 N--CA 1.403 -2.799 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -73.56 -36.74 65.64 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.831 -177.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.404 ' SG ' HD21 ' A' ' 112' ' ' LEU . 16.1 t -89.94 -3.8 57.84 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 60.3 t30 55.43 63.4 2.1 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 124.779 1.232 . . . . 0.0 110.276 -177.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.419 HD21 HD11 ' A' ' 63' ' ' LEU . 52.4 mt -93.28 159.75 15.13 Favored 'General case' 0 C--N 1.284 -2.276 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.305 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -70.43 35.03 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.392 1.077 . . . . 0.0 113.405 -175.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 72' ' ' CYS . 57.4 m -158.02 156.4 31.05 Favored 'General case' 0 C--N 1.284 -2.249 0 C-N-CA 125.171 1.388 . . . . 0.0 107.284 -175.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 42.1 m -142.46 120.95 12.45 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.45 HG21 ' HB3' ' A' ' 104' ' ' GLN . 67.7 mt . . . . . 0 C--N 1.299 -1.619 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 N--CA 1.443 -0.82 0 CA-C-O 120.58 0.229 . . . . 0.0 110.46 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 43.2 p -90.29 158.06 17.36 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 175.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -87.26 72.0 9.93 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.0 p -145.73 159.42 43.19 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 75.3 mt -128.83 117.24 19.38 Favored Pre-proline 0 C--N 1.299 -1.598 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -71.49 146.35 85.12 Favored 'Cis proline' 0 C--O 1.242 0.694 0 C-N-CA 124.109 -1.205 . . . . 0.0 112.3 0.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -71.97 145.83 45.94 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.619 2.213 . . . . 0.0 113.083 -177.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.6 mm -96.2 108.78 21.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.7 m . . . . . 0 C--N 1.295 -1.79 0 CA-C-O 121.473 0.654 . . . . 0.0 112.271 -175.999 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.466 ' SG ' ' HG3' ' A' ' 73' ' ' GLU . 95.2 m . . . . . 0 N--CA 1.405 -2.694 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -106.2 113.06 26.36 Favored 'General case' 0 C--N 1.288 -2.099 0 CA-C-O 122.036 0.922 . . . . 0.0 108.82 173.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.442 HD11 ' HB2' ' A' ' 73' ' ' GLU . 3.3 mp -106.94 146.08 13.72 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.504 0 CA-C-N 114.116 -1.402 . . . . 0.0 107.785 -174.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.469 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 34.2 ptt180 -65.64 120.16 12.44 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-O 121.551 0.691 . . . . 0.0 109.171 -178.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 pp -69.88 -15.98 19.84 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.466 -175.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -71.67 -23.21 61.62 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.488 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.497 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 6.9 pt20 -83.83 -18.8 36.37 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.587 -178.055 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -94.31 -4.06 49.36 Favored 'General case' 0 CA--C 1.48 -1.719 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.236 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.529 ' O ' ' HG2' ' A' ' 34' ' ' MET . 41.9 t30 -57.15 -32.02 65.96 Favored 'General case' 0 C--N 1.317 -0.816 0 O-C-N 123.89 0.744 . . . . 0.0 110.646 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -69.53 -53.74 17.54 Favored 'General case' 0 C--O 1.221 -0.406 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.418 ' HB3' HG11 ' A' ' 78' ' ' VAL . 0.4 OUTLIER -55.61 -51.69 66.3 Favored 'General case' 0 C--O 1.222 -0.393 0 O-C-N 123.605 0.566 . . . . 0.0 109.832 178.778 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -51.77 -56.58 13.02 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 123.899 0.88 . . . . 0.0 112.468 176.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.529 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 26.6 ptm -69.92 -42.87 72.75 Favored 'General case' 0 CA--C 1.504 -0.81 0 C-N-CA 119.967 -0.693 . . . . 0.0 112.263 -174.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -67.35 -27.12 66.86 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.916 -175.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 94.8 mt -88.63 -28.48 20.62 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 112.17 0.434 . . . . 0.0 112.17 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.518 ' HA ' HG13 ' A' ' 96' ' ' VAL . 35.2 p -84.64 -21.67 30.18 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 118.233 -1.387 . . . . 0.0 111.451 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.8 p -91.36 121.65 33.28 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 . . . . . 0 C--N 1.3 -1.584 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 166.889 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 . . . . . 0 N--CA 1.434 -1.228 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -70.3 -44.89 67.41 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 175.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 51.0 m -57.37 -36.3 71.06 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 123.563 0.54 . . . . 0.0 110.574 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.9 mt -80.85 -53.19 6.69 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.627 -178.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 19.6 t -66.2 -48.34 70.95 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.198 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.502 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 32.8 t -58.46 -34.23 70.63 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 117.868 0.304 . . . . 0.0 110.653 176.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -76.41 -24.68 54.02 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.626 0.727 . . . . 0.0 110.6 -178.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.497 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 6.1 tp-100 -85.58 -46.88 10.39 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.639 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.541 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -64.27 -31.61 72.88 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.673 -177.417 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.417 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 7.3 pt20 -70.87 -10.28 59.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.641 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -75.87 -21.07 57.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 122.062 0.934 . . . . 0.0 108.841 176.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.468 HG12 ' HB2' ' A' ' 70' ' ' CYS . 8.9 t -82.26 163.61 3.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 176.332 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.59 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 31.9 mt-10 -54.84 144.07 23.8 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-O 119.268 -0.396 . . . . 0.0 110.695 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.437 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 18.1 ptpt -57.8 -31.78 66.9 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.325 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -77.18 -20.17 55.79 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.075 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.468 ' HB2' HG12 ' A' ' 66' ' ' VAL . 63.0 m -103.97 -10.67 17.94 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.866 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.59 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 78.5 mt-30 -62.82 -37.76 88.03 Favored 'General case' 0 C--O 1.217 -0.637 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.498 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.8 p -80.96 -24.51 38.03 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.549 176.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.466 ' HG3' ' SG ' ' A' ' 22' ' ' CYS . 8.4 mm-40 -67.22 -36.1 80.97 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 177.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.412 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -61.1 -28.5 69.13 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 123.577 0.751 . . . . 0.0 110.645 178.174 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.541 HD11 HD22 ' A' ' 63' ' ' LEU . 31.5 mm -69.68 -37.51 74.16 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.598 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -65.55 -41.11 93.36 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -177.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.465 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.8 mt-30 -61.03 -38.63 86.82 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 113.505 -1.68 . . . . 0.0 110.621 -178.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.418 HG11 ' HB3' ' A' ' 32' ' ' CYS . 20.8 t -61.11 -44.58 98.58 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.906 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 29.0 t -65.63 -47.77 84.99 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.894 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -174.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -58.68 -50.63 73.15 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.68 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 11.0 pt20 -71.82 -31.72 66.83 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.835 0.35 . . . . 0.0 111.886 -177.022 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.72 -38.23 54.67 Favored 'General case' 0 C--N 1.315 -0.908 0 O-C-N 122.131 -0.356 . . . . 0.0 111.307 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -72.95 -34.08 66.3 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.357 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.551 ' O ' ' HG2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -70.67 -38.12 73.74 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.46 -178.156 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -68.07 -37.97 81.87 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.136 -175.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.479 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.6 mm? -76.64 -33.73 58.33 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.872 178.21 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.417 ' HB2' ' NE2' ' A' ' 93' ' ' GLN . 61.9 tt0 -64.85 -37.3 87.16 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.252 0.549 . . . . 0.0 110.509 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 84' ' ' LYS . 4.6 pt20 -90.49 0.33 57.36 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.667 0.746 . . . . 0.0 110.422 178.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -99.29 -100.6 2.26 Favored Glycine 0 N--CA 1.421 -2.337 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.896 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -118.18 -5.88 10.89 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.008 0.432 . . . . 0.0 112.025 -174.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.479 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 116.57 -101.37 0.97 Allowed Glycine 0 CA--C 1.468 -2.867 0 N-CA-C 106.825 -2.51 . . . . 0.0 106.825 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.466 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 72.4 -34.81 0.67 Allowed Glycine 0 C--O 1.196 -2.229 0 N-CA-C 116.082 1.193 . . . . 0.0 116.082 170.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.417 ' NE2' ' HB2' ' A' ' 87' ' ' GLN . 90.8 mt-30 -46.53 -34.25 4.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 118.322 1.061 . . . . 0.0 112.866 -176.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -71.41 -42.19 68.63 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 120.982 0.42 . . . . 0.0 111.449 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 92' ' ' GLY . 20.5 pt20 -82.83 -47.88 11.39 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 -176.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.518 HG13 ' HA ' ' A' ' 37' ' ' THR . 80.7 t -59.04 -22.83 22.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 125.461 1.504 . . . . 0.0 110.725 178.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -44.48 -46.15 9.56 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 123.562 0.745 . . . . 0.0 112.502 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -67.57 -18.02 64.85 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -176.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.8 tpt -102.29 -48.24 4.25 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.0 p -63.72 -24.09 34.96 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 CA-C-O 121.06 0.457 . . . . 0.0 111.183 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -21.02 66.59 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.703 -0.623 . . . . 0.0 111.539 176.228 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -67.33 -27.89 67.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 176.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.454 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -62.99 -32.11 73.38 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 121.599 0.714 . . . . 0.0 109.807 175.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -74.4 -15.46 60.92 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.645 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 61.2 mtp -90.33 -18.29 25.81 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.793 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.454 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 96.4 mt -50.25 -51.23 65.0 Favored Pre-proline 0 C--N 1.323 -0.544 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -176.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.511 ' HD3' HG21 ' A' ' 75' ' ' ILE . 18.0 Cg_endo -60.79 -24.92 80.13 Favored 'Trans proline' 0 C--N 1.362 1.282 0 C-N-CA 121.73 1.62 . . . . 0.0 113.169 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -84.47 -41.0 17.03 Favored 'General case' 0 N--CA 1.414 -2.251 0 CA-C-O 121.157 0.503 . . . . 0.0 109.822 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -80.37 -37.32 32.58 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.123 -176.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.415 ' SG ' HD21 ' A' ' 112' ' ' LEU . 24.2 t -84.38 -6.04 59.34 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.199 0.524 . . . . 0.0 109.693 -178.229 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 57.45 65.03 1.43 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 122.989 1.376 . . . . 0.0 110.784 -177.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.42 HD21 HD11 ' A' ' 63' ' ' LEU . 41.9 mt -93.67 159.41 15.23 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 113.272 -1.785 . . . . 0.0 109.363 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -75.88 35.79 0.13 Allowed 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 121.658 0.742 . . . . 0.0 112.094 -174.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.401 ' H ' ' C ' ' A' ' 112' ' ' LEU . 78.7 m -154.0 149.06 26.82 Favored 'General case' 0 C--N 1.285 -2.23 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 -176.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 25.7 p -136.1 132.38 36.04 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 118.114 0.416 . . . . 0.0 110.189 -176.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 26.6 mm . . . . . 0 C--N 1.308 -1.205 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 178.738 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 58.3 m . . . . . 0 N--CA 1.42 -1.972 0 CA-C-O 121.002 0.43 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.9 p -71.27 151.11 44.55 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.773 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -79.12 72.0 5.65 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.359 0.6 . . . . 0.0 110.355 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.9 t -149.08 163.92 36.17 Favored 'General case' 0 N--CA 1.419 -2.02 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.3 mt -129.75 118.82 18.87 Favored Pre-proline 0 C--N 1.304 -1.391 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.407 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -75.32 140.93 69.67 Favored 'Cis proline' 0 C--O 1.243 0.727 0 C-N-CA 123.809 -1.329 . . . . 0.0 110.876 -1.159 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.416 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 43.7 Cg_endo -67.08 152.01 80.76 Favored 'Trans proline' 0 C--O 1.244 0.79 0 C-N-CA 122.954 2.436 . . . . 0.0 113.21 -175.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.7 mm -102.81 118.26 49.45 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 75.8 m . . . . . 0 C--N 1.29 -1.983 0 CA-C-O 121.62 0.724 . . . . 0.0 111.625 -176.807 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.7 m . . . . . 0 N--CA 1.416 -2.153 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -99.95 91.74 4.95 Favored 'General case' 0 N--CA 1.422 -1.831 0 CA-C-O 122.439 1.114 . . . . 0.0 110.978 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.409 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 3.5 mp -94.14 138.39 20.67 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.818 0 N-CA-C 105.328 -2.101 . . . . 0.0 105.328 177.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.463 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.5 ptt-85 -71.66 120.54 17.39 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.057 0.456 . . . . 0.0 110.0 -176.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -63.53 -16.31 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-O 121.288 0.566 . . . . 0.0 112.236 -176.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -77.14 -17.74 58.4 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.62 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.463 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.6 pt20 -86.62 -29.2 22.74 Favored 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 119.401 -0.919 . . . . 0.0 108.544 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -85.11 -7.79 58.93 Favored 'General case' 0 CA--C 1.473 -2.004 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.491 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 34' ' ' MET . 8.6 t30 -54.12 -34.84 61.32 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 124.335 1.022 . . . . 0.0 110.889 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -69.06 -55.12 11.74 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -52.29 -53.74 40.27 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 125.114 1.366 . . . . 0.0 108.347 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -49.55 -61.34 2.16 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 126.101 1.76 . . . . 0.0 112.45 175.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.3 ptm -69.82 -28.69 65.91 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -173.468 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.624 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 3.0 t-80 -72.48 -25.72 61.53 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-O 121.139 0.495 . . . . 0.0 109.834 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.5 mt -88.52 -32.17 18.33 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.41 177.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.492 ' HA ' HG13 ' A' ' 96' ' ' VAL . 58.9 p -82.75 -22.14 34.45 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 118.622 -1.231 . . . . 0.0 111.785 -178.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.8 t -90.94 127.73 36.51 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.256 0.551 . . . . 0.0 111.934 -178.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 . . . . . 0 N--CA 1.423 -1.791 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 171.16 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.624 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.212 -0.906 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.3 tp -72.22 -52.03 18.33 Favored 'General case' 0 CA--C 1.489 -1.403 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.0 m -59.23 -21.76 60.05 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.614 -176.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 41.1 mt -89.76 -57.66 2.79 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.014 175.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 52.2 t -64.39 -50.51 67.39 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.155 0.982 . . . . 0.0 112.372 -175.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.547 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 12.1 t -59.23 -39.68 83.52 Favored 'General case' 0 CA--C 1.495 -1.145 0 CA-C-O 121.613 0.721 . . . . 0.0 109.281 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.425 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 27.9 t-20 -70.77 -28.03 64.36 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.956 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -81.13 -42.56 20.73 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.325 0.583 . . . . 0.0 110.446 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.547 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.7 pp -72.25 -31.65 65.99 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.908 -176.611 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.425 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 17.6 pt20 -68.9 -15.16 63.42 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.711 -176.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -81.7 -22.67 37.28 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.309 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.7 t -70.75 161.65 4.54 Favored 'Isoleucine or valine' 0 C--O 1.249 1.026 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.438 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.3 mt-10 -50.09 140.63 12.29 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 123.417 0.687 . . . . 0.0 112.298 178.061 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -55.17 -33.31 62.86 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.111 0.564 . . . . 0.0 112.471 -177.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.417 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 13.9 pt20 -81.9 -7.35 59.6 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.068 0.461 . . . . 0.0 110.576 -178.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.417 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 61.3 m -117.5 -11.28 10.51 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -174.493 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.536 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 75.9 mt-30 -57.96 -48.54 79.64 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.258 0.623 . . . . 0.0 112.03 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.408 ' HA ' HG12 ' A' ' 75' ' ' ILE . 14.7 p -74.82 -23.12 58.42 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.804 -0.759 . . . . 0.0 112.145 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -68.3 -32.54 72.75 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.613 0.721 . . . . 0.0 109.614 178.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.43 -28.75 67.24 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.704 177.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.561 HG21 ' HD3' ' A' ' 107' ' ' PRO . 27.8 mm -70.98 -32.95 50.03 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -176.249 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -66.46 -44.14 83.58 Favored 'General case' 0 CA--C 1.491 -1.32 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 -177.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.515 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.3 mt-30 -59.16 -46.22 88.95 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 113.103 -1.862 . . . . 0.0 110.349 -177.25 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 74' ' ' ALA . 19.6 t -53.42 -44.7 56.08 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 O-C-N 124.211 0.944 . . . . 0.0 110.138 -179.015 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 75' ' ' ILE . 26.1 t -70.12 -45.04 77.5 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -175.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -60.04 -52.58 64.75 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.678 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 20.7 pt20 -70.61 -31.76 68.86 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.855 -176.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.465 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -72.11 -41.46 67.21 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.76 0.314 . . . . 0.0 111.193 178.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -72.1 -37.84 69.47 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 119.99 -0.684 . . . . 0.0 110.089 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.451 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -68.77 -32.34 72.01 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -178.097 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 1.7 pt20 -71.19 -28.84 64.51 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 121.683 0.754 . . . . 0.0 109.755 -177.096 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.604 HD12 ' HA3' ' A' ' 92' ' ' GLY . 3.7 mm? -86.29 -37.28 18.7 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.965 176.039 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -58.18 -36.45 73.07 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.925 1.29 . . . . 0.0 111.333 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -80.19 -9.89 59.74 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-O 121.018 0.437 . . . . 0.0 111.302 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -113.82 -115.57 3.21 Favored Glycine 0 N--CA 1.43 -1.732 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.017 -177.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -71.24 -43.26 67.62 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 124.198 0.999 . . . . 0.0 111.371 -174.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.536 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 142.68 -85.95 0.19 Allowed Glycine 0 CA--C 1.478 -2.224 0 N-CA-C 107.007 -2.437 . . . . 0.0 107.007 -171.618 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.604 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 74.18 -44.55 1.36 Allowed Glycine 0 C--O 1.199 -2.08 0 N-CA-C 115.531 0.972 . . . . 0.0 115.531 171.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.466 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 50.9 mt-30 -44.37 -30.94 0.92 Allowed 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 125.292 1.437 . . . . 0.0 113.677 -176.544 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -75.88 -41.3 52.54 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 120.819 0.342 . . . . 0.0 111.321 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -85.51 -43.88 13.17 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.62 0.724 . . . . 0.0 110.227 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.492 HG13 ' HA ' ' A' ' 37' ' ' THR . 75.9 t -63.81 -22.72 31.62 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 C-N-CA 125.781 1.632 . . . . 0.0 110.547 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 64.5 tt0 -45.48 -45.65 13.22 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.478 0.711 . . . . 0.0 112.844 -178.135 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -67.25 -21.97 65.71 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -177.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.9 tpt -94.94 -49.55 5.51 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -176.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.9 p -61.51 -28.31 43.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.813 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -24.45 65.21 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 177.613 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -62.46 -38.03 88.22 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.507 ' HA ' HD13 ' A' ' 106' ' ' LEU . . . -52.07 -35.55 47.91 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.581 178.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -68.14 -17.25 64.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.134 0.492 . . . . 0.0 111.239 -178.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 40.8 mtt -91.81 -14.57 29.57 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -178.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.507 HD13 ' HA ' ' A' ' 103' ' ' ALA . 6.9 mp -53.16 -45.49 98.25 Favored Pre-proline 0 C--O 1.207 -1.182 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.561 ' HD3' HG21 ' A' ' 75' ' ' ILE . 19.6 Cg_endo -61.52 -26.49 80.88 Favored 'Trans proline' 0 C--N 1.358 1.07 0 CA-C-N 121.067 1.417 . . . . 0.0 112.125 176.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -83.51 -42.87 16.38 Favored 'General case' 0 N--CA 1.417 -2.124 0 CA-C-O 121.277 0.56 . . . . 0.0 110.277 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -79.92 -38.89 31.48 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -176.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 19.6 t -80.77 -5.73 57.55 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 45.4 t30 64.32 58.82 1.07 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 122.952 1.358 . . . . 0.0 109.873 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 49.5 mt -100.23 158.43 15.87 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-N 113.536 -1.666 . . . . 0.0 108.228 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -82.83 45.53 1.01 Allowed 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.62 0.724 . . . . 0.0 111.194 -174.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 48.7 m -157.35 160.55 38.59 Favored 'General case' 0 C--N 1.292 -1.893 0 C-N-CA 124.994 1.318 . . . . 0.0 107.889 -176.286 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.8 m -149.36 135.77 19.25 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 176.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 81.0 mt . . . . . 0 C--N 1.304 -1.402 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -178.673 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 62.7 m . . . . . 0 N--CA 1.432 -1.345 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.3 p -84.6 156.56 21.53 Favored 'General case' 0 C--N 1.296 -1.727 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -79.81 74.57 6.53 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 122.082 0.944 . . . . 0.0 109.595 174.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 47.5 t -136.92 157.72 46.1 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.101 -1.409 . . . . 0.0 107.286 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.6 mm -128.51 109.65 19.15 Favored Pre-proline 0 C--N 1.294 -1.819 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 176.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -73.97 150.81 96.17 Favored 'Cis proline' 0 C--O 1.253 1.271 0 C-N-CA 124.177 -1.176 . . . . 0.0 111.322 -3.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.417 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 57.9 Cg_endo -70.18 150.84 66.2 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.722 2.281 . . . . 0.0 113.178 -175.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.416 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 46.9 mm -97.31 114.19 33.73 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.052 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 82.3 m . . . . . 0 C--N 1.288 -2.107 0 CA-C-O 121.277 0.56 . . . . 0.0 111.522 -176.967 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 29.9 m . . . . . 0 N--CA 1.421 -1.922 0 CA-C-O 121.036 0.446 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -106.54 109.83 21.87 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-O 121.819 0.819 . . . . 0.0 108.882 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.603 ' HB ' ' OE1' ' A' ' 77' ' ' GLN . 2.7 mp -115.02 143.72 24.14 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.107 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.571 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 18.6 ptt180 -71.61 122.12 19.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.81 -13.34 16.69 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.045 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -75.72 -18.88 59.43 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.9 -178.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.571 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.4 pt20 -81.13 -16.97 51.51 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.525 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.458 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.2 mm? -96.59 2.59 52.42 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.138 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.444 ' O ' ' HG2' ' A' ' 34' ' ' MET . 28.6 t-20 -52.52 -39.27 61.17 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 124.343 1.027 . . . . 0.0 112.223 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.1 t-80 -69.2 -54.78 13.07 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.413 ' HB3' HG11 ' A' ' 78' ' ' VAL . 1.2 m -55.13 -47.25 75.32 Favored 'General case' 0 C--O 1.221 -0.418 0 O-C-N 123.467 0.48 . . . . 0.0 110.652 178.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -54.55 -55.39 29.79 Favored 'General case' 0 N--CA 1.437 -1.095 0 C-N-CA 123.457 0.703 . . . . 0.0 112.335 176.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 14.2 ptp -68.43 -41.74 79.88 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -176.26 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -70.25 -25.41 63.36 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.057 -175.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.451 ' O ' ' HB3' ' A' ' 99' ' ' MET . 86.9 mt -88.33 -25.13 22.92 Favored 'General case' 0 C--O 1.214 -0.816 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 177.022 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.507 ' HA ' HG13 ' A' ' 96' ' ' VAL . 29.9 p -87.78 -21.57 25.04 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 117.919 -1.512 . . . . 0.0 111.333 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.2 m -90.63 143.47 26.71 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.558 174.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.464 ' CZ ' ' HA ' ' A' ' 96' ' ' VAL . 48.8 m-85 . . . . . 0 C--N 1.299 -1.619 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.173 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 . . . . . 0 C--O 1.206 -1.19 0 CA-C-O 120.485 0.184 . . . . 0.0 111.267 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.411 HD23 HD22 ' A' ' 106' ' ' LEU . 3.2 tm? -78.5 -46.15 20.29 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -178.523 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.9 m -55.06 -33.37 62.68 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.471 0.653 . . . . 0.0 110.519 178.095 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.3 mt -82.95 -56.13 3.99 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.858 178.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.8 t -58.68 -49.42 77.61 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.196 0.999 . . . . 0.0 111.348 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.486 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 38.5 t -57.82 -37.08 73.18 Favored 'General case' 0 C--O 1.212 -0.903 0 C-N-CA 123.028 0.531 . . . . 0.0 110.839 178.162 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.406 ' HA ' ' HG2' ' A' ' 64' ' ' GLN . 25.9 t-20 -76.42 -25.32 54.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.872 0.844 . . . . 0.0 110.816 -177.079 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.543 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 6.3 tp-100 -79.61 -48.61 13.49 Favored 'General case' 0 C--N 1.283 -2.311 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.369 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.581 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -69.05 -31.7 70.66 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.866 -177.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.406 ' HG2' ' HA ' ' A' ' 61' ' ' ASN . 2.2 pt20 -71.92 -11.18 60.66 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -176.3 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.35 -10.23 57.77 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.929 0.871 . . . . 0.0 109.785 175.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -82.73 163.68 2.98 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 172.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.573 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 27.7 mm-40 -50.55 149.4 3.21 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-N 118.101 0.409 . . . . 0.0 112.023 174.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.538 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 19.4 ptpt -62.51 -38.4 89.8 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.779 -171.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -76.3 -19.59 58.12 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-O 121.534 0.683 . . . . 0.0 110.158 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 57.2 m -98.83 -11.5 21.72 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.541 -176.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 79.4 mt-30 -62.19 -38.84 90.65 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-O 121.414 0.626 . . . . 0.0 109.365 176.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.6 p -80.31 -24.84 39.68 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.125 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -71.32 -29.89 65.56 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.597 178.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.449 ' HB2' HG21 ' A' ' 24' ' ' ILE . . . -63.71 -30.44 71.54 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.42 176.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.581 HD11 HD22 ' A' ' 63' ' ' LEU . 31.4 mm -69.45 -33.94 59.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.539 -179.417 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -65.78 -41.11 92.41 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 -177.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.603 ' OE1' ' HB ' ' A' ' 24' ' ' ILE . 6.4 mt-30 -65.49 -33.13 75.2 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.743 -177.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.458 HG22 ' HB3' ' A' ' 29' ' ' LEU . 22.0 t -58.66 -46.7 90.26 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.03 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.477 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 42.7 t -64.46 -50.61 75.34 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.167 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 -176.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -50.5 -47.51 57.27 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.996 -1.457 . . . . 0.0 112.276 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.649 ' HA ' ' CD ' ' A' ' 84' ' ' LYS . 29.6 pt20 -83.1 -32.91 26.5 Favored 'General case' 0 N--CA 1.432 -1.342 0 C-N-CA 119.531 -0.868 . . . . 0.0 113.272 -176.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.463 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -71.27 -32.8 69.13 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-O 121.057 0.456 . . . . 0.0 110.493 -178.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 4.4 pt20 -74.1 -43.24 58.37 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.167 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.649 ' CD ' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -72.78 -25.08 61.04 Favored 'General case' 0 CA--C 1.498 -1.047 0 C-N-CA 118.197 -1.401 . . . . 0.0 111.824 -175.333 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -71.03 -34.12 70.99 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 119.777 -0.769 . . . . 0.0 109.863 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.444 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.2 mm? -84.16 -31.47 25.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.802 177.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -63.18 -38.32 90.71 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 122.871 0.469 . . . . 0.0 111.903 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -87.94 4.08 46.18 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.433 0.635 . . . . 0.0 112.156 -174.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -101.72 -130.65 7.1 Favored Glycine 0 C--N 1.286 -2.249 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.433 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -93.81 -8.1 41.45 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.647 0.737 . . . . 0.0 110.435 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.62 -150.65 17.32 Favored Glycine 0 N--CA 1.422 -2.28 0 N-CA-C 108.716 -1.754 . . . . 0.0 108.716 -176.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.409 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 112.91 -19.91 20.4 Favored Glycine 0 C--O 1.189 -2.671 0 C-N-CA 119.723 -1.227 . . . . 0.0 111.079 -177.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -51.38 -37.66 49.31 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 124.088 0.955 . . . . 0.0 111.252 -177.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -76.92 -33.25 57.76 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.014 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.418 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 29.8 pt20 -83.17 -44.51 14.97 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.349 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.507 HG13 ' HA ' ' A' ' 37' ' ' THR . 93.2 t -64.2 -22.54 31.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 C-N-CA 125.537 1.535 . . . . 0.0 110.687 177.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -45.95 -45.39 15.56 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.471 1.108 . . . . 0.0 112.285 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.8 pt20 -65.25 -18.75 65.56 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -178.214 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.451 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 3.6 tpt -98.87 -45.92 5.82 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.86 -25.02 36.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 120.891 0.376 . . . . 0.0 111.253 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -63.21 -22.66 67.01 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.374 -0.829 . . . . 0.0 111.831 174.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -66.45 -25.99 66.99 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 122.393 0.277 . . . . 0.0 110.444 175.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.49 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -60.97 -30.25 70.15 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 121.564 0.697 . . . . 0.0 110.487 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -70.51 -19.82 62.89 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.188 -178.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 56.0 mtp -92.4 -15.07 27.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.67 -178.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.5 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 97.5 mt -55.78 -45.93 99.81 Favored Pre-proline 0 C--N 1.317 -0.819 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.226 -178.151 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 14.5 Cg_endo -58.25 -25.01 70.28 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 122.222 1.948 . . . . 0.0 113.195 174.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.05 -47.71 13.19 Favored 'General case' 0 N--CA 1.419 -1.991 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -67.29 -38.45 85.04 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.595 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.454 ' SG ' HD21 ' A' ' 112' ' ' LEU . 15.9 t -90.33 -4.11 57.32 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-O 120.832 0.349 . . . . 0.0 110.336 -177.363 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 60.31 60.67 1.97 Allowed 'General case' 0 N--CA 1.477 0.916 0 CA-C-O 122.783 1.278 . . . . 0.0 109.67 -178.652 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.455 ' C ' ' H ' ' A' ' 114' ' ' CYS . 38.5 mt -91.65 160.06 15.56 Favored 'General case' 0 C--N 1.286 -2.192 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.133 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -70.0 26.96 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.477 1.111 . . . . 0.0 112.753 -177.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.455 ' H ' ' C ' ' A' ' 112' ' ' LEU . 85.2 m -157.66 158.81 36.15 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 -173.327 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.7 p -150.99 130.41 12.9 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 48.5 mt . . . . . 0 C--N 1.309 -1.153 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -178.119 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 63.1 m . . . . . 0 N--CA 1.435 -1.205 0 CA-C-O 120.88 0.372 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.3 p -79.43 161.29 26.22 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.825 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.423 ' HD3' ' N ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -88.11 66.44 8.54 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.725 0.774 . . . . 0.0 109.312 177.285 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 64.8 p -138.57 160.16 40.29 Favored 'General case' 0 N--CA 1.42 -1.967 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.0 mm -128.77 112.85 18.98 Favored Pre-proline 0 C--N 1.302 -1.488 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 176.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -72.62 154.2 98.89 Favored 'Cis proline' 0 CA--C 1.547 1.139 0 C-N-CA 123.716 -1.368 . . . . 0.0 112.228 -0.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.88 150.85 30.76 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 122.264 1.976 . . . . 0.0 113.022 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -98.6 113.07 32.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 105.674 -1.972 . . . . 0.0 105.674 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 80.9 m . . . . . 0 C--N 1.3 -1.578 0 CA-C-O 121.592 0.711 . . . . 0.0 111.963 -177.042 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 32.8 m . . . . . 0 N--CA 1.423 -1.776 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -100.51 110.17 22.33 Favored 'General case' 0 N--CA 1.414 -2.271 0 C-N-CA 118.165 -1.414 . . . . 0.0 108.817 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 mp -111.92 137.58 44.06 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.899 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 178.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.488 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 13.9 ptp180 -67.25 116.55 8.15 Favored 'General case' 0 N--CA 1.417 -2.111 0 CA-C-O 121.783 0.802 . . . . 0.0 109.335 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.65 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -67.69 -13.75 17.28 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.958 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.257 -174.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -77.43 -16.55 58.74 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.637 -178.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.1 pt20 -85.92 -20.31 29.19 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 119.116 -1.034 . . . . 0.0 109.29 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.475 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.5 mm? -91.54 -2.9 57.01 Favored 'General case' 0 CA--C 1.483 -1.607 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.52 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 -51.38 -35.4 38.6 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.58 -1.191 . . . . 0.0 110.959 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 t-160 -69.76 -54.42 13.77 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.43 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.7 OUTLIER -54.08 -52.21 61.67 Favored 'General case' 0 C--O 1.22 -0.487 0 O-C-N 123.737 0.648 . . . . 0.0 109.92 178.112 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -50.31 -60.06 3.35 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.053 0.941 . . . . 0.0 112.44 177.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.9 ptt? -68.13 -39.54 82.68 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.682 -172.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -70.9 -26.26 63.14 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.282 -175.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 90.6 mt -87.62 -27.73 22.32 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.543 ' HA ' HG13 ' A' ' 96' ' ' VAL . 39.9 p -86.01 -22.02 27.5 Favored 'General case' 0 N--CA 1.422 -1.836 0 C-N-CA 118.032 -1.467 . . . . 0.0 111.787 179.213 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.9 p -90.89 148.07 22.72 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.414 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 . . . . . 0 N--CA 1.417 -2.119 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.927 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 . . . . . 0 C--O 1.209 -1.047 0 CA-C-O 120.651 0.262 . . . . 0.0 111.423 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -77.91 -43.07 31.13 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.4 m -56.84 -34.6 67.92 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 123.655 0.597 . . . . 0.0 110.123 177.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 50.5 mt -79.75 -56.14 4.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.191 177.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 22.7 t -58.97 -49.27 78.49 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 124.186 0.994 . . . . 0.0 111.846 -175.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.498 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.7 t -58.99 -34.39 71.78 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 122.838 0.455 . . . . 0.0 110.651 177.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -77.53 -23.49 50.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.603 0.716 . . . . 0.0 110.852 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -83.17 -47.88 11.12 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.514 178.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.501 HD22 HD11 ' A' ' 75' ' ' ILE . 3.7 pp -66.48 -31.57 72.4 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.425 0.631 . . . . 0.0 111.014 -177.217 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.53 -14.6 63.12 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.134 -177.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -77.25 -22.91 51.45 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.453 0.644 . . . . 0.0 109.312 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.2 t -74.78 161.73 4.72 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.088 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.586 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 38.3 mt-10 -53.46 144.01 17.98 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -55.54 -31.24 61.95 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.99 0.916 . . . . 0.0 112.087 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.576 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.9 pt20 -84.94 -5.08 59.35 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.744 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.576 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 61.5 m -125.61 -6.27 6.93 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.991 -175.327 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.586 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 99.0 mt-30 -61.97 -41.88 98.51 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.433 0.635 . . . . 0.0 109.93 177.108 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.456 ' HA ' HG12 ' A' ' 75' ' ' ILE . 6.0 p -78.28 -23.55 47.17 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.329 177.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.432 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 14.7 mm-40 -72.0 -30.96 65.76 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.269 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.478 ' HA ' ' HG3' ' A' ' 77' ' ' GLN . . . -60.77 -24.27 65.64 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.267 176.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.609 HG21 ' HD3' ' A' ' 107' ' ' PRO . 32.6 mm -74.31 -29.97 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.683 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -71.54 -39.19 70.85 Favored 'General case' 0 CA--C 1.489 -1.383 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 -176.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.514 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 44.0 mm-40 -56.16 -46.75 79.19 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 112.286 -2.234 . . . . 0.0 109.075 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.475 HG22 ' HB3' ' A' ' 29' ' ' LEU . 12.2 t -57.89 -46.25 87.47 Favored 'Isoleucine or valine' 0 C--N 1.354 0.786 0 O-C-N 124.297 0.998 . . . . 0.0 109.667 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 75' ' ' ILE . 23.6 t -67.49 -41.3 85.84 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.813 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.898 -173.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -60.83 -52.83 63.42 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.107 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.65 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.1 pt20 -68.89 -37.27 78.9 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -176.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.62 -37.14 73.77 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 120.903 0.382 . . . . 0.0 111.508 -177.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -75.72 -38.43 58.55 Favored 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.233 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.499 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -67.34 -33.17 74.69 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 120.593 0.235 . . . . 0.0 111.07 -177.197 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.443 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 2.2 pt20 -72.2 -29.82 64.35 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.073 0.463 . . . . 0.0 110.769 -176.03 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.525 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.2 mm? -87.14 -33.11 19.53 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.534 0.683 . . . . 0.0 111.454 175.347 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -63.15 -36.5 83.82 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.256 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -81.99 -6.98 59.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.006 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -92.06 -133.08 5.97 Favored Glycine 0 N--CA 1.429 -1.827 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.161 -177.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -104.83 -18.95 14.05 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 120.891 0.377 . . . . 0.0 111.098 -176.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 154.61 -141.57 8.3 Favored Glycine 0 CA--C 1.477 -2.343 0 N-CA-C 109.159 -1.576 . . . . 0.0 109.159 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.404 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 96.06 -24.44 29.98 Favored Glycine 0 N--CA 1.424 -2.112 0 C-N-CA 120.358 -0.925 . . . . 0.0 113.267 176.764 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -54.05 -31.52 51.76 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -77.11 -35.17 56.57 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.327 179.381 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.404 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 14.2 pt20 -83.99 -43.54 15.07 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.61 0.719 . . . . 0.0 109.68 -177.284 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.543 HG13 ' HA ' ' A' ' 37' ' ' THR . 95.4 t -63.04 -23.15 32.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.507 177.207 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -46.48 -43.73 16.94 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.675 0.79 . . . . 0.0 112.936 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -69.4 -17.94 63.71 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.098 0.475 . . . . 0.0 111.865 -177.12 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.419 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 5.9 tpt -102.06 -47.38 4.57 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.143 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.5 p -64.73 -24.03 34.7 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.692 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.468 ' HG3' ' N ' ' A' ' 102' ' ' LYS . 34.9 pttt -59.23 -26.96 65.32 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.778 -0.576 . . . . 0.0 110.711 173.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.468 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 26.0 mtpp -65.02 -28.71 69.68 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.411 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -61.43 -43.49 98.78 Favored 'General case' 0 C--O 1.197 -1.659 0 O-C-N 123.931 0.769 . . . . 0.0 108.959 174.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -70.67 -16.89 62.84 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.197 -178.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 27.3 mtm -91.39 -13.38 32.52 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.095 -0.378 . . . . 0.0 111.29 177.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.51 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 95.7 mt -50.64 -45.35 85.62 Favored Pre-proline 0 CA--C 1.543 0.698 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.609 ' HD3' HG21 ' A' ' 75' ' ' ILE . 16.0 Cg_endo -58.25 -24.54 67.96 Favored 'Trans proline' 0 C--N 1.367 1.53 0 C-N-CA 122.172 1.915 . . . . 0.0 112.86 176.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -85.62 -44.06 12.94 Favored 'General case' 0 N--CA 1.413 -2.307 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -73.21 -35.86 66.39 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.315 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 25.0 t -90.05 -3.83 57.73 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-O 121.331 0.586 . . . . 0.0 109.797 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 61.7 t30 62.37 50.86 3.57 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 122.736 1.255 . . . . 0.0 110.853 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.435 HD21 HD11 ' A' ' 63' ' ' LEU . 66.3 mt -89.54 158.61 17.59 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.712 -178.671 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -80.3 43.79 0.65 Allowed 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 124.067 0.947 . . . . 0.0 112.06 -174.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 59.5 m -159.16 162.63 36.4 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.4 p -146.32 140.71 26.64 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 73.0 mt . . . . . 0 C--N 1.307 -1.262 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.48 -178.51 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 21.5 m . . . . . 0 N--CA 1.425 -1.677 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.4 p -78.58 146.16 34.36 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 175.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -87.82 69.82 9.54 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.676 0.75 . . . . 0.0 109.358 177.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.8 t -146.85 171.47 15.15 Favored 'General case' 0 N--CA 1.418 -2.074 0 N-CA-C 106.7 -1.592 . . . . 0.0 106.7 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 37.9 mm -128.84 119.83 20.21 Favored Pre-proline 0 C--N 1.305 -1.362 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -71.72 146.91 86.89 Favored 'Cis proline' 0 C--O 1.249 1.049 0 C-N-CA 123.751 -1.354 . . . . 0.0 111.645 -1.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -73.97 139.66 27.48 Favored 'Trans proline' 0 N--CA 1.445 -1.353 0 C-N-CA 122.252 1.968 . . . . 0.0 111.347 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.3 mm -106.18 115.54 48.05 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.8 t . . . . . 0 C--N 1.298 -1.644 0 C-N-CA 119.431 -0.908 . . . . 0.0 111.028 -176.784 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 64.0 m . . . . . 0 N--CA 1.417 -2.117 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -101.7 121.96 43.02 Favored 'General case' 0 N--CA 1.417 -2.124 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 173.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mp -122.26 134.41 65.58 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.395 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 -178.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.1 ptp180 -66.75 121.98 16.64 Favored 'General case' 0 N--CA 1.426 -1.655 0 O-C-N 123.913 0.758 . . . . 0.0 110.203 -173.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -64.13 -17.13 20.2 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.267 -175.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -75.94 -13.62 60.25 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.219 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -96.46 -10.53 27.25 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.124 178.07 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.436 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.9 mm? -98.7 4.95 47.93 Favored 'General case' 0 CA--C 1.488 -1.42 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.18 176.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.502 ' O ' ' HG2' ' A' ' 34' ' ' MET . 7.8 t30 -50.57 -36.6 35.39 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.27 -1.332 . . . . 0.0 113.099 -179.233 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -72.23 -53.61 12.06 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -178.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -54.72 -51.36 65.84 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 124.493 1.121 . . . . 0.0 108.809 -178.664 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -52.25 -56.03 17.39 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 124.201 1.001 . . . . 0.0 112.792 176.4 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.502 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 15.6 ptp -67.88 -43.63 78.91 Favored 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 119.849 -0.74 . . . . 0.0 112.788 -175.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -65.29 -25.34 67.59 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 99' ' ' MET . 93.1 mt -85.53 -32.54 22.13 Favored 'General case' 0 C--O 1.209 -1.076 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.809 175.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.548 ' HA ' HG13 ' A' ' 96' ' ' VAL . 40.7 p -86.43 -21.13 27.26 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 118.645 -1.222 . . . . 0.0 112.621 -177.327 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.5 m -89.6 121.11 31.48 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 113.037 0.755 . . . . 0.0 113.037 -177.2 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 . . . . . 0 C--N 1.29 -2.019 0 N-CA-C 103.436 -2.801 . . . . 0.0 103.436 165.907 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.204 -1.309 0 N-CA-C 111.433 0.16 . . . . 0.0 111.433 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -81.1 -44.94 17.21 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.1 m -56.99 -32.09 65.76 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 124.052 0.845 . . . . 0.0 109.671 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 54.7 mt -87.83 -49.52 7.05 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.213 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 52.5 t -61.09 -49.77 75.96 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.294 0.237 . . . . 0.0 111.383 -179.074 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.525 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 53.1 t -58.78 -32.27 69.16 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.581 0.352 . . . . 0.0 110.586 178.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.404 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 47.8 t30 -80.4 -26.04 38.74 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.489 0.661 . . . . 0.0 110.687 -177.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -82.85 -46.13 13.41 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.281 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.651 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -67.36 -32.45 73.38 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.554 -177.276 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.401 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 11.2 pt20 -70.85 -9.82 58.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.781 -178.688 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 12.9 mm-40 -78.67 -17.69 55.56 Favored 'General case' 0 C--O 1.247 0.935 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 176.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 8.4 t -85.23 162.48 2.9 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 175.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 2.5 mm-40 -49.89 144.62 6.33 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 124.155 0.982 . . . . 0.0 112.405 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -58.63 -33.51 70.14 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.316 0.579 . . . . 0.0 111.599 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -79.61 -11.49 59.87 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.073 -178.27 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 62.6 m -116.47 -9.49 11.43 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.929 -175.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 71.7 mt-30 -57.45 -49.37 76.47 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.387 0.675 . . . . 0.0 112.229 178.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.44 ' HA ' HG12 ' A' ' 75' ' ' ILE . 25.4 p -76.57 -23.7 53.52 Favored 'General case' 0 CA--C 1.499 -1.012 0 C-N-CA 119.494 -0.882 . . . . 0.0 111.841 177.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 15.0 mm-40 -66.56 -35.2 79.64 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 178.725 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.489 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.49 -26.66 66.98 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.372 0.669 . . . . 0.0 111.185 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.651 HD11 HD22 ' A' ' 63' ' ' LEU . 19.8 mm -72.94 -26.45 23.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.341 0.591 . . . . 0.0 109.537 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -75.88 -38.87 57.42 Favored 'General case' 0 CA--C 1.495 -1.152 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 -174.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 73' ' ' GLU . 63.6 mm-40 -58.09 -44.61 87.72 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 112.335 -2.212 . . . . 0.0 108.996 178.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.4 t -56.63 -46.38 82.76 Favored 'Isoleucine or valine' 0 C--N 1.359 0.987 0 O-C-N 124.428 1.08 . . . . 0.0 109.601 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 75' ' ' ILE . 41.7 t -65.9 -47.32 85.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -175.599 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.14 -40.62 86.07 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.297 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -82.02 -31.45 30.98 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.266 0.555 . . . . 0.0 111.275 -178.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.472 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -77.83 -31.23 51.51 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.021 0.439 . . . . 0.0 111.877 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -80.33 -33.75 37.19 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -33.5 63.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.382 -176.275 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.44 ' HG3' HD22 ' A' ' 86' ' ' LEU . 15.7 pt20 -67.4 -32.52 73.47 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.125 0.488 . . . . 0.0 110.416 -178.69 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.5 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.0 mm? -84.29 -29.21 26.58 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.993 177.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -66.91 -38.35 86.05 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.423 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -79.41 -4.64 52.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.447 0.641 . . . . 0.0 111.084 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -95.5 -133.96 7.59 Favored Glycine 0 N--CA 1.426 -2.021 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -92.13 -49.64 6.09 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.633 0.73 . . . . 0.0 109.726 -178.257 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.417 ' O ' HD12 ' A' ' 86' ' ' LEU . . . 178.11 -152.7 11.92 Favored Glycine 0 CA--C 1.484 -1.861 0 N-CA-C 107.348 -2.301 . . . . 0.0 107.348 -176.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.4 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 111.53 -23.69 17.25 Favored Glycine 0 C--O 1.201 -1.925 0 C-N-CA 119.975 -1.107 . . . . 0.0 111.872 178.449 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 48.1 mt-30 -49.96 -34.65 21.5 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 124.297 1.039 . . . . 0.0 112.376 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -75.46 -40.83 56.95 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.554 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 20.8 pt20 -80.08 -45.13 18.81 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-O 121.231 0.539 . . . . 0.0 109.67 -175.521 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.548 HG13 ' HA ' ' A' ' 37' ' ' THR . 88.1 t -63.04 -22.76 31.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 C-N-CA 124.893 1.277 . . . . 0.0 110.759 177.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.422 ' HA ' HG12 ' A' ' 100' ' ' VAL . 28.6 tt0 -54.25 -35.18 62.22 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.23 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.554 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 10.2 pt20 -69.41 -17.45 63.66 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.033 0.444 . . . . 0.0 111.199 -178.809 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.421 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 2.9 tpt -103.2 -44.03 5.3 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -177.041 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.422 HG12 ' HA ' ' A' ' 97' ' ' GLN . 9.2 p -66.82 -23.71 31.48 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 CA-C-O 121.079 0.466 . . . . 0.0 110.972 177.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -21.57 66.6 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 121.867 -0.52 . . . . 0.0 111.278 175.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -67.12 -28.07 67.85 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -68.93 -25.42 64.57 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-O 121.457 0.646 . . . . 0.0 110.131 176.21 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -70.71 -25.17 62.83 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 122.014 0.912 . . . . 0.0 108.883 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 38.8 mtp -92.3 -14.67 28.47 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.491 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.451 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.2 OUTLIER -52.07 -48.46 88.5 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 124.491 1.116 . . . . 0.0 111.305 -177.553 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 18.6 Cg_endo -59.28 -23.18 68.65 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 121.581 1.521 . . . . 0.0 113.494 177.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -89.19 -40.31 12.96 Favored 'General case' 0 N--CA 1.416 -2.139 0 C-N-CA 119.861 -0.735 . . . . 0.0 110.489 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -66.56 -41.73 88.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.276 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.409 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 30.3 t -88.49 -6.02 57.87 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.283 -176.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 60.56 61.45 1.73 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 123.116 1.436 . . . . 0.0 110.616 -178.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.451 HD21 HD11 ' A' ' 63' ' ' LEU . 54.8 mt -102.34 158.46 16.18 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 113.472 -1.695 . . . . 0.0 109.536 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -78.87 49.79 0.95 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.002 0.921 . . . . 0.0 111.391 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.441 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 18.2 m -158.19 159.08 35.73 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 123.939 0.896 . . . . 0.0 109.99 -176.715 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.5 p -147.78 116.83 6.82 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 176.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 72.0 mt . . . . . 0 C--N 1.305 -1.33 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 -176.387 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 81.0 m . . . . . 0 N--CA 1.433 -1.307 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.4 p -74.37 160.85 30.48 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.184 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -94.3 71.91 3.85 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 120.112 -0.635 . . . . 0.0 110.707 -178.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.4 t -152.06 167.39 28.61 Favored 'General case' 0 N--CA 1.428 -1.53 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.5 mt -129.05 118.89 19.56 Favored Pre-proline 0 C--N 1.311 -1.104 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.95 148.41 90.73 Favored 'Cis proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.711 -1.37 . . . . 0.0 112.591 0.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -74.2 143.98 32.73 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.36 2.04 . . . . 0.0 112.555 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.6 mm -96.24 115.27 35.1 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 176.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 76.8 m . . . . . 0 C--N 1.291 -1.965 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -174.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.0 m . . . . . 0 N--CA 1.428 -1.562 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -106.75 114.38 28.44 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-O 122.196 0.998 . . . . 0.0 109.252 175.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 mp -113.45 128.87 70.07 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.551 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 -177.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.561 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.6 ptp180 -67.29 124.2 22.46 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-O 121.467 0.651 . . . . 0.0 111.609 -174.672 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.73 -19.74 21.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.539 -176.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -76.33 -11.71 59.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.314 -178.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 3.4 pt20 -98.63 -10.47 23.28 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 119.616 -0.834 . . . . 0.0 110.575 178.326 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -105.94 3.83 28.87 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.556 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 34' ' ' MET . 3.7 t-20 -57.4 -34.81 69.26 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.492 0.495 . . . . 0.0 111.528 -176.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -69.13 -53.83 18.12 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.17 -52.57 62.89 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.578 -1.192 . . . . 0.0 108.46 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -51.16 -60.77 2.75 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 125.022 1.329 . . . . 0.0 112.415 176.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.498 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.6 ptm -66.21 -39.61 89.74 Favored 'General case' 0 C--O 1.208 -1.108 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -173.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.415 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 2.5 t-80 -68.47 -27.08 65.84 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.543 -175.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.8 mt -82.97 -34.74 26.35 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.578 176.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.465 ' HA ' HG13 ' A' ' 96' ' ' VAL . 41.4 p -82.52 -21.68 35.32 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 118.447 -1.301 . . . . 0.0 112.007 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -90.15 121.73 32.46 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.682 -178.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 . . . . . 0 C--N 1.289 -2.061 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 168.414 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.415 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER . . . . . 0 C--O 1.216 -0.663 0 CA-C-O 120.988 0.423 . . . . 0.0 110.972 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -80.5 -41.86 23.53 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 179.199 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.4 m -57.83 -28.99 64.58 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.374 0.606 . . . . 0.0 110.312 176.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.1 mt -86.82 -55.73 3.72 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.801 178.147 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 51.9 t -59.57 -48.16 82.74 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.291 0.636 . . . . 0.0 111.827 -177.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.56 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 24.9 t -60.49 -33.64 72.89 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 122.835 0.454 . . . . 0.0 110.583 178.351 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.425 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 64.2 t30 -78.31 -23.85 46.93 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.803 0.811 . . . . 0.0 110.035 -177.309 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -82.1 -47.93 11.97 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.774 178.668 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.56 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.8 pp -68.04 -30.71 69.99 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.508 -176.467 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.425 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 16.9 pt20 -69.05 -15.28 63.42 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.19 -176.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -82.42 -18.36 42.14 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.393 0.616 . . . . 0.0 110.306 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.418 HG12 ' HB2' ' A' ' 70' ' ' CYS . 12.0 t -76.76 163.27 3.97 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.513 ' HB2' ' SG ' ' A' ' 70' ' ' CYS . 46.0 mt-10 -47.73 147.48 1.88 Allowed 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 123.545 0.738 . . . . 0.0 112.295 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.416 ' HA ' HE21 ' A' ' 71' ' ' GLN . 22.0 ptmt -50.83 -38.62 50.02 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.068 0.947 . . . . 0.0 112.874 -176.844 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.517 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 25.0 pt20 -87.6 -19.55 27.64 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.504 0.669 . . . . 0.0 110.666 -177.372 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.517 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 44.6 m -96.97 -9.1 28.95 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.152 -171.575 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.444 ' HB3' HD22 ' A' ' 112' ' ' LEU . 47.3 mt-30 -57.11 -46.91 82.23 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-O 121.339 0.59 . . . . 0.0 109.844 175.032 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.425 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.5 p -76.87 -23.6 52.62 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.541 0.686 . . . . 0.0 111.546 179.483 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -72.87 -30.52 64.03 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.425 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.553 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -62.44 -27.42 69.1 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.398 176.415 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.526 HD11 HD22 ' A' ' 63' ' ' LEU . 32.4 mm -70.21 -27.69 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.528 -179.108 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -74.78 -41.78 59.38 Favored 'General case' 0 CA--C 1.5 -0.963 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 -176.316 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.436 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 50.2 mm-40 -59.05 -42.33 90.04 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 112.227 -2.26 . . . . 0.0 110.374 -179.198 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 74' ' ' ALA . 30.5 t -60.39 -43.95 95.02 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 75' ' ' ILE . 48.0 t -64.4 -47.29 90.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.836 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -177.097 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.63 -59.46 4.81 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.505 -179.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 18.4 pt20 -66.41 -30.24 70.56 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 120.931 0.396 . . . . 0.0 112.024 -175.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.3 -40.45 62.25 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 121.019 -0.273 . . . . 0.0 110.905 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -76.67 -36.94 57.0 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 119.794 -0.762 . . . . 0.0 110.646 -177.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.25 -26.46 62.91 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.618 -0.265 . . . . 0.0 110.869 -177.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -77.63 -30.28 52.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.493 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.573 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.0 mm? -86.18 -40.81 15.24 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.809 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.44 -31.76 70.73 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.629 0.772 . . . . 0.0 112.12 -177.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -77.55 -12.9 60.01 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.782 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -129.09 -100.83 0.97 Allowed Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 119.766 -1.207 . . . . 0.0 113.894 -175.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -71.2 -22.46 62.02 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -173.302 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.573 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 106.45 -88.54 0.56 Allowed Glycine 0 CA--C 1.472 -2.62 0 N-CA-C 107.917 -2.073 . . . . 0.0 107.917 -174.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.535 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 79.03 -46.56 2.97 Favored Glycine 0 C--O 1.189 -2.712 0 CA-C-O 118.98 -0.9 . . . . 0.0 114.559 171.315 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.468 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 52.3 mt-30 -46.45 -27.62 1.14 Allowed 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 125.001 1.321 . . . . 0.0 114.399 -175.284 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.438 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 7.8 pt20 -71.98 -46.56 56.87 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.783 0.325 . . . . 0.0 111.019 176.199 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.438 ' N ' ' HG3' ' A' ' 94' ' ' GLN . 28.9 pt20 -85.63 -47.17 10.09 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.632 0.73 . . . . 0.0 110.265 -176.599 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.465 HG13 ' HA ' ' A' ' 37' ' ' THR . 69.6 t -59.82 -22.56 24.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 C-N-CA 126.331 1.852 . . . . 0.0 110.679 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 53.8 tt0 -46.2 -44.73 16.34 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.085 0.554 . . . . 0.0 112.469 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -68.17 -18.74 64.69 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 3.9 tpt -100.33 -46.69 5.18 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -175.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.6 p -65.74 -25.85 37.44 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.194 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -24.54 67.93 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 121.93 -0.481 . . . . 0.0 111.335 176.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -65.46 -29.29 69.94 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 122.963 0.505 . . . . 0.0 110.447 178.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.548 ' HA ' HD13 ' A' ' 106' ' ' LEU . . . -58.26 -32.08 68.03 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-O 121.383 0.611 . . . . 0.0 110.556 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.56 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 37.1 mt-30 -68.78 -18.19 64.16 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.864 -178.477 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 42.9 mtp -91.56 -15.09 29.19 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 103' ' ' ALA . 6.4 mp -53.44 -49.07 90.42 Favored Pre-proline 0 C--N 1.319 -0.728 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 25.5 Cg_endo -61.64 -22.31 74.14 Favored 'Trans proline' 0 C--N 1.364 1.39 0 C-N-CA 121.567 1.511 . . . . 0.0 113.077 177.715 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -85.09 -41.59 15.59 Favored 'General case' 0 N--CA 1.411 -2.385 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -75.88 -42.45 49.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.858 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.449 ' SG ' HD11 ' A' ' 63' ' ' LEU . 8.9 t -84.09 -2.08 56.08 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.649 -174.445 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 60.69 61.47 1.69 Allowed 'General case' 0 CA--C 1.508 -0.67 0 CA-C-O 122.991 1.377 . . . . 0.0 109.84 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.444 HD22 ' HB3' ' A' ' 71' ' ' GLN . 39.4 mt -96.86 158.03 15.62 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 114.106 -1.406 . . . . 0.0 109.53 178.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -81.37 43.74 0.75 Allowed 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 122.071 0.938 . . . . 0.0 111.57 -174.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 98.3 m -163.39 149.98 12.18 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 104.637 -2.357 . . . . 0.0 104.637 -177.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.7 m -142.38 139.48 31.73 Favored 'General case' 0 C--N 1.288 -2.072 0 CA-C-N 118.632 0.651 . . . . 0.0 109.602 178.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.56 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 55.1 mt . . . . . 0 C--N 1.3 -1.55 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -178.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.475 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 72.2 m . . . . . 0 N--CA 1.442 -0.872 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.9 p -81.79 172.37 13.43 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 120.96 0.409 . . . . 0.0 110.151 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -97.6 81.99 3.01 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.614 0.721 . . . . 0.0 109.87 176.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.1 t -156.27 164.56 38.18 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.4 mm -129.18 116.62 18.83 Favored Pre-proline 0 C--N 1.305 -1.358 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 177.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -72.65 146.53 86.9 Favored 'Cis proline' 0 C--O 1.244 0.778 0 C-N-CA 124.024 -1.24 . . . . 0.0 111.33 -1.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.475 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 61.2 Cg_endo -70.57 153.25 65.31 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.498 2.132 . . . . 0.0 112.263 -177.241 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.1 mm -95.66 107.92 20.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 N-CA-C 106.46 -1.682 . . . . 0.0 106.46 176.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 80.9 m . . . . . 0 C--N 1.292 -1.899 0 CA-C-O 121.687 0.756 . . . . 0.0 112.144 -176.042 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 88.4 m . . . . . 0 N--CA 1.405 -2.678 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -106.43 94.07 4.94 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 122.11 0.957 . . . . 0.0 108.923 177.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.426 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.1 mp -98.05 130.62 46.55 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.606 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 -176.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.504 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 35.7 ptt180 -67.37 116.26 7.92 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-O 121.15 0.5 . . . . 0.0 111.402 -176.52 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.512 ' HB ' ' OE1' ' A' ' 81' ' ' GLN . 2.6 pp -60.82 -18.5 17.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.918 -176.225 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -73.67 -16.57 61.21 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.879 -178.126 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.9 pt20 -89.56 -15.86 31.95 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.482 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.7 mm? -97.67 6.37 48.07 Favored 'General case' 0 CA--C 1.485 -1.555 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.417 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -56.59 -34.15 66.89 Favored 'General case' 0 C--N 1.31 -1.136 0 O-C-N 124.068 0.855 . . . . 0.0 111.655 -178.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 44.1 t-80 -70.58 -52.88 18.56 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.5 t -54.51 -50.57 67.52 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.759 -1.109 . . . . 0.0 108.166 -178.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -52.94 -58.49 6.77 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 124.401 1.08 . . . . 0.0 112.161 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -66.14 -39.04 89.55 Favored 'General case' 0 C--O 1.214 -0.788 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.607 -173.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -73.05 -24.87 60.75 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.183 -175.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.429 ' O ' ' HB3' ' A' ' 99' ' ' MET . 95.7 mt -88.68 -23.44 23.0 Favored 'General case' 0 C--O 1.21 -0.979 0 C-N-CA 120.866 -0.333 . . . . 0.0 111.781 177.334 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.54 ' HA ' HG13 ' A' ' 96' ' ' VAL . 40.8 p -89.52 -21.61 22.83 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 118.382 -1.327 . . . . 0.0 111.338 178.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.5 m -90.29 152.96 20.81 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.846 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.413 ' CE2' ' HA ' ' A' ' 96' ' ' VAL . 52.4 m-85 . . . . . 0 C--N 1.302 -1.463 0 CA-C-O 121.806 0.812 . . . . 0.0 111.658 179.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.214 -0.778 0 CA-C-O 120.575 0.226 . . . . 0.0 111.433 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.0 tp -72.71 -54.27 9.42 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 174.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.5 m -57.94 -21.03 41.99 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.057 -179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.4 mt -90.19 -57.79 2.72 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.507 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 50.7 t -67.3 -50.4 60.42 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.119 0.568 . . . . 0.0 111.849 -176.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.594 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 43.4 t -61.71 -34.94 76.68 Favored 'General case' 0 CA--C 1.495 -1.14 0 CA-C-O 121.645 0.736 . . . . 0.0 109.262 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.488 ' O ' ' HG2' ' A' ' 64' ' ' GLN . 8.9 t30 -72.49 -35.93 68.28 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.631 178.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -76.06 -38.99 56.44 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-O 120.875 0.369 . . . . 0.0 111.376 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.667 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -71.83 -30.96 66.03 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 121.05 0.452 . . . . 0.0 110.617 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 24.2 pt20 -73.36 -4.27 32.36 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.189 0.518 . . . . 0.0 110.883 -177.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 7.9 mm-40 -84.94 -17.92 36.21 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 122.017 0.913 . . . . 0.0 108.578 176.074 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 10.2 t -85.07 164.19 2.56 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.471 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 4.9 mp0 -54.21 141.83 28.05 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 124.362 1.065 . . . . 0.0 110.616 177.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -57.6 -33.02 67.76 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -174.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.49 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 16.7 pt20 -80.22 -9.6 59.73 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.597 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.49 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.3 m -112.29 -9.57 13.87 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.215 -174.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 79.5 mt-30 -61.52 -40.24 93.92 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 121.123 0.487 . . . . 0.0 110.774 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 1.9 p -79.47 -27.24 41.58 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.317 0.579 . . . . 0.0 111.295 177.005 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 8.3 mm-40 -69.35 -33.46 73.13 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.483 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.06 -30.75 68.28 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.003 177.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.667 HD11 HD22 ' A' ' 63' ' ' LEU . 31.6 mm -66.94 -34.81 72.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.045 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -71.84 -40.07 69.3 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 -172.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 73' ' ' GLU . 48.8 mm-40 -62.31 -37.12 84.35 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 112.579 -2.101 . . . . 0.0 109.439 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 74' ' ' ALA . 33.3 t -60.86 -48.48 88.71 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 75' ' ' ILE . 40.6 t -64.71 -46.82 91.09 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.724 -173.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -57.11 -49.67 75.19 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.614 -1.175 . . . . 0.0 112.129 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.512 ' OE1' ' HB ' ' A' ' 26' ' ' ILE . 28.8 pt20 -74.29 -30.33 62.04 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.359 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.402 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -75.18 -40.0 59.78 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 120.95 0.405 . . . . 0.0 111.095 -178.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.494 ' HB2' HE22 ' A' ' 93' ' ' GLN . 13.8 pt20 -72.92 -30.3 63.79 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.244 -177.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -75.91 -31.07 59.0 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.484 -179.147 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -75.66 -28.37 58.7 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.202 0.525 . . . . 0.0 111.62 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.492 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.4 mm? -84.6 -35.04 23.0 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.802 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -67.09 -32.22 73.23 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.13 0.491 . . . . 0.0 110.526 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -77.81 -11.04 59.85 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.875 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -89.24 -134.27 5.15 Favored Glycine 0 N--CA 1.424 -2.112 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -103.92 -49.78 3.55 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 120.756 0.312 . . . . 0.0 110.67 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -157.02 -148.18 5.01 Favored Glycine 0 N--CA 1.446 -0.637 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 100.53 -31.95 7.94 Favored Glycine 0 C--O 1.205 -1.663 0 CA-C-O 118.918 -0.934 . . . . 0.0 114.185 176.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.494 HE22 ' HB2' ' A' ' 83' ' ' GLN . 14.8 mm100 -48.95 -33.88 11.81 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -177.421 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -77.26 -37.17 53.6 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.039 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.564 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 29.2 pt20 -82.58 -44.46 15.81 Favored 'General case' 0 CA--C 1.497 -1.072 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.243 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.54 HG13 ' HA ' ' A' ' 37' ' ' THR . 95.8 t -58.55 -23.84 23.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.805 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -49.84 -44.11 49.3 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.912 178.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.564 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 29.0 pt20 -66.4 -18.24 65.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.854 0.359 . . . . 0.0 111.777 -177.141 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.429 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 6.4 tpt -101.37 -48.69 4.28 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -176.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.6 p -64.97 -24.21 35.05 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 CA-C-O 120.969 0.414 . . . . 0.0 111.499 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.432 ' HG3' ' N ' ' A' ' 102' ' ' LYS . 27.8 pttt -64.27 -23.77 67.42 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.918 -0.489 . . . . 0.0 110.578 176.067 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.432 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 24.6 mtpp -64.52 -32.71 74.46 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.706 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.566 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -64.0 -37.27 86.79 Favored 'General case' 0 C--O 1.196 -1.758 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.148 176.131 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -68.18 -18.62 64.65 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.226 0.536 . . . . 0.0 110.704 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 29.8 mtm -91.79 -14.8 29.24 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.566 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.6 OUTLIER -52.68 -44.32 95.09 Favored Pre-proline 0 N--CA 1.475 0.794 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -177.368 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.446 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 18.2 Cg_endo -60.34 -24.0 76.22 Favored 'Trans proline' 0 C--N 1.368 1.594 0 CA-C-N 120.935 1.37 . . . . 0.0 112.862 176.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -89.24 -37.67 14.8 Favored 'General case' 0 N--CA 1.408 -2.564 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.138 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -76.88 -34.09 57.79 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 12.4 t -91.97 -2.81 56.56 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 59.7 t30 66.3 56.09 0.82 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 122.42 1.105 . . . . 0.0 109.696 178.202 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 107' ' ' PRO . 36.8 mt -101.48 157.1 17.06 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.102 -179.223 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -78.47 39.83 0.35 Allowed 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.876 0.87 . . . . 0.0 112.979 -173.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 86.3 m -154.8 158.48 39.51 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 -174.736 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 24.0 p -147.01 141.23 26.2 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 43.1 mm . . . . . 0 C--N 1.313 -1.012 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -179.898 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 60.6 m . . . . . 0 N--CA 1.408 -2.528 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.6 p -69.0 140.38 55.0 Favored 'General case' 0 N--CA 1.415 -2.214 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -84.86 69.13 10.71 Favored 'General case' 0 N--CA 1.421 -1.907 0 CA-C-O 121.602 0.715 . . . . 0.0 109.912 -175.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 t -148.5 171.79 15.53 Favored 'General case' 0 N--CA 1.417 -2.094 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 39.7 mm -128.45 118.21 20.17 Favored Pre-proline 0 C--N 1.303 -1.451 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -72.93 145.75 84.95 Favored 'Cis proline' 0 C--O 1.245 0.835 0 C-N-CA 123.877 -1.301 . . . . 0.0 112.668 1.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -77.66 136.86 15.72 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 122.401 2.067 . . . . 0.0 112.154 -178.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 42.9 mm -95.88 110.03 23.69 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.126 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 79.0 m . . . . . 0 C--N 1.308 -1.237 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -176.249 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 m . . . . . 0 N--CA 1.407 -2.615 0 CA-C-O 121.343 0.592 . . . . 0.0 109.907 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -107.39 98.91 8.48 Favored 'General case' 0 C--N 1.276 -2.599 0 CA-C-O 122.144 0.973 . . . . 0.0 110.05 178.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.49 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 3.3 mp -105.29 138.99 27.73 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.813 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.623 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 16.8 ptt180 -68.51 117.41 10.24 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-O 121.171 0.51 . . . . 0.0 110.734 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.473 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -64.06 -13.53 13.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -176.144 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -77.36 -20.12 55.26 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.953 -178.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.623 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 14.9 pt20 -86.68 -15.91 38.16 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 119.884 -0.726 . . . . 0.0 109.382 -178.389 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.422 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.6 mm? -98.69 1.77 46.49 Favored 'General case' 0 CA--C 1.483 -1.623 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.79 177.217 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.478 ' O ' ' HG2' ' A' ' 34' ' ' MET . 27.7 t-20 -56.18 -32.96 64.82 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.898 -178.248 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -71.98 -52.9 14.87 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -177.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.416 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -54.72 -53.73 51.12 Favored 'General case' 0 CA--C 1.516 -0.353 0 O-C-N 123.682 0.613 . . . . 0.0 109.863 177.717 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 40.4 tt0 -49.42 -58.45 5.12 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 123.88 0.872 . . . . 0.0 112.63 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 11.8 ptp -65.96 -43.02 89.15 Favored 'General case' 0 CA--C 1.498 -1.055 0 C-N-CA 119.95 -0.7 . . . . 0.0 111.72 -175.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -67.7 -32.79 73.67 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 123.835 0.71 . . . . 0.0 110.825 -174.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.433 ' O ' ' HB3' ' A' ' 99' ' ' MET . 94.7 mt -78.46 -25.69 45.91 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-O 121.135 0.493 . . . . 0.0 111.171 178.046 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.467 HG22 HG11 ' A' ' 96' ' ' VAL . 68.0 p -91.69 -0.27 57.55 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.709 174.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.8 t -88.29 121.79 31.08 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.747 -175.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 . . . . . 0 N--CA 1.419 -2.017 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 169.099 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.441 -0.878 0 N-CA-C 111.838 0.311 . . . . 0.0 111.838 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -74.3 -43.82 55.21 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 177.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.2 m -61.66 -26.7 68.18 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.172 0.511 . . . . 0.0 110.783 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.3 mt -84.45 -53.37 5.48 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.397 177.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.5 t -65.4 -48.03 74.25 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.11 0.964 . . . . 0.0 111.16 -175.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.526 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.7 t -59.4 -33.3 71.04 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 122.97 0.508 . . . . 0.0 110.53 177.589 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -81.45 -23.43 37.48 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.712 0.767 . . . . 0.0 110.373 -178.352 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -83.13 -40.02 20.32 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.326 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.526 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.9 pp -67.5 -32.57 73.47 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 121.229 0.538 . . . . 0.0 110.522 -178.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.402 ' N ' HD12 ' A' ' 63' ' ' LEU . 16.4 pt20 -71.73 -7.25 46.94 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.656 -179.081 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -78.44 -22.31 47.83 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.747 0.784 . . . . 0.0 109.15 175.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.412 HG12 ' HB2' ' A' ' 70' ' ' CYS . 7.3 t -82.15 163.95 2.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.224 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -50.79 144.02 8.97 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.06 0.544 . . . . 0.0 110.579 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.484 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 21.8 ptmt -62.19 -31.02 71.49 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -174.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -79.27 -10.57 59.85 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.545 0.688 . . . . 0.0 109.94 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.412 ' HB2' HG12 ' A' ' 66' ' ' VAL . 59.8 m -108.44 -10.48 15.28 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.943 -176.143 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.484 ' NE2' ' HA ' ' A' ' 68' ' ' LYS . 77.3 mt-30 -59.3 -40.61 86.74 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 178.621 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.515 ' HA ' HG12 ' A' ' 75' ' ' ILE . 8.7 p -83.93 -23.76 31.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 120.024 -0.67 . . . . 0.0 112.625 177.702 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.03 -36.03 82.15 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.697 0.76 . . . . 0.0 109.534 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.412 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -58.05 -29.54 65.45 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.265 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.576 HG21 ' HD3' ' A' ' 107' ' ' PRO . 28.5 mm -67.39 -35.79 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.09 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.377 -177.584 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.491 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 14.3 mmmm -69.05 -41.78 77.16 Favored 'General case' 0 CA--C 1.489 -1.385 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 -176.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.52 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 6.7 mt-30 -59.58 -39.35 83.81 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 113.689 -1.596 . . . . 0.0 111.425 -177.26 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.422 HG22 ' HB3' ' A' ' 29' ' ' LEU . 21.9 t -56.99 -44.6 82.96 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 O-C-N 123.743 0.652 . . . . 0.0 109.52 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 23.7 t -65.55 -48.55 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 CA-C-N 115.507 -0.769 . . . . 0.0 108.966 -176.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 43.1 mt-10 -55.71 -52.68 63.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.558 -1.201 . . . . 0.0 111.054 -177.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.52 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -71.29 -34.82 71.0 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -177.138 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.433 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -71.8 -37.64 70.36 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -177.593 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -76.95 -37.01 56.1 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.753 -179.002 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.432 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -69.38 -30.62 68.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.693 0.282 . . . . 0.0 111.309 -177.75 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 2.3 pt20 -73.23 -31.47 64.16 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.141 0.496 . . . . 0.0 110.058 -177.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.1 mm? -82.7 -30.48 29.14 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.929 175.398 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -59.95 -40.1 87.86 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 123.36 0.664 . . . . 0.0 110.045 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -83.34 -5.75 59.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.701 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -94.58 -136.71 8.46 Favored Glycine 0 N--CA 1.418 -2.515 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.839 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -93.35 -19.02 21.74 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -175.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 148.17 -118.48 0.99 Allowed Glycine 0 CA--C 1.483 -1.924 0 N-CA-C 108.444 -1.863 . . . . 0.0 108.444 -175.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.56 -33.29 2.32 Favored Glycine 0 C--O 1.201 -1.93 0 CA-C-O 118.683 -1.065 . . . . 0.0 114.903 173.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -47.2 -33.08 4.97 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 -177.094 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -77.15 -37.0 54.83 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 120.797 0.332 . . . . 0.0 111.361 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.559 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 14.0 pt20 -85.59 -41.29 15.38 Favored 'General case' 0 C--O 1.212 -0.905 0 CA-C-O 121.452 0.644 . . . . 0.0 110.038 -177.696 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.467 HG11 HG22 ' A' ' 37' ' ' THR . 73.2 t -62.32 -23.48 32.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 C-N-CA 124.9 1.28 . . . . 0.0 111.045 176.336 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.448 ' HA ' HG12 ' A' ' 100' ' ' VAL . 35.5 tt0 -53.22 -37.32 61.94 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -177.515 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.6 pt20 -68.96 -18.6 64.1 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.89 0.376 . . . . 0.0 111.629 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.433 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 6.3 tpt -106.04 -45.13 4.42 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -174.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.448 HG12 ' HA ' ' A' ' 97' ' ' GLN . 14.8 p -62.72 -24.9 36.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.987 178.708 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -61.31 -22.97 65.37 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.862 -0.524 . . . . 0.0 111.173 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -67.58 -23.59 65.41 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 122.055 -0.403 . . . . 0.0 110.484 177.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.453 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -63.92 -34.92 79.05 Favored 'General case' 0 C--O 1.202 -1.429 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 174.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.481 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 44.7 mt-30 -75.39 -19.41 59.55 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.547 -179.095 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 48.2 mtt -86.92 -15.65 38.29 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.796 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.453 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 95.8 mt -52.37 -50.7 78.26 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -178.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.576 ' HD3' HG21 ' A' ' 75' ' ' ILE . 29.9 Cg_endo -62.96 -22.63 73.92 Favored 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 121.981 1.788 . . . . 0.0 112.524 178.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -83.72 -41.79 17.3 Favored 'General case' 0 N--CA 1.408 -2.546 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -176.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -81.41 -33.84 31.97 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.303 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.403 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 23.2 t -87.52 -1.51 57.98 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 53.34 60.22 3.87 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.146 1.378 . . . . 0.0 110.33 -179.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.462 HD21 HD11 ' A' ' 63' ' ' LEU . 79.5 mt -91.19 159.73 15.91 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-N 113.984 -1.462 . . . . 0.0 110.087 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -74.37 35.83 0.1 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.088 0.955 . . . . 0.0 112.221 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.426 ' H ' ' C ' ' A' ' 112' ' ' LEU . 57.3 m -157.62 149.27 21.95 Favored 'General case' 0 N--CA 1.417 -2.097 0 C-N-CA 125.702 1.601 . . . . 0.0 107.645 -175.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 4.5 p -134.59 131.96 38.48 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-O 120.99 0.424 . . . . 0.0 110.45 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.481 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 62.0 mt . . . . . 0 C--N 1.303 -1.451 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 178.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.467 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 61.8 m . . . . . 0 N--CA 1.432 -1.338 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.7 p -68.29 154.99 40.65 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 176.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -92.04 71.41 5.49 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.713 0.768 . . . . 0.0 109.246 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.0 t -147.12 169.71 18.71 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.4 mp -128.82 114.72 19.09 Favored Pre-proline 0 C--N 1.31 -1.138 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -75.53 147.09 87.63 Favored 'Cis proline' 0 C--O 1.237 0.426 0 C-N-CA 124.075 -1.219 . . . . 0.0 111.816 0.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.467 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 59.1 Cg_endo -72.74 141.46 33.98 Favored 'Trans proline' 0 N--CA 1.446 -1.293 0 C-N-CA 122.118 1.878 . . . . 0.0 111.941 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.7 mm -92.03 113.1 26.77 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 177.66 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 84.4 m . . . . . 0 C--N 1.284 -2.241 0 CA-C-O 121.373 0.606 . . . . 0.0 111.798 -174.271 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 56.0 m . . . . . 0 N--CA 1.406 -2.63 0 CA-C-O 121.316 0.579 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -96.68 102.43 14.21 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.967 0.889 . . . . 0.0 109.827 177.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.2 mp -109.91 138.53 37.13 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.262 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 178.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.486 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 39.8 ptt180 -79.03 122.19 25.88 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.536 -177.669 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.494 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.5 pp -62.7 -15.82 15.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -176.182 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -79.3 -15.89 57.24 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.927 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.1 pt20 -84.88 -27.93 26.35 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 119.265 -0.974 . . . . 0.0 108.531 178.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.462 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.6 mm? -87.31 1.74 52.32 Favored 'General case' 0 CA--C 1.481 -1.707 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.41 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -53.26 -34.72 58.39 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.171 0.919 . . . . 0.0 110.591 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -69.47 -53.41 19.34 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.204 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.856 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.8 OUTLIER -55.96 -51.69 66.8 Favored 'General case' 0 CA--C 1.503 -0.843 0 O-C-N 123.164 0.29 . . . . 0.0 110.309 178.442 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 -49.51 -55.74 12.27 Favored 'General case' 0 N--CA 1.426 -1.658 0 C-N-CA 123.667 0.787 . . . . 0.0 111.713 176.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.7 ptm -68.69 -38.09 80.05 Favored 'General case' 0 C--O 1.209 -1.028 0 C-N-CA 121.088 -0.245 . . . . 0.0 111.497 -176.04 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.856 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -70.89 -19.45 62.61 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.009 0.433 . . . . 0.0 111.158 -177.444 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 84.6 mt -88.5 -34.09 17.55 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.902 175.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.499 ' HB ' HD21 ' A' ' 86' ' ' LEU . 82.8 p -85.94 -21.04 28.11 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 119.344 -0.942 . . . . 0.0 111.211 -178.085 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -89.26 127.07 35.74 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.31 -178.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 . . . . . 0 C--N 1.299 -1.6 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 171.474 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.432 -1.329 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -75.31 -43.34 51.45 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.1 m -62.93 -25.71 68.46 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 123.658 0.599 . . . . 0.0 110.539 179.207 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 63.9 mt -84.83 -46.99 10.81 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.538 177.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -68.83 -50.63 48.41 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -176.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.506 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.2 t -58.27 -34.29 70.34 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 120.921 0.391 . . . . 0.0 110.169 178.117 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.421 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 9.7 t30 -76.22 -27.21 56.73 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.294 0.568 . . . . 0.0 111.506 -178.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -82.78 -41.81 18.71 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.796 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.571 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -70.64 -33.59 71.15 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.026 -178.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.421 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 3.4 pt20 -70.23 -14.97 62.85 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -176.539 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -79.74 -13.12 59.68 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.514 177.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 18.5 t -77.45 163.68 3.75 Favored 'Isoleucine or valine' 0 C--O 1.254 1.338 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 174.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -48.38 142.44 5.66 Favored 'General case' 0 CA--C 1.508 -0.654 0 C-N-CA 123.566 0.746 . . . . 0.0 110.782 176.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -61.17 -29.13 69.61 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -173.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.493 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 12.1 pt20 -80.31 -22.15 41.85 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-O 121.487 0.66 . . . . 0.0 109.96 178.695 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.493 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.4 m -99.77 -8.32 24.38 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.051 -172.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.5 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 76.1 mt-30 -60.93 -41.62 96.56 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.197 0.522 . . . . 0.0 110.869 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.42 ' HA ' HG12 ' A' ' 75' ' ' ILE . 5.3 p -78.31 -23.79 46.93 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.637 176.417 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.431 ' HA ' ' HG2' ' A' ' 76' ' ' LYS . 33.5 mm-40 -69.85 -30.79 68.36 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.935 177.471 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.446 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -62.7 -27.33 69.18 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.83 176.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.571 HD11 HD22 ' A' ' 63' ' ' LEU . 28.3 mm -73.36 -24.61 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.052 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.431 ' HG2' ' HA ' ' A' ' 73' ' ' GLU . 32.1 mmtp -74.49 -41.94 59.83 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 -176.254 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.467 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 64.7 mm-40 -56.12 -46.4 79.19 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 111.818 -2.446 . . . . 0.0 110.052 -179.38 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.462 HG22 ' HB3' ' A' ' 29' ' ' LEU . 22.9 t -54.94 -46.05 76.32 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 O-C-N 124.204 0.94 . . . . 0.0 110.152 -179.172 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 75' ' ' ILE . 26.0 t -67.78 -47.87 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.748 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -175.157 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.76 -45.85 85.33 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.104 -1.407 . . . . 0.0 111.945 -176.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.494 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.7 pt20 -77.29 -35.24 55.25 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 111.448 0.166 . . . . 0.0 111.448 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.409 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . . . -71.07 -38.87 72.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.884 0.373 . . . . 0.0 111.483 -177.522 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -72.35 -36.74 68.86 Favored 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.059 -178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.452 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -73.19 -32.47 64.84 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.761 -0.375 . . . . 0.0 111.231 -176.971 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.409 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 3.3 pt20 -71.9 -28.96 63.85 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.745 -176.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.502 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.2 mm? -85.27 -33.79 22.08 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.208 174.598 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -59.69 -35.73 75.08 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.552 0.741 . . . . 0.0 111.251 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 85' ' ' GLN . 29.6 pt20 -73.14 -11.72 60.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.137 -178.064 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -92.79 -126.69 4.15 Favored Glycine 0 N--CA 1.427 -1.96 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.016 -177.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -107.56 -22.4 12.54 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 120.929 0.395 . . . . 0.0 110.588 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 165.91 -128.78 1.82 Allowed Glycine 0 N--CA 1.434 -1.446 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -178.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.41 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 91.12 -28.86 7.52 Favored Glycine 0 C--O 1.202 -1.848 0 CA-C-O 119.549 -0.584 . . . . 0.0 112.479 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -52.76 -34.38 52.83 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 123.97 0.908 . . . . 0.0 111.714 -176.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.417 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 8.7 pt20 -75.57 -37.2 60.09 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.579 -179.493 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.569 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 13.1 pt20 -82.59 -45.71 14.24 Favored 'General case' 0 CA--C 1.498 -1.047 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.033 -177.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.502 HG21 ' HG ' ' A' ' 86' ' ' LEU . 96.0 t -57.66 -23.2 19.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 124.376 1.07 . . . . 0.0 110.725 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.482 ' HA ' HG12 ' A' ' 100' ' ' VAL . 53.0 tt0 -50.73 -40.36 54.18 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.803 0.441 . . . . 0.0 111.78 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.2 pt20 -68.76 -18.36 64.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.633 -176.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.453 ' O ' HD22 ' A' ' 36' ' ' LEU . 8.1 tpt -102.44 -48.55 4.12 Favored 'General case' 0 CA--C 1.485 -1.546 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -177.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.482 HG12 ' HA ' ' A' ' 97' ' ' GLN . 14.3 p -60.37 -24.27 30.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.747 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.81 -24.86 64.5 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.851 -0.531 . . . . 0.0 111.688 174.337 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -64.46 -30.39 71.43 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 120.773 0.321 . . . . 0.0 110.188 177.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.506 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -62.8 -28.79 70.24 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-O 121.418 0.628 . . . . 0.0 109.989 177.212 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -73.58 -18.6 61.04 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.163 -178.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 42.3 mtt -92.11 -18.28 23.78 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.808 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.9 OUTLIER -48.18 -48.28 64.74 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 123.884 0.873 . . . . 0.0 113.121 -178.326 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.491 ' HG2' HG12 ' A' ' 116' ' ' ILE . 22.5 Cg_exo -61.35 -26.09 81.08 Favored 'Trans proline' 0 C--N 1.359 1.104 0 C-N-CA 121.533 1.488 . . . . 0.0 113.355 178.314 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -89.17 -37.44 15.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.812 177.7 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -74.68 -34.17 62.61 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 12.8 t -93.75 -2.7 53.38 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 64.1 t30 57.27 63.64 1.83 Allowed 'General case' 0 C--O 1.244 0.785 0 CA-C-O 123.01 1.386 . . . . 0.0 110.885 -179.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.7 mt -100.36 157.88 16.3 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 113.039 -1.891 . . . . 0.0 109.401 178.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -78.22 31.25 0.18 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.747 1.219 . . . . 0.0 112.944 -173.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 91.8 m -150.3 167.84 25.81 Favored 'General case' 0 C--N 1.269 -2.923 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -174.085 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 69.6 m -150.79 133.72 15.93 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 175.077 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.491 HG12 ' HG2' ' A' ' 107' ' ' PRO . 46.1 mm . . . . . 0 C--O 1.263 1.764 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -177.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.9 m . . . . . 0 N--CA 1.425 -1.723 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.6 p -69.27 155.4 40.48 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.291 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -87.75 73.61 9.27 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 175.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.2 t -150.04 167.23 27.36 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.9 mm -128.49 118.79 20.25 Favored Pre-proline 0 C--N 1.306 -1.311 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.76 147.63 89.91 Favored 'Cis proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.763 -1.349 . . . . 0.0 111.876 -1.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.28 136.08 25.94 Favored 'Trans proline' 0 C--O 1.247 0.94 0 C-N-CA 122.184 1.923 . . . . 0.0 112.063 -178.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.8 mm -96.15 124.01 48.65 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 178.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.1 m . . . . . 0 C--N 1.29 -2.019 0 CA-C-O 121.579 0.704 . . . . 0.0 112.06 -175.555 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.6 m . . . . . 0 N--CA 1.405 -2.68 0 N-CA-C 110.116 -0.328 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -99.84 124.48 45.18 Favored 'General case' 0 N--CA 1.415 -2.193 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 173.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.429 HD11 ' HB2' ' A' ' 73' ' ' GLU . 4.1 mp -119.93 145.47 26.15 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -176.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.496 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 35.1 ptt180 -66.14 120.68 13.63 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-O 121.599 0.714 . . . . 0.0 110.06 -178.231 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.47 -14.99 19.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.261 0.553 . . . . 0.0 111.97 -175.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -75.53 -20.84 58.43 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.54 -177.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 6.8 pt20 -85.41 -34.95 21.59 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 119.334 -0.946 . . . . 0.0 109.828 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.423 HD11 ' HB1' ' A' ' 74' ' ' ALA . 2.0 mm? -79.54 -7.81 58.74 Favored 'General case' 0 CA--C 1.475 -1.921 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.21 -177.59 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -54.08 -33.82 58.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 124.246 0.966 . . . . 0.0 110.192 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -69.52 -57.63 4.98 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.449 ' HB3' HG11 ' A' ' 78' ' ' VAL . 0.7 OUTLIER -56.1 -47.5 77.95 Favored 'General case' 0 C--O 1.215 -0.718 0 O-C-N 123.909 0.756 . . . . 0.0 110.392 179.738 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -52.76 -57.95 8.45 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 124.316 1.046 . . . . 0.0 111.842 176.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -67.41 -38.24 84.33 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.818 -175.178 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -74.0 -28.74 61.6 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.3 mt -78.53 -24.33 45.76 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 120.176 -0.609 . . . . 0.0 110.757 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.509 ' HB ' HD21 ' A' ' 86' ' ' LEU . 73.6 p -89.87 -12.77 38.04 Favored 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 118.734 -1.186 . . . . 0.0 111.25 176.735 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.6 t -88.71 144.9 25.96 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.403 178.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 . . . . . 0 N--CA 1.438 -1.041 0 CA-C-O 121.247 0.546 . . . . 0.0 111.206 174.506 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.211 -0.971 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -82.5 -42.36 18.54 Favored 'General case' 0 CA--C 1.49 -1.357 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.3 m -60.42 -31.09 70.07 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.399 0.619 . . . . 0.0 109.93 178.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 44.9 mt -81.8 -53.13 6.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.116 177.56 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 25.3 t -59.13 -49.72 76.78 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 123.443 0.697 . . . . 0.0 111.731 -177.276 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.529 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.0 t -58.55 -35.56 72.52 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.45 0.643 . . . . 0.0 110.419 179.238 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -82.05 -23.69 35.71 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.874 0.845 . . . . 0.0 110.762 -176.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.401 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 64.6 tt0 -86.84 -38.63 16.62 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.7 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.562 HD22 HD11 ' A' ' 75' ' ' ILE . 4.1 pp -68.76 -32.33 72.01 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.11 0.481 . . . . 0.0 109.865 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.464 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 14.6 pt20 -68.61 -10.32 55.28 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.903 -178.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.42 -15.49 59.31 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.516 0.674 . . . . 0.0 109.223 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.6 t -86.49 163.37 2.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 174.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.512 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.6 mt-10 -49.38 143.05 6.88 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 122.938 0.495 . . . . 0.0 110.675 175.443 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.491 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 9.1 ptpp? -59.8 -32.46 70.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -175.879 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.514 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 27.8 pt20 -72.89 -24.01 60.79 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.612 0.72 . . . . 0.0 109.972 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.514 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.0 m -100.22 -9.14 22.75 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.047 -174.731 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.512 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 79.0 mt-30 -61.5 -39.17 90.0 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.894 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.415 ' HA ' HG12 ' A' ' 75' ' ' ILE . 11.0 p -83.55 -23.99 31.79 Favored 'General case' 0 CA--C 1.502 -0.874 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.692 177.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.429 ' HB2' HD11 ' A' ' 24' ' ' ILE . 7.0 mm-40 -66.03 -34.36 77.91 Favored 'General case' 0 C--O 1.248 1.024 0 CA-C-O 122.073 0.939 . . . . 0.0 108.763 178.558 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.423 ' HB1' HD11 ' A' ' 29' ' ' LEU . . . -61.21 -31.52 71.29 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.7 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.562 HD11 HD22 ' A' ' 63' ' ' LEU . 31.0 mm -69.62 -33.62 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.638 -176.401 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.541 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 30.7 mmtp -67.88 -41.15 83.22 Favored 'General case' 0 CA--C 1.487 -1.445 0 CA-C-N 115.234 -0.894 . . . . 0.0 108.871 -178.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 6.6 mt-30 -61.05 -36.37 79.41 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.161 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.449 HG11 ' HB3' ' A' ' 32' ' ' CYS . 23.6 t -57.8 -46.57 87.08 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.702 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 178.224 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 45.1 t -62.51 -45.49 98.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.359 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.541 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 35.6 mt-10 -57.87 -52.23 66.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.236 -177.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 3.5 pt20 -75.06 -31.95 61.4 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.102 -175.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.16 -37.34 58.07 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -177.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -73.85 -32.86 63.86 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.575 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.95 -32.28 59.45 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.578 -175.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -71.83 -27.49 62.94 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.246 0.546 . . . . 0.0 110.261 -178.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.509 HD21 ' HB ' ' A' ' 37' ' ' THR . 3.8 mm? -83.94 -35.11 24.26 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.988 174.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.536 ' HA ' HE21 ' A' ' 93' ' ' GLN . 29.6 tt0 -60.59 -33.5 72.83 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.515 0.726 . . . . 0.0 111.647 178.413 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -86.8 -1.55 57.86 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.258 0.551 . . . . 0.0 111.329 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -95.86 -144.83 17.72 Favored Glycine 0 N--CA 1.419 -2.434 0 CA-C-O 121.753 0.641 . . . . 0.0 113.023 -177.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -100.23 -41.28 7.16 Favored 'General case' 0 C--N 1.279 -2.458 0 CA-C-N 114.84 -0.68 . . . . 0.0 111.045 -174.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 179.69 -176.84 47.86 Favored Glycine 0 N--CA 1.418 -2.547 0 N-CA-C 108.919 -1.672 . . . . 0.0 108.919 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.481 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 119.66 -25.14 7.75 Favored Glycine 0 N--CA 1.408 -3.205 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.27 -177.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.536 HE21 ' HA ' ' A' ' 87' ' ' GLN . 19.4 mp0 -47.35 -40.3 17.02 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.931 0.892 . . . . 0.0 112.092 -178.492 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -77.11 -37.31 54.48 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.583 -176.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.663 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 12.3 pt20 -80.66 -43.52 20.29 Favored 'General case' 0 C--O 1.209 -1.065 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.147 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.428 HG21 ' HG ' ' A' ' 86' ' ' LEU . 69.0 t -61.06 -23.51 30.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 C-N-CA 124.594 1.158 . . . . 0.0 110.541 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -54.57 -37.62 65.69 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.873 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.663 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 30.0 pt20 -71.8 -18.35 62.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.866 0.365 . . . . 0.0 111.143 -178.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.2 tpt -96.78 -47.26 5.94 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 -176.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -62.45 -27.75 43.37 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.319 178.063 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.1 pptp? -63.85 -21.2 66.33 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.912 -0.492 . . . . 0.0 111.286 176.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -65.36 -28.82 69.55 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.383 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.43 -30.92 69.94 Favored 'General case' 0 C--O 1.207 -1.135 0 CA-C-O 121.186 0.517 . . . . 0.0 110.313 178.236 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.445 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 38.6 mt-30 -68.83 -19.31 64.26 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.253 0.549 . . . . 0.0 109.887 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 49.4 mtp -91.97 -19.94 21.89 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 7.0 mp -53.55 -47.5 96.2 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.59 -22.32 73.86 Favored 'Trans proline' 0 C--N 1.362 1.243 0 CA-C-N 120.74 1.3 . . . . 0.0 112.658 176.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -85.09 -49.5 8.21 Favored 'General case' 0 N--CA 1.411 -2.399 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -73.46 -38.92 65.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.062 -175.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.451 ' SG ' HD21 ' A' ' 112' ' ' LEU . 34.0 t -82.82 -0.83 49.78 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 66.5 t30 63.12 40.71 8.75 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.886 1.274 . . . . 0.0 110.477 173.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.451 HD21 ' SG ' ' A' ' 110' ' ' CYS . 48.8 mt -80.97 159.55 24.87 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.314 -177.162 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -69.36 41.55 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 C-N-CA 125.062 1.345 . . . . 0.0 112.657 -176.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 56.7 m -158.06 146.13 18.67 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -176.032 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 40.1 m -134.03 119.25 18.74 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-O 121.062 0.458 . . . . 0.0 110.063 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.445 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 67.1 mt . . . . . 0 C--N 1.304 -1.404 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 74.3 m . . . . . 0 N--CA 1.433 -1.275 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.6 p -75.87 160.85 29.51 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 121.087 0.47 . . . . 0.0 110.357 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -91.29 66.33 5.56 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.8 t -152.44 172.35 16.65 Favored 'General case' 0 N--CA 1.421 -1.901 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -177.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.8 mm -128.35 118.29 20.31 Favored Pre-proline 0 C--N 1.313 -1.009 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 177.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.62 146.41 86.51 Favored 'Cis proline' 0 C--O 1.244 0.796 0 C-N-CA 123.817 -1.326 . . . . 0.0 111.608 0.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -68.45 126.82 14.71 Favored 'Trans proline' 0 N--CA 1.446 -1.304 0 C-N-CA 121.799 1.666 . . . . 0.0 110.126 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.4 mm -89.58 112.37 24.35 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.187 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -178.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 63.2 m . . . . . 0 C--N 1.287 -2.147 0 CA-C-O 121.581 0.705 . . . . 0.0 110.82 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.437 -1.083 0 CA-C-O 120.417 0.151 . . . . 0.0 111.273 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -106.73 116.82 32.58 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.867 0.842 . . . . 0.0 109.727 177.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.428 HG21 ' HB2' ' A' ' 74' ' ' ALA . 3.4 mp -120.49 132.58 69.71 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 -177.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.541 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 21.7 ptt180 -67.49 117.06 8.94 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 121.148 0.499 . . . . 0.0 111.484 -177.375 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.566 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.7 pp -61.98 -14.37 11.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -177.424 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -79.24 -17.33 54.97 Favored 'General case' 0 N--CA 1.423 -1.8 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.257 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.0 pt20 -79.98 -23.57 41.5 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.507 ' HB2' ' OE1' ' A' ' 81' ' ' GLN . 2.5 mm? -93.73 4.46 53.9 Favored 'General case' 0 CA--C 1.489 -1.381 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.048 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -55.02 -31.95 61.45 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 123.624 0.577 . . . . 0.0 111.595 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.424 ' O ' ' HB3' ' A' ' 35' ' ' HIS . 25.4 t-80 -71.67 -53.11 14.63 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 107.84 -1.171 . . . . 0.0 107.84 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.51 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -55.86 -50.29 71.02 Favored 'General case' 0 C--N 1.314 -0.97 0 O-C-N 124.357 1.036 . . . . 0.0 109.188 -177.988 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -49.92 -58.26 5.79 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 125.148 1.379 . . . . 0.0 111.83 174.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.2 ptm -66.8 -37.88 85.41 Favored 'General case' 0 C--O 1.192 -1.972 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.03 -177.167 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.424 ' HB3' ' O ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -58.66 -33.87 70.58 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 123.555 0.742 . . . . 0.0 111.246 179.0 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 89.4 mt -81.48 -41.27 22.0 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.147 178.461 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.445 ' HA ' HG13 ' A' ' 96' ' ' VAL . 45.8 p -85.24 -21.33 29.13 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.108 -175.415 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.6 t -90.76 121.23 32.47 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.214 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 . . . . . 0 C--N 1.282 -2.355 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 170.801 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.535 0.372 0 CA-C-O 121.405 0.621 . . . . 0.0 112.431 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -86.21 -40.11 15.92 Favored 'General case' 0 CA--C 1.496 -1.111 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 -179.101 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 t -59.27 -24.0 62.86 Favored 'General case' 0 C--O 1.209 -1.054 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.693 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.6 mt -87.63 -56.04 3.52 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.769 177.521 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 27.4 t -57.88 -51.75 68.32 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.471 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 11.0 t -59.31 -33.42 71.08 Favored 'General case' 0 N--CA 1.428 -1.542 0 C-N-CA 124.197 0.999 . . . . 0.0 110.748 178.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 61.9 t30 -81.25 -23.19 38.18 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.129 -176.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 21.2 tp60 -80.06 -46.38 16.65 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.28 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.56 ' O ' ' HG2' ' A' ' 71' ' ' GLN . 3.6 pp -69.14 -35.44 76.37 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.291 -175.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -68.88 -17.38 63.97 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 122.991 0.516 . . . . 0.0 111.735 -175.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 63.6 mm-40 -83.61 -13.31 54.61 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 121.377 0.608 . . . . 0.0 109.713 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.3 t -79.63 162.68 3.77 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -50.52 141.59 12.06 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 123.492 0.717 . . . . 0.0 110.98 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.418 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 18.8 ptpt -57.83 -31.77 66.96 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -174.705 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.447 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 12.1 pt20 -82.11 -12.71 58.05 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.26 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.447 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 42.7 m -110.75 -12.6 14.28 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.584 -174.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.56 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 67.4 mt-30 -56.28 -46.47 79.73 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.434 0.694 . . . . 0.0 110.796 176.591 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.412 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.0 p -75.09 -23.86 58.05 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.324 0.583 . . . . 0.0 111.468 178.327 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 64.7 mm-40 -73.98 -29.52 62.02 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.402 0.62 . . . . 0.0 110.287 177.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.432 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -64.24 -23.13 67.2 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.586 176.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.533 HD11 HD22 ' A' ' 63' ' ' LEU . 35.2 mm -72.87 -27.75 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.362 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -73.03 -41.0 64.67 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 -175.009 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.47 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 12.1 mm100 -56.6 -47.95 78.49 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 111.676 -2.511 . . . . 0.0 110.133 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.462 HG22 ' HB3' ' A' ' 29' ' ' LEU . 20.0 t -56.23 -44.59 79.8 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 O-C-N 124.03 0.832 . . . . 0.0 109.771 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 75' ' ' ILE . 31.0 t -68.09 -42.34 85.01 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.686 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -174.567 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -61.95 -53.0 61.7 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.597 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.566 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.7 pt20 -71.55 -31.05 66.58 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.791 0.329 . . . . 0.0 111.852 -176.314 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.2 -40.97 64.32 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.881 -0.327 . . . . 0.0 110.954 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -70.55 -41.38 72.56 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.154 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.486 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -65.33 -35.99 82.67 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.299 -176.168 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.486 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 1.3 pt20 -71.94 -33.6 68.35 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.604 -174.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.505 HD12 ' HA3' ' A' ' 92' ' ' GLY . 2.7 mm? -84.46 -39.29 19.1 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.391 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -57.48 -41.28 80.37 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 123.804 0.842 . . . . 0.0 111.06 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 84' ' ' LYS . 29.8 pt20 -90.98 -8.67 48.55 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.322 0.582 . . . . 0.0 110.737 -178.081 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -89.9 -78.88 1.34 Allowed Glycine 0 N--CA 1.426 -1.996 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.846 -176.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -132.76 -12.54 2.96 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.74 -106.79 1.42 Allowed Glycine 0 C--N 1.285 -2.254 0 N-CA-C 106.865 -2.494 . . . . 0.0 106.865 -173.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.505 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 77.26 -37.29 1.55 Allowed Glycine 0 C--O 1.185 -2.908 0 CA-C-O 119.039 -0.867 . . . . 0.0 115.04 172.143 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.427 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 14.0 mm100 -52.29 -21.06 3.12 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -175.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -79.2 -39.72 32.56 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.084 0.469 . . . . 0.0 110.877 174.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -86.0 -38.95 17.37 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 121.625 0.726 . . . . 0.0 110.217 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.445 HG13 ' HA ' ' A' ' 37' ' ' THR . 72.2 t -69.71 -22.52 25.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.207 0 C-N-CA 125.631 1.572 . . . . 0.0 110.633 176.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.427 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 53.6 tt0 -45.91 -44.75 14.89 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -59.87 -28.13 67.27 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 123.069 0.548 . . . . 0.0 112.04 178.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.415 ' O ' HD22 ' A' ' 36' ' ' LEU . 5.2 tpt -96.59 -48.08 5.67 Favored 'General case' 0 CA--C 1.494 -1.206 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -174.426 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.2 p -60.38 -27.98 41.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.603 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -25.16 68.18 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.958 -0.464 . . . . 0.0 111.265 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -64.54 -25.58 68.04 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 122.661 0.384 . . . . 0.0 110.855 177.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.443 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -60.36 -36.26 77.59 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-O 121.495 0.664 . . . . 0.0 110.032 176.779 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -73.24 -16.51 61.4 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.74 0.781 . . . . 0.0 110.297 -177.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 54.3 mtp -92.67 -15.85 26.27 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.978 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.45 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 92.6 mt -55.1 -47.07 99.4 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.927 -177.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.471 ' HD3' HG21 ' A' ' 75' ' ' ILE . 12.3 Cg_endo -58.78 -22.28 60.95 Favored 'Trans proline' 0 C--N 1.366 1.497 0 C-N-CA 121.759 1.639 . . . . 0.0 113.127 175.361 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -84.82 -47.83 9.98 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.044 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -68.49 -47.41 67.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.1 -176.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 97.8 m -81.3 2.05 29.83 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 47.9 t30 53.58 64.48 1.83 Allowed 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 122.97 1.367 . . . . 0.0 110.697 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.422 HD21 HD11 ' A' ' 63' ' ' LEU . 62.9 mt -98.59 158.19 15.76 Favored 'General case' 0 C--N 1.275 -2.673 0 CA-C-N 113.396 -1.729 . . . . 0.0 108.659 -178.823 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -81.08 45.1 0.81 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.814 0.816 . . . . 0.0 111.068 -175.417 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 57.2 m -160.88 155.3 23.3 Favored 'General case' 0 C--N 1.285 -2.226 0 C-N-CA 125.722 1.609 . . . . 0.0 106.712 -176.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 41.5 m -150.32 136.76 18.88 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 38.0 mm . . . . . 0 C--N 1.309 -1.158 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.001 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 58.1 m . . . . . 0 N--CA 1.428 -1.55 0 CA-C-O 120.952 0.406 . . . . 0.0 110.607 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.6 p -82.53 166.1 19.57 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.781 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -90.55 76.98 6.51 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 175.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t -152.67 163.95 38.67 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.1 mm -128.79 115.91 19.26 Favored Pre-proline 0 C--N 1.305 -1.334 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 176.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.59 147.18 88.98 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.869 -1.305 . . . . 0.0 111.692 -1.27 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.85 140.16 45.46 Favored 'Trans proline' 0 C--O 1.247 0.959 0 C-N-CA 122.661 2.241 . . . . 0.0 111.789 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 40.3 mm -95.32 116.99 38.22 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 65.8 m . . . . . 0 C--N 1.284 -2.281 0 CA-C-O 121.462 0.649 . . . . 0.0 110.893 -177.948 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 86.3 m . . . . . 0 N--CA 1.415 -2.195 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -101.83 102.95 13.62 Favored 'General case' 0 N--CA 1.423 -1.81 0 CA-C-O 122.269 1.033 . . . . 0.0 109.2 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.516 HD11 ' HB2' ' A' ' 73' ' ' GLU . 3.1 mp -102.08 144.16 13.75 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.568 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -178.074 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.443 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.8 ptt180 -70.58 115.28 9.57 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.161 0.505 . . . . 0.0 110.736 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.415 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -65.64 -10.9 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.417 ' HG2' ' HB2' ' A' ' 25' ' ' ARG . 4.1 pt20 -78.08 -21.02 51.16 Favored 'General case' 0 N--CA 1.427 -1.609 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.098 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.447 ' HG3' HD22 ' A' ' 29' ' ' LEU . 1.0 OUTLIER -82.06 -26.54 33.63 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 119.492 -0.883 . . . . 0.0 108.813 -179.98 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.491 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.4 mm? -86.58 -1.7 57.87 Favored 'General case' 0 CA--C 1.487 -1.474 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.152 -178.757 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.573 ' O ' ' HG2' ' A' ' 34' ' ' MET . 8.2 t30 -51.65 -32.65 30.19 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 124.265 0.978 . . . . 0.0 111.692 179.791 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 30.9 t-80 -70.31 -56.42 6.78 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.507 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.452 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -53.84 -53.28 54.67 Favored 'General case' 0 CA--C 1.507 -0.709 0 O-C-N 123.918 0.761 . . . . 0.0 110.052 178.717 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -47.88 -56.14 8.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.201 1.001 . . . . 0.0 112.283 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.573 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 14.3 ptp -70.66 -44.11 67.78 Favored 'General case' 0 C--O 1.202 -1.402 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.261 -176.11 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 43.0 m80 -68.28 -22.88 64.71 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -178.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 89.0 mt -81.7 -34.24 30.74 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.663 174.627 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.473 ' HA ' HG13 ' A' ' 96' ' ' VAL . 62.0 p -84.2 -22.16 31.0 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 117.84 -1.544 . . . . 0.0 112.212 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.6 p -90.69 145.95 24.41 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-O 121.735 0.779 . . . . 0.0 112.559 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 . . . . . 0 C--N 1.281 -2.392 0 N-CA-C 104.645 -2.354 . . . . 0.0 104.645 169.795 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 . . . . . 0 N--CA 1.426 -1.627 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -80.22 -42.69 22.79 Favored 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.3 m -59.82 -27.23 66.43 Favored 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.732 0.645 . . . . 0.0 110.718 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.0 mt -88.15 -51.17 5.93 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.775 176.037 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.7 t -59.72 -48.14 82.85 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.429 0.692 . . . . 0.0 111.895 -177.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.512 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 42.1 t -57.86 -35.94 71.65 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.269 0.557 . . . . 0.0 110.091 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.552 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 4.1 t-20 -76.56 -25.67 54.29 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.16 -176.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -85.57 -44.9 12.26 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.954 178.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.566 HD22 HD11 ' A' ' 75' ' ' ILE . 3.7 pp -66.26 -31.9 73.0 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.365 0.603 . . . . 0.0 110.24 -177.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.552 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 3.3 pt20 -71.97 -9.24 58.08 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.684 -178.294 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -78.29 -15.91 58.28 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.416 0.627 . . . . 0.0 109.819 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.0 t -84.05 161.61 3.22 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 174.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 33.7 mt-10 -49.31 142.2 7.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.287 0.635 . . . . 0.0 111.306 177.095 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.459 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 15.5 ptpt -56.38 -33.42 65.72 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -174.06 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.502 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.8 pt20 -77.57 -22.81 50.38 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 121.758 0.79 . . . . 0.0 110.176 -179.504 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.502 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 66.3 m -98.57 -13.15 20.56 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.672 -173.142 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 76.8 mt-30 -57.04 -40.69 77.25 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 123.234 0.614 . . . . 0.0 111.802 178.198 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.456 ' HA ' HG12 ' A' ' 75' ' ' ILE . 20.4 p -83.47 -24.06 31.95 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 119.409 -0.917 . . . . 0.0 111.981 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.516 ' HB2' HD11 ' A' ' 24' ' ' ILE . 9.4 mm-40 -64.92 -36.8 85.55 Favored 'General case' 0 CA--C 1.553 1.091 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 177.725 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.466 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -58.12 -31.79 67.52 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.093 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.566 HD11 HD22 ' A' ' 63' ' ' LEU . 28.2 mm -69.91 -32.6 52.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.322 -176.337 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.477 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 14.6 mmmm -68.92 -41.07 78.66 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 -178.224 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.489 ' NE2' ' HB ' ' A' ' 24' ' ' ILE . 5.9 mt-30 -61.01 -37.87 84.07 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 113.598 -1.637 . . . . 0.0 110.639 -179.431 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.491 HG22 ' HB3' ' A' ' 29' ' ' LEU . 40.3 t -55.91 -46.85 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 123.94 0.775 . . . . 0.0 109.233 178.721 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 38.4 t -62.95 -46.08 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.357 -175.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 38.6 mt-10 -56.88 -52.3 65.7 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.307 -178.093 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -73.33 -32.12 64.38 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.816 -176.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.414 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -71.35 -39.69 71.14 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.045 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -72.56 -41.08 66.15 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.545 -179.03 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.427 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -66.67 -27.92 68.04 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 120.841 0.353 . . . . 0.0 111.62 -176.822 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.428 ' HA ' ' NE2' ' A' ' 88' ' ' GLN . 1.1 pt20 -77.67 -30.33 51.95 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.824 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.495 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.2 mm? -87.04 -41.64 13.7 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.165 0.507 . . . . 0.0 111.982 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -58.66 -32.13 68.81 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.727 1.211 . . . . 0.0 112.412 -177.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.428 ' NE2' ' HA ' ' A' ' 85' ' ' GLN . 11.4 pt20 -73.72 -9.48 58.7 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -174.315 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -154.86 -73.6 0.01 OUTLIER Glycine 0 C--N 1.304 -1.206 0 C-N-CA 118.649 -1.738 . . . . 0.0 113.975 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -61.18 -43.03 99.52 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -175.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.495 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 101.49 -106.1 2.98 Favored Glycine 0 CA--C 1.473 -2.54 0 N-CA-C 105.728 -2.949 . . . . 0.0 105.728 -170.004 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.403 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 75.61 -24.94 1.44 Allowed Glycine 0 C--O 1.186 -2.892 0 N-CA-C 115.555 0.982 . . . . 0.0 115.555 169.75 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -58.61 -21.6 53.97 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 118.887 1.344 . . . . 0.0 113.719 -174.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -77.65 -38.11 48.49 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.503 174.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.402 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 13.3 pt20 -85.19 -43.0 14.2 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 122.025 0.917 . . . . 0.0 109.38 -178.898 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.473 HG13 ' HA ' ' A' ' 37' ' ' THR . 72.1 t -63.2 -22.71 31.42 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 C-N-CA 125.821 1.648 . . . . 0.0 110.146 177.696 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -45.14 -47.45 12.26 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.436 0.694 . . . . 0.0 112.527 -179.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 29.7 pt20 -69.32 -17.6 63.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.041 -177.074 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 4.9 tpt -100.14 -45.45 5.64 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -178.148 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.7 p -66.55 -25.85 36.07 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.186 179.308 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.88 -26.26 67.28 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 122.025 -0.422 . . . . 0.0 111.395 175.219 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -63.0 -31.9 73.14 Favored 'General case' 0 C--O 1.208 -1.08 0 C-N-CA 122.802 0.441 . . . . 0.0 110.015 178.279 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -61.58 -31.81 71.88 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-O 121.147 0.499 . . . . 0.0 110.486 178.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -72.62 -20.91 61.2 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.728 0.775 . . . . 0.0 109.629 -179.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' MET . . . . . 0.433 ' O ' ' HB2' ' A' ' 108' ' ' ASN . 48.2 mtp -92.4 -17.3 24.8 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.563 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.434 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 3.6 mp -53.17 -46.52 97.75 Favored Pre-proline 0 N--CA 1.471 0.603 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 16.3 Cg_endo -60.94 -22.31 74.01 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 121.216 1.278 . . . . 0.0 112.577 176.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 105' ' ' MET . 16.0 m120 -84.71 -49.42 8.51 Favored 'General case' 0 N--CA 1.415 -2.196 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -74.2 -33.3 63.36 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.757 -174.513 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.472 ' SG ' HD21 ' A' ' 112' ' ' LEU . 34.8 t -89.32 -6.98 56.25 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 60.0 64.33 1.29 Allowed 'General case' 0 C--O 1.241 0.633 0 CA-C-O 123.499 1.619 . . . . 0.0 110.653 -178.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.472 HD21 ' SG ' ' A' ' 110' ' ' CYS . 40.4 mt -101.83 159.24 15.51 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 112.412 -2.176 . . . . 0.0 109.555 178.706 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -74.32 45.28 0.22 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.092 0.957 . . . . 0.0 111.952 -175.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 56.0 m -162.12 164.49 27.97 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 124.046 0.938 . . . . 0.0 109.297 -175.683 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 55.0 m -150.64 123.74 8.8 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 66.4 mt . . . . . 0 C--N 1.311 -1.085 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -178.329 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 64.5 m . . . . . 0 N--CA 1.428 -1.529 0 CA-C-O 120.897 0.379 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.1 p -73.48 148.25 43.34 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -87.75 79.47 8.18 Favored 'General case' 0 N--CA 1.42 -1.93 0 CA-C-O 121.799 0.809 . . . . 0.0 108.876 177.38 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.4 p -140.98 164.91 28.99 Favored 'General case' 0 N--CA 1.417 -2.108 0 CA-C-N 113.984 -1.462 . . . . 0.0 107.99 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 34.1 mm -128.72 110.93 18.89 Favored Pre-proline 0 C--N 1.3 -1.578 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -73.06 151.49 97.14 Favored 'Cis proline' 0 C--O 1.248 1.004 0 C-N-CA 124.341 -1.108 . . . . 0.0 112.192 -0.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -74.02 156.98 47.3 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.258 1.972 . . . . 0.0 111.998 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.7 mm -114.65 117.2 54.87 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 N-CA-C 107.03 -1.471 . . . . 0.0 107.03 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 85.8 m . . . . . 0 C--N 1.291 -1.972 0 CA-C-O 121.826 0.822 . . . . 0.0 111.879 -177.654 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.404 -2.736 0 CA-C-O 121.383 0.611 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.454 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 3.3 pt20 -101.12 101.05 11.7 Favored 'General case' 0 N--CA 1.416 -2.143 0 CA-C-O 122.443 1.116 . . . . 0.0 110.276 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.446 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 2.4 mp -115.08 132.37 64.54 Favored 'Isoleucine or valine' 0 C--N 1.261 -3.241 0 N-CA-C 105.628 -1.99 . . . . 0.0 105.628 176.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.527 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.6 ptt180 -68.55 118.13 11.18 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -65.67 -16.42 20.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.226 0.536 . . . . 0.0 111.926 -176.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -74.87 -16.52 60.67 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.254 -178.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 7.0 pt20 -89.18 -19.63 25.22 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.277 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.424 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.7 mm? -89.88 -0.23 57.44 Favored 'General case' 0 CA--C 1.477 -1.859 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.743 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -50.38 -37.66 38.49 Favored 'General case' 0 C--O 1.218 -0.598 0 O-C-N 124.413 1.071 . . . . 0.0 111.146 178.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -66.81 -52.98 37.43 Favored 'General case' 0 C--O 1.215 -0.747 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.839 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.7 OUTLIER -58.28 -51.94 67.68 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 123.274 0.359 . . . . 0.0 110.639 179.523 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -50.05 -52.34 35.2 Favored 'General case' 0 N--CA 1.434 -1.233 0 C-N-CA 124.162 0.985 . . . . 0.0 111.608 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptm -71.71 -41.05 69.06 Favored 'General case' 0 C--O 1.211 -0.946 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.521 -177.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.839 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 1.4 p80 -68.16 -24.68 65.0 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.995 0.426 . . . . 0.0 111.954 -176.228 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.416 HD22 ' O ' ' A' ' 99' ' ' MET . 95.2 mt -83.39 -40.61 19.15 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.81 176.428 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.471 ' HA ' HG13 ' A' ' 96' ' ' VAL . 58.5 p -83.7 -21.0 32.49 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 118.947 -1.101 . . . . 0.0 112.929 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.6 m -90.66 121.54 32.66 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 C--N 1.297 -1.691 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 169.032 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.435 -1.186 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -72.88 -45.45 58.2 Favored 'General case' 0 C--O 1.214 -0.796 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 174.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.2 m -58.05 -26.89 63.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 122.876 0.471 . . . . 0.0 111.282 177.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.3 mt -81.71 -56.39 4.03 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.319 175.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.9 t -62.37 -48.52 79.4 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.2 0.6 . . . . 0.0 112.408 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.539 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.0 t -59.03 -32.27 69.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.444 0.698 . . . . 0.0 110.117 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.471 ' O ' ' HG2' ' A' ' 64' ' ' GLN . 8.1 t30 -76.88 -41.32 44.31 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.89 0.852 . . . . 0.0 110.322 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.405 HE21 ' HB2' ' A' ' 28' ' ' GLN . 5.9 tp60 -65.13 -36.44 84.26 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.12 -179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.567 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -80.21 -33.24 38.29 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.161 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 4.0 pt20 -68.68 -23.11 64.35 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -174.706 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.93 -22.85 63.15 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.227 0.537 . . . . 0.0 110.053 176.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.8 t -74.66 158.16 5.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 177.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.413 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 1.3 mp0 -42.69 140.67 1.23 Allowed 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 125.03 1.332 . . . . 0.0 111.818 177.523 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -58.82 -32.97 69.87 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -173.297 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.587 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.5 pt20 -81.62 -11.8 58.97 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.587 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.3 m -112.5 -8.23 13.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.891 -172.579 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 99.1 mt-30 -60.64 -43.37 97.63 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.776 0.798 . . . . 0.0 109.819 177.263 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 2.9 p -77.71 -25.24 49.2 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.144 179.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 77' ' ' GLN . 4.1 mm-40 -73.62 -29.27 62.26 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.08 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.515 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.03 -32.92 70.17 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.497 176.224 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.567 HD11 HD22 ' A' ' 63' ' ' LEU . 22.5 mm -70.22 -32.15 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.926 -176.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.416 ' HE2' HD11 ' A' ' 116' ' ' ILE . 31.8 mmtp -70.16 -40.52 74.67 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 -175.355 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 7.2 mt-30 -64.04 -36.86 85.37 Favored 'General case' 0 CA--C 1.497 -1.071 0 CA-C-N 113.681 -1.599 . . . . 0.0 109.968 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 74' ' ' ALA . 43.7 t -56.73 -46.86 83.24 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.812 0 O-C-N 124.649 1.218 . . . . 0.0 108.569 178.133 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 41.2 t -64.29 -46.77 92.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.275 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 44.3 mt-10 -57.91 -50.33 73.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.942 -178.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -73.89 -28.3 61.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.94 0.4 . . . . 0.0 111.635 -178.62 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.48 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.67 -38.54 58.67 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 120.962 0.41 . . . . 0.0 111.135 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 80' ' ' GLU . 13.9 pt20 -71.11 -38.17 72.35 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -30.72 65.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.685 -176.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 3.3 pt20 -74.68 -31.19 61.83 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.24 0.543 . . . . 0.0 110.499 -178.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.583 HD12 ' HA3' ' A' ' 92' ' ' GLY . 2.7 mm? -86.4 -37.31 18.51 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.172 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.18 -35.78 76.14 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.395 -178.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -83.35 -3.24 57.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.26 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -91.51 -70.99 1.19 Allowed Glycine 0 N--CA 1.437 -1.266 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.631 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.42 -37.56 0.14 Allowed 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.483 0.658 . . . . 0.0 110.29 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.2 -93.86 0.11 Allowed Glycine 0 N--CA 1.419 -2.448 0 N-CA-C 107.101 -2.4 . . . . 0.0 107.101 -178.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.583 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 75.42 -31.35 1.18 Allowed Glycine 0 C--O 1.2 -1.999 0 CA-C-O 119.413 -0.66 . . . . 0.0 114.721 173.428 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -47.83 -35.38 10.12 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 124.681 1.192 . . . . 0.0 112.201 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -74.17 -42.16 60.35 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.467 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 19.4 pt20 -77.45 -44.71 28.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.48 0.657 . . . . 0.0 110.133 -178.398 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.471 HG13 ' HA ' ' A' ' 37' ' ' THR . 94.1 t -64.5 -22.85 32.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 C-N-CA 124.789 1.236 . . . . 0.0 110.355 177.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -45.83 -46.0 15.29 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.004 0.522 . . . . 0.0 112.407 -178.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -65.08 -18.22 65.11 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.914 0.388 . . . . 0.0 111.957 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.416 ' O ' HD22 ' A' ' 36' ' ' LEU . 7.6 tpt -101.65 -49.25 4.06 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.3 p -63.02 -23.95 34.67 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.824 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -23.07 66.93 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 121.827 -0.546 . . . . 0.0 110.565 175.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 99' ' ' MET . 22.7 mtpp -67.56 -26.43 66.29 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.301 176.318 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.95 -32.26 73.65 Favored 'General case' 0 C--O 1.211 -0.949 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.312 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.47 ' HB3' HG21 ' A' ' 116' ' ' ILE . 14.1 mm100 -69.69 -19.98 63.56 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 122.079 0.943 . . . . 0.0 109.243 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 52.9 mtp -92.15 -19.12 22.6 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.03 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.409 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 3.3 mp -54.1 -45.52 99.05 Favored Pre-proline 0 N--CA 1.47 0.543 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -176.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 17.7 Cg_endo -61.19 -22.23 74.02 Favored 'Trans proline' 0 C--N 1.366 1.471 0 CA-C-N 120.791 1.318 . . . . 0.0 112.552 176.12 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -86.84 -45.19 11.1 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -69.53 -43.39 73.1 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.303 -177.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.413 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 13.9 t -86.36 -0.82 56.75 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -176.638 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 56.88 59.5 3.46 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 122.957 1.361 . . . . 0.0 109.973 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.439 HD21 HD11 ' A' ' 63' ' ' LEU . 57.5 mt -96.87 157.42 15.91 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 113.638 -1.619 . . . . 0.0 110.344 -178.726 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -78.77 43.87 0.51 Allowed 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 124.825 1.25 . . . . 0.0 112.492 -173.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 54.2 m -156.96 157.1 34.14 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 -176.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.0 m -136.83 140.88 42.75 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.47 HG21 ' HB3' ' A' ' 104' ' ' GLN . 38.4 mm . . . . . 0 N--CA 1.434 -1.253 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 175.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.823 ' SG ' ' HB2' ' A' ' 9' ' ' PRO . 4.1 t . . . . . 0 N--CA 1.427 -1.602 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 74.9 p -77.37 149.57 35.2 Favored 'General case' 0 C--N 1.271 -2.816 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.94 71.12 5.57 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 119.372 -0.931 . . . . 0.0 109.655 178.678 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 t -143.65 168.37 20.06 Favored 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 74.3 mt -129.7 115.35 18.07 Favored Pre-proline 0 C--N 1.308 -1.222 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.71 146.38 86.56 Favored 'Cis proline' 0 C--O 1.246 0.887 0 C-N-CA 123.863 -1.307 . . . . 0.0 111.981 0.089 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.823 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 91.1 Cg_endo -77.22 152.66 31.12 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.371 2.047 . . . . 0.0 112.802 -178.109 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 mm -109.36 111.64 37.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.0 m . . . . . 0 C--N 1.292 -1.915 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.229 -173.38 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 67.4 m . . . . . 0 N--CA 1.419 -1.977 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -106.95 101.83 11.23 Favored 'General case' 0 N--CA 1.42 -1.975 0 CA-C-O 122.176 0.989 . . . . 0.0 109.186 176.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -108.39 132.56 55.91 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.452 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.528 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.7 ptt-85 -67.58 114.19 6.02 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 121.832 0.825 . . . . 0.0 109.432 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.55 ' HB ' HE22 ' A' ' 81' ' ' GLN . 2.5 pp -68.0 -9.65 11.25 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 CA-C-N 115.254 -0.885 . . . . 0.0 113.203 -174.563 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -77.42 -20.52 54.46 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.519 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.3 pt20 -81.52 -20.98 38.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -89.27 -4.86 58.0 Favored 'General case' 0 CA--C 1.477 -1.84 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.623 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -55.92 -32.71 64.03 Favored 'General case' 0 C--O 1.218 -0.597 0 O-C-N 124.03 0.831 . . . . 0.0 110.808 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -66.28 -56.66 10.14 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.406 ' HB3' HG11 ' A' ' 78' ' ' VAL . 0.1 OUTLIER -54.22 -51.21 65.17 Favored 'General case' 0 C--O 1.218 -0.59 0 O-C-N 123.827 0.704 . . . . 0.0 109.715 178.98 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -50.68 -60.52 2.95 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 124.062 0.945 . . . . 0.0 112.422 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -67.84 -35.33 78.4 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.736 -173.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -73.99 -30.27 62.39 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.681 -177.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 99' ' ' MET . 95.9 mt -84.54 -24.64 29.21 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 179.007 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.463 ' HA ' HG13 ' A' ' 96' ' ' VAL . 71.3 p -84.76 -12.93 52.69 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.196 -1.402 . . . . 0.0 110.129 175.092 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.0 t -88.49 149.97 23.37 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.645 177.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.442 ' CZ ' ' HA ' ' A' ' 96' ' ' VAL . 50.7 m-85 . . . . . 0 N--CA 1.434 -1.264 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.513 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.452 -0.364 0 CA-C-O 120.583 0.23 . . . . 0.0 111.422 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -73.76 -45.05 54.22 Favored 'General case' 0 CA--C 1.491 -1.294 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.2 m -56.63 -36.38 69.41 Favored 'General case' 0 C--O 1.213 -0.837 0 O-C-N 123.907 0.754 . . . . 0.0 110.333 179.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 40.2 mt -79.3 -47.35 16.0 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.955 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.6 t -69.28 -50.39 47.35 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.765 -175.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.423 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 7.5 t -52.36 -43.43 64.67 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 124.178 0.991 . . . . 0.0 110.048 175.257 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.451 ' HA ' ' CD ' ' A' ' 64' ' ' GLN . 8.1 t30 -72.06 -23.76 61.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.373 -176.275 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -83.83 -48.18 10.33 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.255 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.541 ' O ' ' HG2' ' A' ' 71' ' ' GLN . 3.7 pp -65.21 -34.0 77.34 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-O 121.214 0.531 . . . . 0.0 111.037 -177.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.451 ' CD ' ' HA ' ' A' ' 61' ' ' ASN . 13.4 pt20 -69.31 -15.57 63.37 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.178 0.591 . . . . 0.0 111.865 -176.143 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -84.58 -11.44 56.01 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.479 0.657 . . . . 0.0 110.301 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 11.6 t -82.74 163.45 3.03 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 174.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 46.0 mt-10 -47.47 144.06 3.25 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.408 0.683 . . . . 0.0 111.657 176.213 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -63.19 -28.93 70.39 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -175.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.52 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 13.9 pt20 -80.0 -14.86 58.25 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.507 0.67 . . . . 0.0 110.399 177.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.52 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.7 m -110.94 -7.09 14.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.156 -173.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 72.0 mt-30 -62.95 -40.33 97.36 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.092 0.472 . . . . 0.0 110.347 177.545 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 114' ' ' CYS . 32.1 p -77.34 -23.83 50.86 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.419 176.408 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 14.1 mm-40 -71.0 -32.03 68.73 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.328 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.08 -27.01 68.81 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.815 177.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.491 HD11 HD22 ' A' ' 63' ' ' LEU . 31.0 mm -69.55 -32.5 53.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.734 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -70.8 -41.64 71.37 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 106.465 -1.679 . . . . 0.0 106.465 -174.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.426 HE21 ' HA ' ' A' ' 77' ' ' GLN . 0.1 OUTLIER -56.99 -44.07 82.34 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 112.492 -2.14 . . . . 0.0 110.584 -179.025 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.406 HG11 ' HB3' ' A' ' 32' ' ' CYS . 15.8 t -59.41 -45.96 93.09 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.584 0 O-C-N 124.079 0.862 . . . . 0.0 109.59 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 75' ' ' ILE . 40.1 t -65.53 -46.25 90.27 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.89 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -175.343 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -54.64 -51.85 64.12 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.196 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.55 HE22 ' HB ' ' A' ' 26' ' ' ILE . 3.6 pt20 -76.43 -34.46 58.77 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -175.544 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.54 -33.89 67.15 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.834 0.349 . . . . 0.0 111.098 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -76.37 -35.69 58.55 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.892 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.484 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -71.1 -35.87 71.97 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.088 -176.984 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.414 ' HG3' HD22 ' A' ' 86' ' ' LEU . 2.4 pt20 -68.63 -30.04 68.67 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 121.221 0.534 . . . . 0.0 110.7 -176.371 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.61 HD12 ' HA3' ' A' ' 92' ' ' GLY . 4.1 mm? -86.28 -37.48 18.51 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.982 175.188 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -60.91 -34.81 75.24 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.983 0.913 . . . . 0.0 111.868 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -75.62 -4.83 42.32 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.507 0.67 . . . . 0.0 111.738 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -105.24 -132.52 7.38 Favored Glycine 0 N--CA 1.428 -1.837 0 N-CA-C 110.984 -0.847 . . . . 0.0 110.984 178.026 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -88.62 -23.78 22.98 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 120.781 0.325 . . . . 0.0 111.686 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 157.98 -94.44 0.14 Allowed Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLY . . . . . 0.61 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 73.05 -36.91 0.76 Allowed Glycine 0 C--O 1.202 -1.847 0 N-CA-C 115.421 0.929 . . . . 0.0 115.421 176.263 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -49.32 -29.23 5.74 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 124.118 0.967 . . . . 0.0 113.462 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -77.03 -40.1 47.71 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 122.227 0.211 . . . . 0.0 111.204 178.233 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.403 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 4.1 pt20 -79.63 -45.88 18.25 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.55 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.518 HG21 ' HG ' ' A' ' 86' ' ' LEU . 84.4 t -62.22 -23.03 30.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 C-N-CA 125.29 1.436 . . . . 0.0 111.07 177.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -42.58 -52.34 4.82 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.427 1.091 . . . . 0.0 112.732 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 20.6 pt20 -60.12 -18.21 45.65 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.752 0.821 . . . . 0.0 112.778 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 5.6 tpt -106.01 -47.09 3.93 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -177.616 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.1 p -64.78 -23.78 34.15 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-O 120.899 0.381 . . . . 0.0 111.527 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.516 ' O ' ' HG3' ' A' ' 105' ' ' MET . 0.0 OUTLIER -61.69 -25.31 67.33 Favored 'General case' 0 C--O 1.218 -0.599 0 O-C-N 121.791 -0.568 . . . . 0.0 110.966 173.567 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -65.47 -27.93 68.85 Favored 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 122.499 0.32 . . . . 0.0 110.207 177.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.462 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -63.36 -36.18 82.87 Favored 'General case' 0 C--O 1.202 -1.401 0 CA-C-O 121.948 0.88 . . . . 0.0 109.001 175.634 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -76.82 -16.06 59.55 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.3 -178.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' MET . . . . . 0.516 ' HG3' ' O ' ' A' ' 101' ' ' LYS . 68.4 mtp -91.57 -14.7 29.83 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.057 178.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.462 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 96.9 mt -51.46 -50.09 78.61 Favored Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 123.559 0.537 . . . . 0.0 112.351 -178.494 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' PRO . . . . . 0.489 ' HD3' HG21 ' A' ' 75' ' ' ILE . 19.5 Cg_endo -61.38 -26.3 81.28 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.817 1.678 . . . . 0.0 112.663 177.102 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -83.1 -28.3 29.58 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-O 121.358 0.599 . . . . 0.0 109.616 -177.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -84.33 -47.85 10.31 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.452 0.644 . . . . 0.0 111.022 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 88.4 m -82.63 0.58 42.44 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -175.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 60.2 t30 56.87 61.68 2.53 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 122.175 0.988 . . . . 0.0 109.963 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 74.9 mt -95.09 158.52 15.43 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.735 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -72.55 17.65 0.11 Allowed 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.93 0.892 . . . . 0.0 113.318 -172.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 72' ' ' CYS . 83.1 m -148.31 158.01 43.83 Favored 'General case' 0 C--N 1.268 -2.949 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 -169.666 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 31.9 p -134.69 146.88 49.9 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.403 HG12 ' HG3' ' A' ' 107' ' ' PRO . 33.6 mm . . . . . 0 C--N 1.303 -1.431 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 177.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.479 0 N-CA-C 111.286 -0.726 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.58 ' HG3' ' HA2' ' A' ' 15' ' ' GLY . 48.6 mtm180 -76.47 141.07 41.44 Favored 'General case' 0 CA--C 1.485 -1.535 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 66.7 m -132.92 144.73 50.35 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 51.8 p -83.38 154.71 23.88 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.85 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -85.86 69.58 10.58 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.5 m -158.6 168.23 27.45 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 81.5 mt -128.22 123.16 22.38 Favored Pre-proline 0 C--N 1.309 -1.192 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -71.53 142.76 74.42 Favored 'Cis proline' 0 C--O 1.244 0.809 0 C-N-CA 123.642 -1.399 . . . . 0.0 112.61 0.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.88 142.49 39.15 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 122.353 2.035 . . . . 0.0 110.857 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.496 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 44.8 mm -101.68 107.72 22.13 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.262 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.56 ' HA ' ' O ' ' A' ' 2' ' ' ARG . 77.5 m -104.06 131.72 51.03 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 121.899 0.856 . . . . 0.0 111.618 -178.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -90.1 157.36 45.63 Favored Pre-proline 0 C--N 1.297 -1.685 0 CA-C-N 113.946 -1.479 . . . . 0.0 111.435 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.91 -6.78 17.8 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 122.881 2.388 . . . . 0.0 113.66 -177.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -144.16 160.36 41.06 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . 0.58 ' HA2' ' HG3' ' A' ' 2' ' ' ARG . . . -153.0 90.32 0.13 Allowed Glycine 0 N--CA 1.419 -2.443 0 C-N-CA 118.787 -1.673 . . . . 0.0 114.198 178.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -70.76 -27.55 64.02 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 174.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.574 ' HA ' ' OE1' ' A' ' 69' ' ' GLN . 12.6 t70 -98.47 105.59 17.76 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.323 -1.308 . . . . 0.0 107.831 176.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -141.84 61.37 12.69 Favored Pre-proline 0 C--N 1.304 -1.372 0 CA-C-O 121.055 0.455 . . . . 0.0 111.703 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.53 ' HA ' ' SG ' ' A' ' 22' ' ' CYS . 98.3 Cg_endo -75.54 8.02 2.81 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 123.042 2.495 . . . . 0.0 113.714 -172.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.496 ' HD3' ' H ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -102.87 -31.17 10.4 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 -179.3 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -135.6 46.07 1.06 Allowed Glycine 0 N--CA 1.419 -2.462 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.96 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.53 ' SG ' ' HA ' ' A' ' 19' ' ' PRO . 33.7 m -57.67 121.06 9.49 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-N 114.558 -0.821 . . . . 0.0 110.65 175.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -101.73 112.46 25.06 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 122.092 0.948 . . . . 0.0 109.994 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.406 HG21 ' CB ' ' A' ' 74' ' ' ALA . 3.0 mp -120.08 131.22 73.02 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.284 0 N-CA-C 105.637 -1.986 . . . . 0.0 105.637 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.471 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 24.4 ptt-85 -73.03 123.52 23.69 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 121.099 0.476 . . . . 0.0 109.744 -176.148 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.75 -16.65 21.38 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -174.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.437 ' CD ' ' HB2' ' A' ' 25' ' ' ARG . 17.8 pm0 -75.77 -18.31 59.57 Favored 'General case' 0 N--CA 1.421 -1.915 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.973 -178.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.6 pt20 -83.83 -19.53 34.8 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.408 HD22 ' HG2' ' A' ' 28' ' ' GLN . 2.4 mm? -91.75 3.26 55.52 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.624 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -59.11 -34.47 72.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 123.762 0.664 . . . . 0.0 109.317 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -69.73 -50.35 44.35 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.057 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.613 ' HA ' ' ND1' ' A' ' 35' ' ' HIS . 0.5 OUTLIER -58.11 -48.73 79.31 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 120.772 0.32 . . . . 0.0 110.338 178.408 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -52.52 -52.15 56.05 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 123.44 0.696 . . . . 0.0 111.651 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.4 ptm -70.64 -38.41 73.86 Favored 'General case' 0 C--O 1.205 -1.288 0 C-N-CA 120.676 -0.41 . . . . 0.0 111.062 -177.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.613 ' ND1' ' HA ' ' A' ' 32' ' ' CYS . 0.9 OUTLIER -70.83 -23.36 62.34 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.371 -0.532 . . . . 0.0 111.926 -176.147 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.449 HD22 ' O ' ' A' ' 99' ' ' MET . 91.5 mt -88.86 -39.08 14.09 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.218 174.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.529 ' HA ' HG13 ' A' ' 96' ' ' VAL . 41.1 p -83.61 -22.79 32.13 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 118.21 -1.396 . . . . 0.0 112.31 -175.203 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 t -92.5 121.74 34.25 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.903 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -87.06 93.14 9.28 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 169.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -65.26 169.92 5.21 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.025 -1.443 . . . . 0.0 112.455 -171.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 26.7 p90 -89.18 -31.73 17.8 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -166.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.42 -6.06 56.03 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 121.536 0.684 . . . . 0.0 110.09 -176.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 50.5 mt -78.52 86.9 4.51 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.236 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -95.78 -51.14 4.62 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 26.5 mmt -129.85 76.72 1.74 Allowed 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.651 ' HA ' ' OE1' ' A' ' 52' ' ' GLN . . . -80.86 78.83 7.62 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 114.823 -1.08 . . . . 0.0 112.022 -175.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 47.8 t -123.41 -70.76 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 176.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -137.48 96.37 3.24 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.51 0.671 . . . . 0.0 111.928 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.449 ' HB2' ' HG3' ' A' ' 52' ' ' GLN . 45.2 m-80 -146.62 120.45 5.15 Favored Pre-proline 0 C--N 1.303 -1.45 0 N-CA-C 105.712 -1.958 . . . . 0.0 105.712 176.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -53.23 -37.45 80.42 Favored 'Trans proline' 0 N--CA 1.484 0.947 0 C-N-CA 123.444 2.763 . . . . 0.0 114.625 -172.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -69.74 -15.08 63.08 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -176.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.651 ' OE1' ' HA ' ' A' ' 46' ' ' ALA . 19.1 mt-30 -68.44 -40.47 81.12 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -76.96 3.79 11.4 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.247 -0.888 . . . . 0.0 113.173 -175.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.611 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 11.8 pt20 -58.24 -36.4 73.14 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 121.102 0.477 . . . . 0.0 110.402 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -26.66 68.13 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.344 -178.235 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -83.13 -41.6 18.34 Favored 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.8 m -56.67 -31.52 64.51 Favored 'General case' 0 C--O 1.212 -0.882 0 O-C-N 123.708 0.63 . . . . 0.0 110.121 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 65.8 mt -82.99 -48.06 11.06 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.232 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.2 t -65.94 -50.07 65.72 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -178.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.536 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.7 t -59.31 -30.8 68.61 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.101 0.56 . . . . 0.0 110.29 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -78.7 -25.04 44.69 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.43 0.633 . . . . 0.0 111.471 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -84.9 -42.9 14.58 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.198 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.569 HD22 HD11 ' A' ' 75' ' ' ILE . 3.7 pp -68.49 -31.99 71.65 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.647 -177.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -71.2 -10.36 59.63 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -177.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -86.11 -12.43 50.04 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 121.816 0.817 . . . . 0.0 109.424 176.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 15.6 t -83.46 163.28 2.97 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.24 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 174.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.439 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 1.6 mp0 -48.2 142.23 5.58 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 124.187 0.995 . . . . 0.0 111.738 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -53.65 -35.58 61.15 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 124.767 1.227 . . . . 0.0 112.915 -174.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.574 ' OE1' ' HA ' ' A' ' 17' ' ' ASP . 3.2 pt20 -87.49 -20.81 26.02 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.221 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 59.5 m -95.17 -8.84 35.16 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.681 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.554 ' HB3' HD22 ' A' ' 112' ' ' LEU . 23.0 mt-30 -57.33 -43.12 83.1 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.87 176.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 6.5 p -80.87 -24.21 38.49 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.163 0.506 . . . . 0.0 111.177 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -67.92 -33.18 74.19 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.483 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.441 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.72 -31.29 68.15 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.459 177.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.569 HD11 HD22 ' A' ' 63' ' ' LEU . 21.1 mm -73.18 -27.57 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.238 0 CA-C-N 115.095 -0.957 . . . . 0.0 109.94 -177.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -74.54 -39.81 62.11 Favored 'General case' 0 CA--C 1.484 -1.589 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 -175.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -56.22 -40.42 74.04 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 112.626 -2.079 . . . . 0.0 109.215 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 74' ' ' ALA . 25.9 t -60.64 -47.9 90.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.929 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 42.3 t -61.6 -48.71 87.51 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.198 -174.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -61.75 -41.53 97.79 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.655 -175.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -79.97 -28.82 39.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.634 0.254 . . . . 0.0 111.163 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.98 -41.12 60.15 Favored 'General case' 0 C--N 1.311 -1.077 0 O-C-N 122.19 -0.319 . . . . 0.0 111.314 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -69.48 -35.63 75.78 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.126 -178.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.434 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -72.01 -36.23 69.66 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.178 -178.388 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.434 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 5.8 pt20 -72.8 -34.51 66.94 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.355 -174.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.472 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 2.4 mm? -76.79 -36.62 56.85 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.62 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -66.39 -40.35 89.62 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.623 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -75.12 -17.46 60.42 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.367 0.604 . . . . 0.0 110.157 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -83.08 -65.52 1.59 Allowed Glycine 0 N--CA 1.421 -2.357 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 28.4 pt20 -158.43 -26.2 0.08 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -175.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.472 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 146.38 -114.97 0.77 Allowed Glycine 0 CA--C 1.492 -1.397 0 N-CA-C 108.476 -1.85 . . . . 0.0 108.476 -174.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.23 -32.17 2.3 Favored Glycine 0 C--O 1.196 -2.252 0 CA-C-O 118.909 -0.94 . . . . 0.0 114.488 172.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -48.1 -32.66 7.11 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.921 0.888 . . . . 0.0 113.396 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -72.87 -38.12 67.11 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.964 0.412 . . . . 0.0 111.429 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.46 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 20.0 pt20 -85.43 -44.19 12.96 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 121.475 0.655 . . . . 0.0 109.662 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.529 HG13 ' HA ' ' A' ' 37' ' ' THR . 92.0 t -61.19 -22.53 27.55 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 C-N-CA 125.412 1.485 . . . . 0.0 110.933 176.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.41 ' HA ' HG12 ' A' ' 100' ' ' VAL . 53.3 tt0 -46.44 -46.23 18.63 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 20.1 pt20 -63.55 -18.5 63.92 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -178.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.449 ' O ' HD22 ' A' ' 36' ' ' LEU . 4.7 tpt -100.43 -46.83 5.11 Favored 'General case' 0 N--CA 1.438 -1.072 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -177.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' A' ' 97' ' ' GLN . 7.9 p -62.08 -26.17 39.38 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-O 120.834 0.35 . . . . 0.0 111.771 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -23.42 67.34 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.805 -0.559 . . . . 0.0 111.345 177.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -65.93 -25.59 67.21 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.024 178.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.22 -28.82 69.04 Favored 'General case' 0 C--O 1.203 -1.385 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.332 176.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -71.17 -24.52 62.26 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.265 1.031 . . . . 0.0 109.083 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 49.0 mtm -92.37 -13.02 30.78 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.528 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.46 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.1 OUTLIER -54.0 -46.75 98.52 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.226 0.61 . . . . 0.0 111.06 -177.965 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.597 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 20.3 Cg_endo -60.72 -26.89 83.88 Favored 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 121.382 1.388 . . . . 0.0 112.666 175.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -77.97 -46.98 19.62 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -64.64 -47.96 76.61 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.305 -0.862 . . . . 0.0 112.44 -177.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.4 ' SG ' HD11 ' A' ' 63' ' ' LEU . 10.2 t -84.08 -3.32 57.99 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.2 0.524 . . . . 0.0 109.701 -175.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.2 t30 58.17 64.23 1.55 Allowed 'General case' 0 C--O 1.247 0.944 0 CA-C-O 123.072 1.415 . . . . 0.0 110.717 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 71' ' ' GLN . 31.6 mt -101.63 158.52 16.03 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 112.992 -1.913 . . . . 0.0 109.015 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -72.92 44.68 0.14 Allowed 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 124.368 1.067 . . . . 0.0 112.988 -176.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.597 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 67.0 m -160.47 152.14 19.75 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -175.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.8 m -151.33 114.92 4.87 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 6.3 pt . . . . . 0 N--CA 1.428 -1.547 0 CA-C-O 118.459 -0.781 . . . . 0.0 112.546 -177.448 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.325 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.4 mtt85 -95.85 145.16 25.59 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 117.093 0.447 . . . . 0.0 110.538 -178.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 72.6 m -129.12 148.88 51.1 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 177.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.4 p -75.65 142.43 42.58 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 176.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.66 68.88 10.55 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.825 0.821 . . . . 0.0 109.976 178.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.1 t -150.5 170.96 17.86 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 105.936 -1.875 . . . . 0.0 105.936 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.3 mp -127.39 125.35 23.91 Favored Pre-proline 0 C--N 1.298 -1.635 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.29 143.26 76.7 Favored 'Cis proline' 0 C--O 1.243 0.76 0 C-N-CA 123.722 -1.366 . . . . 0.0 111.985 -1.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.77 129.76 21.72 Favored 'Trans proline' 0 C--O 1.254 1.282 0 C-N-CA 122.122 1.882 . . . . 0.0 111.43 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.416 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 37.6 mm -92.41 111.69 24.75 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 75.9 m -106.5 137.79 43.86 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.449 0.642 . . . . 0.0 111.305 -175.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -112.87 143.06 28.33 Favored Pre-proline 0 N--CA 1.415 -2.186 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.721 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -85.23 28.03 0.58 Allowed 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 123.056 2.504 . . . . 0.0 111.567 -179.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -120.06 135.4 54.95 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 115.271 -0.877 . . . . 0.0 108.896 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 148.68 -94.26 0.16 Allowed Glycine 0 CA--C 1.476 -2.351 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.486 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 20.6 tp -156.3 -56.72 0.09 Allowed 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 121.457 0.646 . . . . 0.0 109.921 -174.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -70.01 111.64 5.84 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.876 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -134.62 85.14 37.53 Favored Pre-proline 0 C--N 1.296 -1.748 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -81.99 -23.31 4.63 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 121.665 1.576 . . . . 0.0 111.587 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -144.16 -53.97 0.34 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.126 -1.805 . . . . 0.0 106.126 177.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 152.59 -53.5 0.47 Allowed Glycine 0 CA--C 1.473 -2.572 0 N-CA-C 105.527 -3.029 . . . . 0.0 105.527 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 60.0 m -86.23 127.75 34.8 Favored 'General case' 0 N--CA 1.409 -2.494 0 CA-C-N 113.231 -1.485 . . . . 0.0 108.576 170.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -107.6 117.07 33.12 Favored 'General case' 0 N--CA 1.416 -2.137 0 CA-C-O 121.871 0.843 . . . . 0.0 108.948 172.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.408 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.3 mp -111.69 143.34 21.69 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.64 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 -177.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.524 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.2 ptt180 -69.72 116.27 9.92 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 118.399 0.545 . . . . 0.0 110.382 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 pp -63.66 -14.8 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.395 0.617 . . . . 0.0 112.393 -175.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -73.43 -22.9 60.09 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.698 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.524 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.0 pt20 -83.73 -18.5 37.67 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.431 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.4 mm? -94.87 -0.7 53.8 Favored 'General case' 0 CA--C 1.48 -1.715 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.441 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -59.14 -30.97 68.53 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 123.751 0.657 . . . . 0.0 111.273 -178.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.404 ' O ' ' HG2' ' A' ' 34' ' ' MET . 3.4 t-160 -71.08 -52.56 18.68 Favored 'General case' 0 C--O 1.216 -0.662 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.825 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 1.6 t -56.47 -46.79 80.22 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 124.173 0.989 . . . . 0.0 109.032 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -53.11 -56.02 19.48 Favored 'General case' 0 N--CA 1.425 -1.692 0 C-N-CA 124.926 1.291 . . . . 0.0 111.349 174.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 31' ' ' HIS . 24.7 ptm -70.29 -33.66 71.82 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.397 -173.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.825 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -69.89 -23.42 63.25 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.631 -178.72 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.9 mt -88.54 -36.14 16.54 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.862 175.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.414 ' HB ' HD21 ' A' ' 86' ' ' LEU . 72.4 p -80.15 -19.78 46.41 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 119.161 -1.016 . . . . 0.0 112.809 -176.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 66.4 p -89.57 135.43 33.61 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -178.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -116.05 113.97 23.92 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 172.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -83.52 169.23 15.68 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -176.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 9.0 p90 -108.7 -28.56 9.17 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.544 -173.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.418 ' O ' ' HG2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -82.56 10.95 6.32 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 119.676 -0.81 . . . . 0.0 111.467 -174.562 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -66.82 106.7 1.95 Allowed 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 174.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.418 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 33.2 mmt180 -114.68 0.57 13.93 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.138 0.494 . . . . 0.0 110.678 -175.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 20.2 ptm -161.67 29.88 0.13 Allowed 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.463 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.71 89.23 3.07 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-O 121.445 0.64 . . . . 0.0 111.702 -177.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 61.1 t -122.39 -61.96 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 105.566 -2.012 . . . . 0.0 105.566 172.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -130.88 97.76 4.42 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 105.877 -1.897 . . . . 0.0 105.877 170.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.43 ' HB3' ' HG3' ' A' ' 52' ' ' GLN . 39.1 t-20 -144.59 129.95 9.49 Favored Pre-proline 0 C--N 1.286 -2.171 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -173.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.55 -26.99 83.83 Favored 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 123.084 2.523 . . . . 0.0 113.034 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -74.61 -9.56 58.69 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.43 ' HG3' ' HB3' ' A' ' 49' ' ' ASN . 21.6 mt-30 -70.87 -31.64 68.38 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.064 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -76.59 10.71 1.98 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.765 -174.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -61.05 -37.6 83.23 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.942 0.877 . . . . 0.0 109.594 175.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.413 ' HB2' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -74.12 -23.68 59.33 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.252 178.932 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.92 -38.73 61.74 Favored 'General case' 0 CA--C 1.495 -1.166 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.082 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 m -56.97 -35.59 69.33 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 42.4 mt -73.41 -51.67 16.45 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.247 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.6 t -60.78 -50.5 73.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 122.776 0.43 . . . . 0.0 111.277 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.542 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.4 t -59.44 -33.63 71.51 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 124.168 0.987 . . . . 0.0 110.161 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.43 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 16.9 t-20 -79.22 -23.21 43.93 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.517 0.675 . . . . 0.0 110.411 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -82.26 -48.26 11.44 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.857 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.593 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -67.41 -33.36 75.02 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.431 -177.299 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -69.59 -12.77 61.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.982 -176.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 68.6 mm-40 -89.39 -11.01 44.43 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.464 0.649 . . . . 0.0 109.569 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -80.84 164.45 3.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 174.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -45.6 136.5 5.81 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.828 0.451 . . . . 0.0 110.9 173.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.602 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 17.2 ptpt -57.9 -33.99 69.33 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -174.136 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.429 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 24.5 pt20 -76.11 -20.46 57.62 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.835 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.429 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 58.8 m -102.29 -9.38 20.44 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.776 -174.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.602 ' NE2' ' HA ' ' A' ' 68' ' ' LYS . 79.5 mt-30 -59.45 -42.62 92.38 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 121.17 0.509 . . . . 0.0 110.773 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.2 p -78.82 -24.22 44.62 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.279 0.562 . . . . 0.0 111.406 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -71.43 -32.54 68.49 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.442 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.477 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.84 -29.85 69.75 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.766 176.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.593 HD11 HD22 ' A' ' 63' ' ' LEU . 28.2 mm -68.9 -35.64 70.27 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.654 -178.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -63.48 -44.62 93.88 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -176.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 4.6 mt-30 -61.65 -41.92 98.18 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 113.322 -1.763 . . . . 0.0 110.32 -177.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 74' ' ' ALA . 38.2 t -53.31 -47.56 57.23 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.082 0 O-C-N 124.413 1.07 . . . . 0.0 109.359 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 75' ' ' ILE . 41.4 t -67.76 -45.83 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.091 0 CA-C-N 115.476 -0.783 . . . . 0.0 108.939 -174.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -56.94 -51.61 68.48 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.208 -178.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.465 ' HA ' ' HG3' ' A' ' 84' ' ' LYS . 20.3 pt20 -72.61 -31.74 65.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.648 -177.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.18 -38.46 66.15 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.871 0.367 . . . . 0.0 111.37 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -75.72 -34.75 60.37 Favored 'General case' 0 C--N 1.312 -1.043 0 C-N-CA 120.014 -0.674 . . . . 0.0 110.144 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.465 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -72.82 -31.7 65.0 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.14 -178.415 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -71.32 -33.33 69.57 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.579 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.591 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 4.1 mm? -78.66 -37.04 42.87 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.009 175.26 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -58.03 -41.73 83.85 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.924 0.89 . . . . 0.0 110.732 179.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -79.28 -14.41 59.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.777 -176.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -96.75 -105.88 2.3 Favored Glycine 0 N--CA 1.425 -2.04 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.988 -176.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -102.92 -17.35 15.53 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.145 0.498 . . . . 0.0 111.649 -175.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.591 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 128.08 -93.12 0.36 Allowed Glycine 0 N--CA 1.428 -1.889 0 N-CA-C 108.601 -1.8 . . . . 0.0 108.601 -173.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.576 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 72.25 -37.37 0.67 Allowed Glycine 0 C--O 1.193 -2.46 0 N-CA-C 115.77 1.068 . . . . 0.0 115.77 172.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -49.63 -27.7 4.93 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 118.538 1.169 . . . . 0.0 113.111 -178.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.439 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 29.1 pt20 -67.3 -45.0 77.84 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 120.67 0.271 . . . . 0.0 110.477 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 19.2 pt20 -86.51 -42.64 13.37 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 121.521 0.677 . . . . 0.0 111.075 -175.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.449 HG21 ' HG ' ' A' ' 86' ' ' LEU . 91.0 t -64.57 -22.95 32.33 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.191 0 C-N-CA 125.108 1.363 . . . . 0.0 111.766 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -48.1 -45.09 32.37 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 28.8 pt20 -61.3 -21.79 64.29 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 122.961 0.504 . . . . 0.0 112.322 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 3.3 tpt -100.42 -44.89 5.75 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -175.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.95 -24.13 34.88 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.516 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -23.66 67.38 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.755 -0.59 . . . . 0.0 110.578 176.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -63.26 -29.25 70.61 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -63.71 -29.88 71.05 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 121.191 0.52 . . . . 0.0 110.266 177.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -73.14 -17.23 61.41 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.792 0.806 . . . . 0.0 109.511 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 50.7 mtp -92.14 -20.61 21.06 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.331 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 5.0 mp -52.15 -45.51 93.84 Favored Pre-proline 0 N--CA 1.468 0.43 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.425 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 14.1 Cg_endo -59.79 -22.5 68.3 Favored 'Trans proline' 0 C--N 1.369 1.624 0 C-N-CA 121.141 1.227 . . . . 0.0 112.862 176.083 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -89.45 -45.82 9.16 Favored 'General case' 0 N--CA 1.411 -2.39 0 CA-C-O 121.126 0.488 . . . . 0.0 109.971 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -68.31 -38.95 82.09 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.868 -176.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.456 ' SG ' HD21 ' A' ' 112' ' ' LEU . 16.7 t -87.3 -6.46 58.51 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -179.01 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.1 t30 57.74 64.4 1.57 Allowed 'General case' 0 CA--C 1.508 -0.638 0 C-N-CA 124.91 1.284 . . . . 0.0 110.082 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.456 HD21 ' SG ' ' A' ' 110' ' ' CYS . 47.5 mt -96.04 159.46 14.95 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 113.372 -1.74 . . . . 0.0 109.935 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -71.7 37.53 0.06 Allowed 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 123.612 0.765 . . . . 0.0 112.709 -177.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 74.4 m -157.15 154.58 29.55 Favored 'General case' 0 C--N 1.28 -2.416 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -175.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 12.0 p -149.74 134.14 17.42 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 43.0 mm . . . . . 0 C--N 1.307 -1.241 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -178.872 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.814 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.444 ' HG2' ' HA3' ' A' ' 15' ' ' GLY . 34.7 mmt180 -86.27 141.71 29.08 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-N 117.546 0.673 . . . . 0.0 110.002 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 63.7 m -123.37 149.28 45.14 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 177.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 77.5 p -86.96 157.74 19.41 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.865 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -91.98 76.81 5.46 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.305 0.574 . . . . 0.0 109.594 176.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.9 t -152.01 172.0 16.96 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.6 mp -128.33 117.77 20.22 Favored Pre-proline 0 N--CA 1.435 -1.206 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.34 147.74 90.18 Favored 'Cis proline' 0 C--O 1.246 0.908 0 C-N-CA 123.596 -1.418 . . . . 0.0 111.801 -0.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -69.92 139.57 39.98 Favored 'Trans proline' 0 C--O 1.247 0.952 0 C-N-CA 122.164 1.909 . . . . 0.0 111.094 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.53 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 44.3 mm -97.44 111.44 27.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.955 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 73.6 m -105.35 125.0 50.49 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-O 121.491 0.662 . . . . 0.0 110.235 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -84.36 155.42 63.06 Favored Pre-proline 0 C--N 1.284 -2.244 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.422 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -70.58 -8.23 23.13 Favored 'Trans proline' 0 C--O 1.24 0.609 0 C-N-CA 122.657 2.238 . . . . 0.0 113.211 -177.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.413 ' CG ' ' H ' ' A' ' 15' ' ' GLY . 23.3 t70 -161.79 -148.16 0.14 Allowed 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . 0.444 ' HA3' ' HG2' ' A' ' 2' ' ' ARG . . . 161.51 -42.09 0.4 Allowed Glycine 0 N--CA 1.435 -1.422 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -141.96 -58.76 0.47 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -165.59 92.59 0.54 Allowed 'General case' 0 C--N 1.284 -2.24 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -130.46 75.15 79.47 Favored Pre-proline 0 C--N 1.297 -1.711 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.215 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -73.25 -40.02 1.86 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 121.956 1.771 . . . . 0.0 111.237 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.488 ' HD2' ' H ' ' A' ' 20' ' ' ARG . 0.1 OUTLIER -88.16 -34.11 17.96 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.086 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 124.57 -67.94 0.5 Allowed Glycine 0 CA--C 1.464 -3.123 0 N-CA-C 107.955 -2.058 . . . . 0.0 107.955 -177.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 67.8 m -67.1 133.09 49.17 Favored 'General case' 0 N--CA 1.418 -2.05 0 CA-C-N 114.307 -0.946 . . . . 0.0 109.414 172.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -107.11 108.54 20.05 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-O 121.869 0.843 . . . . 0.0 108.893 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.446 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.0 mp -102.49 141.3 18.84 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.691 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -175.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.5 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 20.6 ptt180 -67.11 114.14 5.63 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 121.672 0.749 . . . . 0.0 111.12 -177.121 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.23 -15.65 12.95 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -73.75 -23.19 59.7 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.835 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.5 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.3 pt20 -83.37 -33.31 25.83 Favored 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.721 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.472 HD11 ' HB1' ' A' ' 74' ' ' ALA . 2.0 mm? -82.15 -8.64 59.66 Favored 'General case' 0 CA--C 1.474 -1.971 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.021 -177.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -58.09 -30.27 66.11 Favored 'General case' 0 C--N 1.314 -0.937 0 O-C-N 124.17 0.919 . . . . 0.0 110.855 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -70.18 -54.66 11.9 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -54.08 -50.52 66.6 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.396 1.079 . . . . 0.0 108.524 -178.461 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -53.86 -61.15 2.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 125.504 1.522 . . . . 0.0 112.581 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -67.17 -34.87 78.46 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.831 0.348 . . . . 0.0 111.825 -172.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.433 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 8.9 t-80 -67.51 -33.13 74.46 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.804 -177.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 91.4 mt -84.64 -34.68 23.03 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.539 ' HB ' HD21 ' A' ' 86' ' ' LEU . 41.8 p -79.71 -21.01 45.14 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 118.83 -1.148 . . . . 0.0 113.165 -176.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 57.2 p -88.68 154.73 20.07 Favored 'General case' 0 N--CA 1.424 -1.727 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.829 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -128.09 132.0 49.03 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 173.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.466 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 5.2 t0 -85.65 171.71 11.44 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -176.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 55.3 p90 -102.78 -34.57 8.97 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -172.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.81 8.18 21.0 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.993 -175.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.466 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 60.0 mt -65.19 102.8 0.69 Allowed 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 175.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -94.16 -37.96 11.32 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-O 121.107 0.48 . . . . 0.0 111.212 -177.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 20.5 ptm -155.29 26.34 0.41 Allowed 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.96 -177.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.17 91.65 6.18 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.514 -177.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 92.0 t -116.3 -47.88 4.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.993 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -144.81 107.73 4.5 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-O 121.57 0.7 . . . . 0.0 110.607 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 30.8 p30 -157.36 154.25 25.23 Favored Pre-proline 0 C--N 1.302 -1.466 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.492 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 12.6 Cg_endo -55.39 -30.23 72.03 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.352 2.701 . . . . 0.0 113.137 -178.347 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -68.21 -33.5 74.53 Favored 'General case' 0 C--O 1.206 -1.196 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -177.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -70.75 -20.77 62.6 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.867 0.365 . . . . 0.0 111.252 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.492 ' OE1' ' HA ' ' A' ' 50' ' ' PRO . 45.7 mt-30 -79.65 4.17 16.89 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.196 -178.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.582 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 13.7 pt20 -59.42 -39.49 83.66 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.637 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.433 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -67.08 -20.75 65.86 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.498 -177.944 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.3 tp -74.97 -52.27 11.57 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 175.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.7 m -55.31 -27.66 48.41 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.929 -178.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 50.1 mt -88.34 -51.37 5.78 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.958 178.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.44 -50.19 60.35 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.94 0.496 . . . . 0.0 112.129 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.542 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 10.1 t -59.37 -41.43 89.29 Favored 'General case' 0 CA--C 1.492 -1.274 0 C-N-CA 123.412 0.685 . . . . 0.0 109.664 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -72.08 -26.67 62.25 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.944 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.465 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 7.0 tp60 -78.27 -48.92 14.67 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.474 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.644 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -67.61 -31.64 71.82 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.651 -177.095 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.404 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 11.7 pt20 -74.23 -6.96 50.92 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.693 -178.366 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.7 -24.12 56.2 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 174.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.9 t -81.19 161.84 3.68 Favored 'Isoleucine or valine' 0 C--O 1.248 1.025 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.302 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.452 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 47.7 mt-10 -50.2 141.48 11.3 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.984 0.914 . . . . 0.0 112.263 176.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -62.57 -24.79 67.73 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -174.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.465 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 12.4 pt20 -82.55 -15.36 52.59 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.458 0.647 . . . . 0.0 110.533 178.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.465 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 64.2 m -107.81 -9.34 15.78 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.167 -174.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 76.9 mt-30 -59.33 -40.83 87.57 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.42 ' HA ' HG12 ' A' ' 75' ' ' ILE . 14.5 p -81.2 -24.54 37.4 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.488 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.415 ' O ' ' HG3' ' A' ' 77' ' ' GLN . 7.7 mm-40 -67.74 -32.97 73.95 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.145 179.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.513 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -61.57 -34.89 76.37 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.361 177.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.644 HD11 HD22 ' A' ' 63' ' ' LEU . 30.8 mm -65.12 -37.18 79.57 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.787 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.274 -178.364 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -66.0 -43.18 88.45 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 -175.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.491 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.4 mt-30 -62.7 -41.22 99.01 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 113.47 -1.696 . . . . 0.0 109.402 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 74' ' ' ALA . 27.8 t -55.17 -46.82 77.87 Favored 'Isoleucine or valine' 0 C--N 1.356 0.859 0 O-C-N 123.769 0.668 . . . . 0.0 109.845 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 75' ' ' ILE . 21.2 t -70.07 -46.7 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.101 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -173.324 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -64.85 -35.25 80.53 Favored 'General case' 0 N--CA 1.424 -1.734 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.183 -174.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 13.7 pt20 -85.61 -26.35 26.13 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.979 0.419 . . . . 0.0 111.607 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.476 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -72.27 -44.94 62.07 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.105 0.478 . . . . 0.0 110.22 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -69.21 -29.55 67.54 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.413 ' HB3' ' HA ' ' A' ' 81' ' ' GLN . 7.4 tttt -65.04 -46.26 81.98 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 124.477 1.111 . . . . 0.0 111.332 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 2.7 pt20 -69.07 -23.29 64.01 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-O 121.339 0.59 . . . . 0.0 110.791 -175.104 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.539 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.4 mm? -86.13 -36.0 19.83 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.918 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -65.13 -37.4 87.32 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 123.327 0.651 . . . . 0.0 110.981 177.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -82.02 0.47 40.13 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.677 0.751 . . . . 0.0 111.069 -178.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -96.68 -120.15 3.83 Favored Glycine 0 N--CA 1.424 -2.119 0 N-CA-C 108.986 -1.646 . . . . 0.0 108.986 175.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -116.45 -56.56 2.28 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-O 121.114 0.483 . . . . 0.0 109.961 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -155.62 -141.07 3.13 Favored Glycine 0 CA--C 1.493 -1.29 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 -178.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 95.09 -30.3 8.27 Favored Glycine 0 C--O 1.202 -1.886 0 CA-C-O 119.128 -0.818 . . . . 0.0 113.227 177.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -49.44 -34.62 17.06 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 123.513 0.725 . . . . 0.0 112.812 -175.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -78.8 -33.24 46.38 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -85.45 -39.24 17.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.854 0.835 . . . . 0.0 110.092 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.514 HG13 ' HA ' ' A' ' 37' ' ' THR . 84.5 t -63.72 -22.67 31.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.328 -1.305 . . . . 0.0 110.501 174.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -46.15 -47.34 17.55 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 123.429 0.455 . . . . 0.0 112.128 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -59.46 -21.55 60.24 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.159 0.504 . . . . 0.0 112.028 -178.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.9 tpt -104.07 -45.22 4.79 Favored 'General case' 0 N--CA 1.423 -1.79 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.747 -173.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.26 -24.01 31.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 CA-C-O 121.077 0.465 . . . . 0.0 110.765 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -22.66 66.48 Favored 'General case' 0 C--N 1.333 -0.118 0 O-C-N 121.91 -0.494 . . . . 0.0 111.017 176.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -66.2 -28.24 68.61 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.37 177.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.536 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -62.85 -35.34 79.65 Favored 'General case' 0 C--O 1.201 -1.476 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 176.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -68.01 -18.87 64.84 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.565 0.698 . . . . 0.0 110.026 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 36.1 mtp -92.67 -13.97 28.73 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.317 -178.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 1.7 mm? -51.15 -44.97 88.82 Favored Pre-proline 0 N--CA 1.476 0.839 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.616 ' HD3' HG21 ' A' ' 75' ' ' ILE . 18.5 Cg_endo -60.67 -31.04 91.61 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 121.387 1.391 . . . . 0.0 112.417 176.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -77.26 -36.02 54.76 Favored 'General case' 0 N--CA 1.427 -1.608 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -178.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -75.11 -49.57 19.19 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.454 0.645 . . . . 0.0 111.254 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 38.8 t -82.19 -2.24 51.65 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.456 -173.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 66.46 42.93 2.74 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 122.765 1.269 . . . . 0.0 110.19 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 68.4 mt -82.4 157.67 23.61 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.057 -178.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -74.74 31.44 0.09 Allowed 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.587 1.155 . . . . 0.0 112.895 -175.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 99.3 m -154.5 160.04 41.32 Favored 'General case' 0 C--N 1.28 -2.419 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -173.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 27.1 p -146.4 144.57 29.82 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 70.8 mt . . . . . 0 C--N 1.301 -1.528 0 CA-C-O 118.243 -0.884 . . . . 0.0 109.076 -178.159 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.418 ' HA3' ' O ' ' A' ' 12' ' ' PHE . . . . . . . . 0 CA--C 1.502 -0.765 0 N-CA-C 111.364 -0.695 . . . . 0.0 111.364 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 77.9 mtp180 -95.24 139.88 30.93 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 50.5 m -120.5 145.09 47.63 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-O 120.828 0.347 . . . . 0.0 111.631 -175.172 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.4 p -79.01 161.33 26.69 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.438 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -85.37 69.71 10.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.438 0.637 . . . . 0.0 109.765 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.8 t -143.01 169.66 17.15 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 34.7 mm -129.15 112.61 18.39 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 178.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 7' ' ' ILE . 3.9 Cg_exo -76.92 146.48 84.0 Favored 'Cis proline' 0 C--O 1.246 0.891 0 C-N-CA 123.969 -1.263 . . . . 0.0 109.919 -2.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.44 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 43.4 Cg_endo -64.46 142.51 78.69 Favored 'Trans proline' 0 C--N 1.328 -0.549 0 C-N-CA 122.56 2.173 . . . . 0.0 112.065 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.431 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 42.0 mm -92.35 116.15 32.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.6 m -104.63 121.85 44.39 Favored 'General case' 0 C--N 1.285 -2.198 0 CA-C-O 121.609 0.718 . . . . 0.0 110.736 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.418 ' O ' ' HA3' ' A' ' 1' ' ' GLY . 60.0 m-85 -100.79 142.36 24.46 Favored Pre-proline 0 N--CA 1.427 -1.577 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.386 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -79.64 -10.75 14.37 Favored 'Trans proline' 0 N--CA 1.454 -0.825 0 C-N-CA 122.387 2.058 . . . . 0.0 113.626 -177.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -137.41 -167.31 2.09 Favored 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -173.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.56 24.54 28.07 Favored Glycine 0 N--CA 1.432 -1.568 0 N-CA-C 111.399 -0.68 . . . . 0.0 111.399 -175.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.6 HD23 ' H ' ' A' ' 16' ' ' LEU . 1.9 pt? -101.41 -18.13 16.16 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 121.044 0.45 . . . . 0.0 111.352 -176.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -122.47 110.51 15.7 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -133.29 99.88 14.37 Favored Pre-proline 0 C--N 1.293 -1.876 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.453 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . 32.0 Cg_exo -63.07 -40.73 32.05 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.323 2.016 . . . . 0.0 109.423 174.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.508 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 4.1 mpt_? -126.68 -47.51 1.54 Allowed 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 172.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.26 38.45 4.8 Favored Glycine 0 CA--C 1.473 -2.574 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.487 -177.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 68.1 m -67.98 137.67 55.31 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 114.256 -0.972 . . . . 0.0 110.028 177.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -100.61 112.83 25.27 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-O 121.714 0.769 . . . . 0.0 109.216 175.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.4 HG21 ' HB2' ' A' ' 74' ' ' ALA . 3.9 mp -114.33 139.03 42.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.969 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 -175.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.462 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 21.4 ptt-85 -67.12 121.77 16.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.487 0.66 . . . . 0.0 111.616 -175.11 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.38 -18.91 19.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 115.536 -0.757 . . . . 0.0 112.717 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -74.0 -17.23 61.02 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.192 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.518 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 1.2 pt20 -91.85 -19.05 22.93 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.157 -177.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.411 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.3 mm? -96.45 2.33 52.45 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.306 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.538 ' O ' ' HG2' ' A' ' 34' ' ' MET . 43.5 t30 -52.05 -39.72 60.06 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 124.754 1.283 . . . . 0.0 111.488 -178.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -70.61 -52.77 19.2 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -175.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.511 ' HB3' HG11 ' A' ' 78' ' ' VAL . 1.2 m -55.26 -50.2 70.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 123.866 0.729 . . . . 0.0 110.32 178.103 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -54.01 -59.84 4.12 Favored 'General case' 0 N--CA 1.433 -1.286 0 C-N-CA 123.707 0.803 . . . . 0.0 112.319 176.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.538 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.4 ptm -65.39 -41.05 94.12 Favored 'General case' 0 C--O 1.204 -1.322 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -66.8 -26.23 66.84 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 120.904 0.383 . . . . 0.0 110.302 -176.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 91.7 mt -88.32 -26.5 22.22 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.416 ' HA ' HG13 ' A' ' 96' ' ' VAL . 69.8 p -88.51 -19.25 26.66 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.587 -1.245 . . . . 0.0 111.578 176.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 74.3 p -90.01 139.4 30.64 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -120.62 86.73 2.62 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -74.94 174.2 9.63 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 114.186 -1.37 . . . . 0.0 111.017 -173.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -106.06 -30.68 9.13 Favored 'General case' 0 C--N 1.284 -2.283 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.917 -172.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.5 10.67 12.35 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.657 -0.817 . . . . 0.0 111.63 -174.431 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 52.5 mt -71.06 91.11 0.88 Allowed 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.313 175.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.3 mtm180 -93.22 -31.11 14.86 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 121.155 0.502 . . . . 0.0 110.687 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 65.5 mtt -116.91 69.48 0.76 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.866 0.841 . . . . 0.0 109.984 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -127.02 27.99 5.86 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.267 -1.333 . . . . 0.0 109.58 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 49.8 t -81.75 -66.54 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.224 -177.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -154.25 29.42 0.45 Allowed 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -82.98 132.91 49.47 Favored Pre-proline 0 C--N 1.284 -2.264 0 CA-C-N 114.15 -1.387 . . . . 0.0 111.477 -169.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -61.39 -17.4 53.15 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 122.695 2.263 . . . . 0.0 110.651 175.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -67.57 -17.72 64.74 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.404 178.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -70.2 -26.51 63.92 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.473 0.654 . . . . 0.0 109.594 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -74.6 5.42 4.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.772 -177.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.571 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 26.2 pt20 -53.99 -43.07 69.71 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.743 0.817 . . . . 0.0 110.031 176.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.439 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.0 OUTLIER -66.99 -26.46 66.81 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.321 -178.565 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -75.08 -43.69 51.69 Favored 'General case' 0 C--O 1.209 -1.071 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.6 m -57.87 -30.64 65.98 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.31 0.576 . . . . 0.0 110.79 178.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 56.5 mt -84.77 -56.16 3.73 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.506 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.3 t -62.1 -48.98 77.77 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.637 1.175 . . . . 0.0 111.397 -176.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.496 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 43.5 t -59.27 -36.53 75.7 Favored 'General case' 0 C--O 1.215 -0.755 0 C-N-CA 122.397 0.279 . . . . 0.0 110.456 178.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.532 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 8.6 t30 -71.71 -36.56 70.57 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-O 121.217 0.532 . . . . 0.0 110.466 -178.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.518 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 8.2 tp-100 -71.72 -44.24 64.49 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.914 -179.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.496 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.3 pp -72.8 -30.7 64.28 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 121.178 0.513 . . . . 0.0 110.961 -177.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.531 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 11.9 pt20 -72.36 -14.33 61.7 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -176.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.532 ' HG3' ' O ' ' A' ' 61' ' ' ASN . 44.3 mt-10 -80.22 -16.41 54.83 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-O 121.758 0.79 . . . . 0.0 109.363 177.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.423 HG12 ' HB2' ' A' ' 70' ' ' CYS . 18.8 t -79.61 163.13 3.65 Favored 'Isoleucine or valine' 0 C--O 1.25 1.128 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 175.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -51.03 145.09 7.89 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 123.856 0.862 . . . . 0.0 111.334 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.607 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 8.9 ptpp? -58.9 -32.53 69.6 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -176.079 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.429 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 13.1 pt20 -80.05 -21.61 43.26 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.637 0.732 . . . . 0.0 109.785 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.429 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.8 m -97.66 -13.07 21.72 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.653 -173.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.607 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 50.6 mt-30 -57.29 -46.62 82.97 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 121.175 0.512 . . . . 0.0 110.363 175.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.527 ' HA ' HG12 ' A' ' 75' ' ' ILE . 14.9 p -79.35 -23.63 43.27 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.924 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.551 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 10.2 mm-40 -66.62 -35.59 80.55 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 175.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.443 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.83 -25.25 66.49 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 123.551 0.74 . . . . 0.0 110.526 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.699 HG21 ' HD3' ' A' ' 107' ' ' PRO . 30.0 mm -73.8 -27.02 22.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.945 -178.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -75.89 -38.91 57.33 Favored 'General case' 0 CA--C 1.486 -1.494 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -175.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 73' ' ' GLU . 67.6 mm-40 -59.46 -44.15 93.05 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 111.56 -2.563 . . . . 0.0 109.711 -178.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.511 HG11 ' HB3' ' A' ' 32' ' ' CYS . 21.4 t -57.79 -45.72 87.13 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.708 0 O-C-N 123.627 0.579 . . . . 0.0 109.996 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 25.9 t -68.05 -47.04 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.317 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -174.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -55.28 -57.34 12.19 Favored 'General case' 0 N--CA 1.428 -1.571 0 O-C-N 124.836 1.335 . . . . 0.0 110.081 -178.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 19.4 pt20 -68.63 -30.02 68.65 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.02 -39.68 60.96 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 120.917 0.389 . . . . 0.0 111.093 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.448 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 13.7 pt20 -77.58 -37.02 51.42 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.649 -178.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.488 ' CG ' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -70.83 -30.45 66.88 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.34 0.126 . . . . 0.0 111.34 -177.794 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 2.8 pt20 -69.03 -28.68 66.78 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.229 0.537 . . . . 0.0 109.749 -178.435 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.433 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.3 mm? -87.8 -44.03 11.42 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.935 174.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -66.26 -22.48 66.32 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.47 1.108 . . . . 0.0 113.404 -176.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -66.5 -12.52 57.89 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -179.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 138.48 67.14 0.05 OUTLIER Glycine 0 CA--C 1.48 -2.138 0 C-N-CA 119.676 -1.25 . . . . 0.0 112.171 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -145.96 -58.11 0.31 Allowed 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 129.83 -134.91 8.09 Favored Glycine 0 N--CA 1.427 -1.963 0 N-CA-C 106.152 -2.779 . . . . 0.0 106.152 -174.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.63 -34.82 1.6 Allowed Glycine 0 C--O 1.196 -2.278 0 N-CA-C 115.352 0.901 . . . . 0.0 115.352 171.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -48.06 -29.52 3.62 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.651 1.18 . . . . 0.0 114.118 -176.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.479 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 26.5 pt20 -80.88 -43.72 19.45 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.287 0.565 . . . . 0.0 111.054 177.392 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.529 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 25.8 pt20 -84.08 -44.27 14.24 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 121.254 0.55 . . . . 0.0 111.649 -173.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.433 HG21 ' HG ' ' A' ' 86' ' ' LEU . 64.3 t -64.53 -23.48 33.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 C-N-CA 124.86 1.264 . . . . 0.0 110.418 178.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -51.11 -47.41 61.96 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 19.4 pt20 -67.82 -16.92 64.33 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.351 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 7.3 tpt -100.1 -49.07 4.41 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.5 p -59.95 -28.12 40.23 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.673 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.426 ' HE3' ' O ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -58.7 -25.05 62.49 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 175.468 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -65.13 -28.94 69.78 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 122.64 0.376 . . . . 0.0 110.529 177.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.423 ' HB2' ' CD1' ' A' ' 36' ' ' LEU . . . -60.78 -28.73 68.97 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.465 0.65 . . . . 0.0 110.987 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -73.16 -15.76 61.45 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.561 0.696 . . . . 0.0 110.988 -177.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 46.1 mtt -91.69 -13.97 30.83 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.878 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.474 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 98.3 mt -50.67 -48.09 83.54 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.452 -177.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.699 ' HD3' HG21 ' A' ' 75' ' ' ILE . 19.7 Cg_endo -59.19 -26.95 83.62 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 122.105 1.87 . . . . 0.0 113.113 177.152 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -83.59 -44.41 14.63 Favored 'General case' 0 N--CA 1.41 -2.438 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -74.93 -24.87 58.56 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.303 -175.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.416 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 25.6 t -98.8 -7.49 27.4 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.915 -178.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.3 t30 58.75 64.82 1.35 Allowed 'General case' 0 C--O 1.239 0.534 0 CA-C-O 122.819 1.295 . . . . 0.0 110.732 -176.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 107' ' ' PRO . 60.8 mt -99.67 158.95 15.41 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 113.272 -1.786 . . . . 0.0 110.07 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 -72.7 35.26 0.07 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.806 1.242 . . . . 0.0 112.608 -177.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 40.3 m -157.3 159.71 37.82 Favored 'General case' 0 C--N 1.276 -2.598 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 30.6 m -148.47 143.79 26.96 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 39.7 mm . . . . . 0 C--N 1.311 -1.091 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.316 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.466 ' HA2' ' O ' ' A' ' 14' ' ' ASP . . . . . . . . 0 CA--C 1.502 -0.739 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.5 mmt85 -94.43 126.36 39.65 Favored 'General case' 0 CA--C 1.477 -1.839 0 CA-C-N 117.805 0.803 . . . . 0.0 109.612 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 5.4 m -123.57 146.37 48.19 Favored 'General case' 0 C--N 1.279 -2.465 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.138 -173.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.8 p -73.68 156.26 38.13 Favored 'General case' 0 C--O 1.253 1.267 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -84.1 70.21 10.48 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.9 t -153.14 163.34 40.04 Favored 'General case' 0 N--CA 1.419 -1.996 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -178.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 78.2 mt -129.15 119.01 19.51 Favored Pre-proline 0 C--N 1.301 -1.539 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.26 144.18 72.34 Favored 'Cis proline' 0 C--O 1.246 0.878 0 C-N-CA 123.921 -1.283 . . . . 0.0 112.417 -1.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -71.45 133.74 23.11 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.1 1.866 . . . . 0.0 111.459 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.3 mm -92.01 113.58 27.58 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 178.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.2 t -123.06 134.83 54.25 Favored 'General case' 0 N--CA 1.41 -2.442 0 C-N-CA 118.771 -1.171 . . . . 0.0 111.872 -172.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -76.45 151.55 83.14 Favored Pre-proline 0 N--CA 1.427 -1.608 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.747 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.07 -27.63 84.66 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.552 2.168 . . . . 0.0 112.083 -176.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.466 ' O ' ' HA2' ' A' ' 1' ' ' GLY . 13.1 t70 -139.0 -71.11 0.41 Allowed 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.922 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.34 3.72 69.16 Favored Glycine 0 C--N 1.292 -1.893 0 N-CA-C 115.163 0.825 . . . . 0.0 115.163 173.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -125.48 -24.18 3.95 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 118.568 1.184 . . . . 0.0 112.117 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -87.76 119.86 28.5 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 175.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -141.91 81.64 14.4 Favored Pre-proline 0 C--N 1.296 -1.732 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -175.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -79.97 -21.95 7.78 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.236 1.957 . . . . 0.0 112.683 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -133.34 -63.87 0.74 Allowed 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 105.828 -1.915 . . . . 0.0 105.828 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -179.18 -60.88 0.08 OUTLIER Glycine 0 CA--C 1.476 -2.385 0 N-CA-C 106.989 -2.445 . . . . 0.0 106.989 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.9 m -74.84 129.35 37.52 Favored 'General case' 0 C--N 1.28 -2.423 0 CA-C-N 114.565 -0.817 . . . . 0.0 109.191 172.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -106.75 120.37 41.81 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.42 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.3 mp -114.51 143.8 23.46 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.631 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 -178.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.504 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 39.1 ptt180 -66.79 116.54 7.79 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -67.51 -15.54 19.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.363 -173.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -84.5 -9.74 58.08 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.6 -177.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 7.7 pt20 -87.23 -20.68 26.58 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 118.963 -1.095 . . . . 0.0 108.157 176.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.404 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.7 mm? -89.25 -5.24 57.78 Favored 'General case' 0 CA--C 1.474 -1.959 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.203 179.401 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -53.31 -31.99 46.74 Favored 'General case' 0 C--O 1.209 -1.061 0 O-C-N 124.525 1.141 . . . . 0.0 111.101 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 42.7 t-80 -67.23 -58.33 5.03 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.774 -0.371 . . . . 0.0 110.122 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -54.1 -49.98 67.9 Favored 'General case' 0 C--O 1.22 -0.451 0 O-C-N 123.752 0.657 . . . . 0.0 109.71 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -50.18 -58.66 5.09 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 124.579 1.151 . . . . 0.0 112.321 174.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -67.85 -43.46 79.42 Favored 'General case' 0 C--O 1.208 -1.118 0 O-C-N 121.992 -0.443 . . . . 0.0 112.136 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 28.7 m80 -66.21 -26.22 67.28 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.418 ' CD1' ' HB2' ' A' ' 103' ' ' ALA . 98.7 mt -88.58 -28.32 20.79 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 176.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.463 HG22 HG11 ' A' ' 96' ' ' VAL . 66.1 p -86.31 -11.69 51.49 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 119.305 -0.958 . . . . 0.0 111.341 178.222 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.5 p -89.08 121.88 31.85 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -107.77 101.66 10.94 Favored 'General case' 0 N--CA 1.423 -1.796 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 168.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.455 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 5.8 t70 -82.09 172.15 13.54 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.604 -174.185 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -104.28 -31.32 9.63 Favored 'General case' 0 C--N 1.284 -2.245 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -171.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.17 5.74 36.45 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.483 -0.887 . . . . 0.0 111.79 -175.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.455 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 50.9 mt -66.22 90.63 0.15 Allowed 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.405 177.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -120.57 -35.45 3.39 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.492 0.663 . . . . 0.0 109.57 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 58.4 mtt -105.59 5.67 31.48 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.789 -1.096 . . . . 0.0 108.89 -177.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -128.78 95.51 4.12 Favored 'General case' 0 N--CA 1.427 -1.599 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.18 -177.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 61.8 t -116.02 -63.91 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.587 0 N-CA-C 105.829 -1.915 . . . . 0.0 105.829 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -128.42 98.33 5.01 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 104.768 -2.308 . . . . 0.0 104.768 170.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -137.9 137.19 20.87 Favored Pre-proline 0 C--N 1.296 -1.752 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -170.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.556 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 11.0 Cg_endo -54.51 -28.52 55.31 Favored 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 123.445 2.764 . . . . 0.0 113.167 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -78.57 -14.1 59.5 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-O 120.991 0.424 . . . . 0.0 111.312 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -84.03 -17.28 40.92 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.099 0.476 . . . . 0.0 109.739 175.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.556 ' OE1' ' HA ' ' A' ' 50' ' ' PRO . 51.6 mt-30 -78.6 -0.11 28.53 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.025 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.572 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 13.3 pt20 -53.17 -40.38 64.31 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 124.532 1.133 . . . . 0.0 110.351 178.338 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.409 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.0 OUTLIER -65.92 -25.01 66.95 Favored 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.842 -176.699 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -79.75 -43.6 22.27 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.2 m -57.64 -33.26 68.1 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 123.702 0.626 . . . . 0.0 110.562 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 51.0 mt -84.52 -50.77 7.43 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.734 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.4 t -62.56 -49.56 74.81 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 123.243 0.617 . . . . 0.0 111.574 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.472 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 33.0 t -58.3 -38.62 77.42 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 122.597 0.359 . . . . 0.0 110.115 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.56 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 7.5 t30 -73.35 -29.97 63.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.317 0.58 . . . . 0.0 110.686 -177.146 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -77.15 -43.61 33.33 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.277 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.491 HD22 HD11 ' A' ' 75' ' ' ILE . 3.5 pp -72.23 -34.18 68.12 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.514 -177.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -70.65 -12.97 61.89 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -176.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 61' ' ' ASN . 37.0 mt-10 -84.5 -8.95 58.76 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-O 121.643 0.735 . . . . 0.0 110.294 177.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.405 HG12 ' HB2' ' A' ' 70' ' ' CYS . 39.9 t -83.92 163.23 2.92 Favored 'Isoleucine or valine' 0 C--O 1.247 0.971 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 173.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.464 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.1 mt-10 -51.51 142.69 13.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.072 0.549 . . . . 0.0 111.36 177.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -56.91 -33.79 67.3 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -175.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.44 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 19.7 pt20 -78.96 -21.3 47.36 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 121.381 0.61 . . . . 0.0 110.42 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.44 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 49.7 m -100.4 -11.02 20.58 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.473 -174.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 74.2 mt-30 -59.21 -43.81 92.29 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 123.241 0.617 . . . . 0.0 110.881 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.474 ' HA ' HG12 ' A' ' 75' ' ' ILE . 10.9 p -78.32 -23.39 47.07 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 120.258 -0.577 . . . . 0.0 111.728 177.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -68.37 -34.08 75.41 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.472 0.653 . . . . 0.0 110.323 177.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.67 -27.83 66.74 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.367 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.55 HG21 ' HD3' ' A' ' 107' ' ' PRO . 28.9 mm -71.64 -34.96 54.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.973 -178.098 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -64.29 -44.73 90.76 Favored 'General case' 0 C--O 1.249 1.052 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.8 mt-30 -58.28 -45.52 87.75 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 112.682 -2.054 . . . . 0.0 110.914 -176.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.404 HG22 ' HB3' ' A' ' 29' ' ' LEU . 19.6 t -52.45 -44.87 45.08 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.954 0 O-C-N 124.103 0.877 . . . . 0.0 110.06 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.19 -48.88 71.84 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -174.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.97 -39.26 94.15 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.632 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 20.2 pt20 -78.66 -32.65 47.29 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 120.751 0.31 . . . . 0.0 111.698 -179.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.6 -35.06 60.63 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.105 0.479 . . . . 0.0 111.642 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -76.03 -36.0 59.27 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.373 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.7 -32.2 65.57 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.059 -176.626 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 17.7 pt20 -69.4 -38.15 77.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.038 0.447 . . . . 0.0 110.176 -178.502 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.512 ' HG ' HG21 ' A' ' 96' ' ' VAL . 3.7 mm? -74.91 -33.34 61.99 Favored 'General case' 0 C--O 1.246 0.903 0 CA-C-O 121.074 0.464 . . . . 0.0 110.713 178.272 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -60.0 -43.59 95.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.948 -1.023 . . . . 0.0 110.511 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -88.92 -2.45 58.6 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.773 -176.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -98.57 -82.09 1.64 Allowed Glycine 0 N--CA 1.425 -2.053 0 CA-C-N 115.424 -0.807 . . . . 0.0 113.041 -177.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 27.3 pt20 -134.95 -23.4 1.54 Allowed 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -172.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 132.98 -127.89 4.92 Favored Glycine 0 CA--C 1.473 -2.556 0 N-CA-C 105.966 -2.854 . . . . 0.0 105.966 -170.077 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.542 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 78.86 -20.66 4.36 Favored Glycine 0 C--O 1.192 -2.487 0 CA-C-N 118.605 1.202 . . . . 0.0 114.151 174.376 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.415 ' HG3' ' H ' ' A' ' 93' ' ' GLN . 13.9 mt-30 -50.73 -37.95 44.63 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 125.551 1.541 . . . . 0.0 110.71 -175.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -78.57 -37.6 42.27 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.843 -178.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.542 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 10.5 pt20 -81.02 -42.55 20.93 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.345 0.593 . . . . 0.0 110.025 -178.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.512 HG21 ' HG ' ' A' ' 86' ' ' LEU . 90.3 t -63.96 -24.57 36.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 CA-C-N 114.823 -1.081 . . . . 0.0 110.205 177.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.429 ' HA ' HG12 ' A' ' 100' ' ' VAL . 28.3 tt0 -49.0 -44.5 41.28 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.05 0.54 . . . . 0.0 112.003 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 13.9 pt20 -69.4 -17.84 63.7 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -176.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 7.3 tpt -98.87 -47.18 5.38 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.429 HG12 ' HA ' ' A' ' 97' ' ' GLN . 14.6 p -62.76 -25.0 37.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.396 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -20.17 65.4 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.644 -0.66 . . . . 0.0 112.089 175.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -66.41 -28.59 68.74 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.483 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -64.25 -24.41 67.65 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-O 121.353 0.597 . . . . 0.0 110.562 178.117 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -75.17 -16.4 60.51 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.526 0.679 . . . . 0.0 110.38 -179.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' MET . . . . . 0.459 ' O ' ' HG2' ' A' ' 109' ' ' GLN . 46.0 mtt -88.18 -14.91 37.42 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.423 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.483 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 93.4 mt -49.46 -49.96 68.35 Favored Pre-proline 0 C--N 1.322 -0.589 0 O-C-N 123.654 0.596 . . . . 0.0 112.537 -177.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.55 ' HD3' HG21 ' A' ' 75' ' ' ILE . 20.8 Cg_endo -62.22 -23.97 75.79 Favored 'Trans proline' 0 C--N 1.365 1.421 0 C-N-CA 121.734 1.623 . . . . 0.0 113.267 177.405 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -82.75 -45.67 14.09 Favored 'General case' 0 N--CA 1.417 -2.119 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.459 ' HG2' ' O ' ' A' ' 105' ' ' MET . 10.6 mm100 -74.15 -39.15 63.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.958 -175.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 10.2 t -86.16 -3.62 59.0 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -177.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 58.33 61.79 2.18 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 124.701 1.2 . . . . 0.0 109.884 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.445 ' C ' ' H ' ' A' ' 114' ' ' CYS . 52.7 mt -94.59 160.16 14.76 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.591 -178.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -67.2 30.66 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.494 0 C-N-CA 124.935 1.294 . . . . 0.0 113.218 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.445 ' H ' ' C ' ' A' ' 112' ' ' LEU . 67.7 m -155.25 143.77 20.44 Favored 'General case' 0 C--N 1.274 -2.69 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -176.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 38.0 m -133.08 116.9 16.9 Favored 'General case' 0 C--N 1.286 -2.16 0 CA-C-O 120.873 0.368 . . . . 0.0 110.152 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.9 mm . . . . . 0 C--N 1.31 -1.126 0 N-CA-C 107.035 -1.469 . . . . 0.0 107.035 178.368 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -1.002 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mmm180 -95.08 151.28 19.33 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.795 ' SG ' ' HB2' ' A' ' 9' ' ' PRO . 4.0 t -146.64 161.25 40.95 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.5 p -85.47 157.2 20.52 Favored 'General case' 0 C--N 1.283 -2.312 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.304 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -87.74 76.58 8.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 177.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.7 m -147.41 160.26 42.76 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.153 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 69.4 mt -129.54 111.6 17.75 Favored Pre-proline 0 C--N 1.309 -1.156 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -73.65 143.83 79.08 Favored 'Cis proline' 0 C--O 1.241 0.648 0 C-N-CA 124.362 -1.099 . . . . 0.0 111.78 -0.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.795 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 74.5 Cg_endo -72.75 155.9 53.55 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.586 2.191 . . . . 0.0 112.681 -178.114 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.8 mm -110.96 112.0 38.65 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.493 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 64.6 m -103.51 143.89 32.12 Favored 'General case' 0 C--N 1.298 -1.653 0 C-N-CA 119.124 -1.03 . . . . 0.0 110.285 -174.299 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -98.36 153.23 38.12 Favored Pre-proline 0 C--N 1.296 -1.719 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.73 -175.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.79 45.96 1.92 Allowed 'Trans proline' 0 C--N 1.358 1.067 0 C-N-CA 123.638 2.892 . . . . 0.0 110.275 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.76 -53.0 63.31 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 125.994 1.718 . . . . 0.0 112.146 -177.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -106.04 -43.02 1.57 Allowed Glycine 0 C--N 1.291 -1.945 0 C-N-CA 120.237 -0.983 . . . . 0.0 110.668 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.4 pp -166.42 169.85 13.53 Favored 'General case' 0 N--CA 1.415 -2.184 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -140.71 19.25 2.34 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-O 121.231 0.538 . . . . 0.0 110.445 174.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.48 ' HB3' ' HB3' ' A' ' 23' ' ' GLN . 3.9 p-10 -72.44 118.17 65.3 Favored Pre-proline 0 CA--C 1.514 -0.437 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.148 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 18' ' ' ASN . 11.7 Cg_exo -75.35 -24.23 12.48 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.737 1.625 . . . . 0.0 111.884 177.256 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.465 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 1.5 mpt_? -132.26 -63.43 0.8 Allowed 'General case' 0 CA--C 1.483 -1.606 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 175.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -150.03 -52.21 0.02 OUTLIER Glycine 0 CA--C 1.474 -2.479 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.736 -177.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.5 m -85.12 128.66 34.74 Favored 'General case' 0 C--N 1.28 -2.423 0 CA-C-O 121.139 0.495 . . . . 0.0 110.487 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.48 ' HB3' ' HB3' ' A' ' 18' ' ' ASN . 23.4 pt20 -106.92 103.28 12.66 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.415 177.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.408 HG21 ' HB2' ' A' ' 74' ' ' ALA . 2.9 mp -108.54 132.34 56.7 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.557 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 -179.069 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.47 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 18.9 ptt-85 -67.42 121.42 15.73 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 123.799 0.687 . . . . 0.0 110.607 -177.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -64.58 -15.81 18.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.403 ' HG2' ' HB2' ' A' ' 25' ' ' ARG . 20.9 pt20 -75.56 -8.89 57.91 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.523 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.596 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 1.4 pt20 -98.49 -18.2 18.33 Favored 'General case' 0 N--CA 1.42 -1.959 0 C-N-CA 118.861 -1.136 . . . . 0.0 109.989 178.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -99.33 -3.84 33.07 Favored 'General case' 0 CA--C 1.476 -1.874 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.68 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.478 ' O ' ' HG2' ' A' ' 34' ' ' MET . 26.7 p30 -54.24 -32.24 55.5 Favored 'General case' 0 C--N 1.311 -1.1 0 O-C-N 124.022 0.826 . . . . 0.0 112.938 -178.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -68.8 -56.82 6.8 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.455 ' HB3' HG11 ' A' ' 78' ' ' VAL . 1.2 m -55.35 -49.82 71.25 Favored 'General case' 0 C--O 1.213 -0.827 0 O-C-N 123.869 0.731 . . . . 0.0 110.172 178.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -51.93 -57.2 10.13 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 123.489 0.716 . . . . 0.0 112.425 176.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 26.3 ptt? -68.31 -41.44 80.85 Favored 'General case' 0 CA--C 1.507 -0.709 0 C-N-CA 120.242 -0.583 . . . . 0.0 112.418 -174.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -72.05 -24.41 61.52 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.436 ' O ' ' HB3' ' A' ' 99' ' ' MET . 99.3 mt -88.65 -21.76 23.79 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 119.916 -0.713 . . . . 0.0 111.988 177.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.465 ' HA ' HG13 ' A' ' 96' ' ' VAL . 32.1 p -85.73 -21.15 28.4 Favored 'General case' 0 C--N 1.298 -1.651 0 C-N-CA 118.177 -1.409 . . . . 0.0 111.548 176.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.8 m -89.8 122.97 33.38 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.648 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -83.28 101.28 11.17 Favored 'General case' 0 N--CA 1.437 -1.108 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 171.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -76.34 177.98 6.87 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.508 -1.223 . . . . 0.0 111.106 -175.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -97.74 -38.93 9.29 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -171.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.82 4.6 9.37 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.943 0.878 . . . . 0.0 111.534 -175.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 69.8 mt -75.54 -8.86 57.84 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.354 176.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -55.07 -29.19 57.02 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 124.477 1.111 . . . . 0.0 112.433 177.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 65.7 mtm -120.12 21.59 11.74 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -134.87 95.41 3.32 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.628 -177.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 42.7 t -84.08 -60.96 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 176.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -140.1 86.7 2.1 Favored 'General case' 0 C--N 1.309 -1.187 0 C-N-CA 125.134 1.373 . . . . 0.0 107.597 173.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -120.48 150.57 52.36 Favored Pre-proline 0 C--N 1.306 -1.319 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.392 -175.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.418 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 36.9 Cg_endo -61.63 -23.13 75.96 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.985 2.457 . . . . 0.0 112.588 -177.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.7 mtpt -65.24 -23.13 66.98 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 178.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -68.89 -29.79 68.15 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.154 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 50' ' ' PRO . 10.8 pt20 -79.72 12.8 2.4 Favored 'General case' 0 C--O 1.211 -0.922 0 C-N-CA 119.698 -0.801 . . . . 0.0 112.205 -177.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.415 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 13.2 pt20 -61.1 -47.39 86.5 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-O 121.686 0.755 . . . . 0.0 109.13 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.4 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.4 p-80 -72.13 -20.79 61.57 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.637 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.83 -44.12 56.63 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 176.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.0 m -56.43 -34.72 67.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.069 0.461 . . . . 0.0 110.317 177.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 45.9 mt -78.49 -51.55 9.83 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.233 0.54 . . . . 0.0 110.838 178.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.9 t -63.57 -49.75 72.19 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.417 1.087 . . . . 0.0 111.076 -176.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.483 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 12.8 t -58.02 -37.99 75.35 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.613 0.765 . . . . 0.0 110.479 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -75.31 -25.05 57.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.514 0.673 . . . . 0.0 110.789 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.596 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 8.2 tp-100 -83.22 -42.91 16.7 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.321 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.483 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 4.0 pp -68.92 -28.29 66.53 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.609 0.718 . . . . 0.0 110.572 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.444 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 12.0 pt20 -75.77 -6.83 52.51 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.265 -177.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -84.03 -11.75 56.26 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-O 121.721 0.772 . . . . 0.0 109.12 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 12.4 t -89.25 164.5 2.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 CA-C-N 114.902 -1.045 . . . . 0.0 108.767 177.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -46.79 144.49 2.35 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.628 0.771 . . . . 0.0 111.031 173.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.539 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -61.3 -33.47 73.64 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.017 1.118 . . . . 0.0 114.017 -176.348 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.458 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 28.4 pt20 -75.53 -25.12 56.92 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.764 0.792 . . . . 0.0 110.004 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.458 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 60.1 m -94.27 -13.63 26.32 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.099 -174.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.539 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 54.3 mt-30 -56.87 -43.86 81.63 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 121.211 0.529 . . . . 0.0 110.202 175.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.476 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.8 p -79.9 -23.81 41.57 Favored 'General case' 0 N--CA 1.435 -1.213 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.414 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -68.88 -32.0 71.34 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.251 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 77' ' ' GLN . . . -62.28 -26.17 68.25 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 123.59 0.756 . . . . 0.0 110.183 177.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.527 HG21 ' HD3' ' A' ' 107' ' ' PRO . 31.0 mm -72.63 -31.2 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.356 -178.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -72.66 -40.81 66.05 Favored 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -175.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 53.2 mm-40 -57.6 -42.33 83.02 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 112.256 -2.247 . . . . 0.0 110.927 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.455 HG11 ' HB3' ' A' ' 32' ' ' CYS . 23.4 t -58.94 -46.49 91.39 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.79 0 O-C-N 123.833 0.708 . . . . 0.0 109.255 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.424 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 19.7 t -69.17 -42.24 81.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -58.88 -48.4 81.53 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.677 -178.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 9.1 pt20 -76.26 -35.55 58.89 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 123.122 0.264 . . . . 0.0 111.386 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.412 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -69.97 -35.92 74.81 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.901 0.381 . . . . 0.0 111.681 -178.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 28.9 pt20 -79.06 -35.46 42.48 Favored 'General case' 0 C--N 1.308 -1.215 0 C-N-CA 118.798 -1.161 . . . . 0.0 110.537 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.46 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -69.39 -30.16 68.08 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.097 -177.314 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -71.35 -37.99 71.66 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 121.216 0.531 . . . . 0.0 109.621 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.496 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 2.6 mm? -78.44 -35.45 46.82 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.471 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 52.4 tp60 -58.16 -43.39 87.38 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.222 0.609 . . . . 0.0 111.547 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.1 pt20 -81.85 -14.42 56.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.311 0.577 . . . . 0.0 110.141 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -84.87 -88.82 0.87 Allowed Glycine 0 N--CA 1.428 -1.848 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.262 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -125.79 -18.34 5.18 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.28 0.562 . . . . 0.0 111.873 -175.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.496 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 127.45 -104.2 0.68 Allowed Glycine 0 CA--C 1.476 -2.355 0 N-CA-C 106.713 -2.555 . . . . 0.0 106.713 -171.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.408 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 75.33 -32.21 1.15 Allowed Glycine 0 C--O 1.196 -2.247 0 N-CA-C 115.634 1.013 . . . . 0.0 115.634 170.045 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -47.36 -34.27 6.77 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.504 1.122 . . . . 0.0 112.291 -178.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -68.91 -45.08 71.8 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.528 178.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 11.9 pt20 -82.93 -47.18 12.07 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 121.074 0.464 . . . . 0.0 110.171 -176.156 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.465 HG13 ' HA ' ' A' ' 37' ' ' THR . 91.5 t -59.41 -22.69 23.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 125.66 1.584 . . . . 0.0 110.224 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -43.02 -45.12 5.02 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.165 0.986 . . . . 0.0 112.67 178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 13.6 pt20 -68.63 -17.77 64.17 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 7.7 tpt -101.96 -47.34 4.6 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.8 p -65.05 -24.13 34.79 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 120.831 0.348 . . . . 0.0 111.354 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.413 ' HG3' ' N ' ' A' ' 102' ' ' LYS . 15.2 ptpt -62.3 -24.82 67.52 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.748 -0.595 . . . . 0.0 110.956 174.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.413 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 26.3 mtpp -63.55 -30.9 71.95 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.49 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -59.9 -38.72 83.06 Favored 'General case' 0 C--O 1.204 -1.34 0 O-C-N 123.722 0.638 . . . . 0.0 109.861 176.09 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.45 ' HB3' HG21 ' A' ' 116' ' ' ILE . 41.2 mt-30 -72.79 -16.9 61.62 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.632 -177.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 43.4 mtt -82.23 -21.2 36.47 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.879 -0.513 . . . . 0.0 110.517 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 7.5 mp -47.43 -46.59 58.59 Favored Pre-proline 0 N--CA 1.481 1.076 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.527 ' HD3' HG21 ' A' ' 75' ' ' ILE . 18.8 Cg_endo -62.3 -22.38 74.03 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 120.897 1.356 . . . . 0.0 112.871 178.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 61.7 m-80 -89.35 -42.79 11.35 Favored 'General case' 0 N--CA 1.403 -2.799 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -73.56 -36.74 65.64 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.831 -177.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.404 ' SG ' HD21 ' A' ' 112' ' ' LEU . 16.1 t -89.94 -3.8 57.84 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 60.3 t30 55.43 63.4 2.1 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 124.779 1.232 . . . . 0.0 110.276 -177.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.419 HD21 HD11 ' A' ' 63' ' ' LEU . 52.4 mt -93.28 159.75 15.13 Favored 'General case' 0 C--N 1.284 -2.276 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.305 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -70.43 35.03 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.392 1.077 . . . . 0.0 113.405 -175.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 72' ' ' CYS . 57.4 m -158.02 156.4 31.05 Favored 'General case' 0 C--N 1.284 -2.249 0 C-N-CA 125.171 1.388 . . . . 0.0 107.284 -175.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 42.1 m -142.46 120.95 12.45 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.45 HG21 ' HB3' ' A' ' 104' ' ' GLN . 67.7 mt . . . . . 0 C--N 1.299 -1.619 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.769 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -71.9 143.41 49.36 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.7 m -134.34 161.21 35.61 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.46 -177.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 43.2 p -90.29 158.06 17.36 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 175.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -87.26 72.0 9.93 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.0 p -145.73 159.42 43.19 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 75.3 mt -128.83 117.24 19.38 Favored Pre-proline 0 C--N 1.299 -1.598 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -71.49 146.35 85.12 Favored 'Cis proline' 0 C--O 1.242 0.694 0 C-N-CA 124.109 -1.205 . . . . 0.0 112.3 0.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -71.97 145.83 45.94 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.619 2.213 . . . . 0.0 113.083 -177.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.6 mm -96.2 108.78 21.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.7 m -108.19 135.58 49.29 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-O 121.473 0.654 . . . . 0.0 112.271 -175.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -88.64 154.82 50.86 Favored Pre-proline 0 C--N 1.305 -1.35 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.268 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -37.45 -56.81 0.8 Allowed 'Trans proline' 0 C--N 1.368 1.576 0 C-N-CA 124.198 3.265 . . . . 0.0 113.997 -178.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -152.55 -64.15 0.16 Allowed 'General case' 0 CA--C 1.502 -0.898 0 C-N-CA 120.478 -0.489 . . . . 0.0 111.086 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . 0.423 ' HA3' HE22 ' A' ' 23' ' ' GLN . . . -157.07 107.27 0.32 Allowed Glycine 0 N--CA 1.418 -2.506 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 -176.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.622 HD23 ' H ' ' A' ' 16' ' ' LEU . 2.2 pt? -83.12 -13.32 55.87 Favored 'General case' 0 C--N 1.278 -2.517 0 CA-C-N 115.132 -0.534 . . . . 0.0 111.55 -179.364 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -99.47 94.79 6.6 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.767 0.794 . . . . 0.0 111.99 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -128.73 82.71 68.1 Favored Pre-proline 0 C--N 1.292 -1.92 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.962 175.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -65.5 -27.12 54.31 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 123.485 2.79 . . . . 0.0 113.473 -174.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.49 ' HD2' ' H ' ' A' ' 20' ' ' ARG . 0.2 OUTLIER -96.49 -51.18 4.44 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 -178.039 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 153.74 -55.68 0.43 Allowed Glycine 0 CA--C 1.457 -3.565 0 N-CA-C 107.48 -2.248 . . . . 0.0 107.48 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.466 ' SG ' ' HG3' ' A' ' 73' ' ' GLU . 95.2 m -84.51 134.62 34.42 Favored 'General case' 0 N--CA 1.405 -2.694 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 171.124 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.423 HE22 ' HA3' ' A' ' 15' ' ' GLY . 11.1 pt20 -106.2 113.06 26.36 Favored 'General case' 0 C--N 1.288 -2.099 0 CA-C-O 122.036 0.922 . . . . 0.0 108.82 173.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.442 HD11 ' HB2' ' A' ' 73' ' ' GLU . 3.3 mp -106.94 146.08 13.72 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.504 0 CA-C-N 114.116 -1.402 . . . . 0.0 107.785 -174.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.469 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 34.2 ptt180 -65.64 120.16 12.44 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-O 121.551 0.691 . . . . 0.0 109.171 -178.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 pp -69.88 -15.98 19.84 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.466 -175.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -71.67 -23.21 61.62 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.488 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.497 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 6.9 pt20 -83.83 -18.8 36.37 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.587 -178.055 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -94.31 -4.06 49.36 Favored 'General case' 0 CA--C 1.48 -1.719 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.236 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.529 ' O ' ' HG2' ' A' ' 34' ' ' MET . 41.9 t30 -57.15 -32.02 65.96 Favored 'General case' 0 C--N 1.317 -0.816 0 O-C-N 123.89 0.744 . . . . 0.0 110.646 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -69.53 -53.74 17.54 Favored 'General case' 0 C--O 1.221 -0.406 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.418 ' HB3' HG11 ' A' ' 78' ' ' VAL . 0.4 OUTLIER -55.61 -51.69 66.3 Favored 'General case' 0 C--O 1.222 -0.393 0 O-C-N 123.605 0.566 . . . . 0.0 109.832 178.778 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -51.77 -56.58 13.02 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 123.899 0.88 . . . . 0.0 112.468 176.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.529 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 26.6 ptm -69.92 -42.87 72.75 Favored 'General case' 0 CA--C 1.504 -0.81 0 C-N-CA 119.967 -0.693 . . . . 0.0 112.263 -174.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -67.35 -27.12 66.86 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.916 -175.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 94.8 mt -88.63 -28.48 20.62 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 112.17 0.434 . . . . 0.0 112.17 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.518 ' HA ' HG13 ' A' ' 96' ' ' VAL . 35.2 p -84.64 -21.67 30.18 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 118.233 -1.387 . . . . 0.0 111.451 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.8 p -91.36 121.65 33.28 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -89.55 90.18 8.15 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 166.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -76.61 169.88 17.46 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.473 -171.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -100.91 -33.64 10.12 Favored 'General case' 0 C--N 1.283 -2.286 0 CA-C-N 115.723 -0.671 . . . . 0.0 112.724 -168.154 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.68 7.23 21.12 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.054 -1.058 . . . . 0.0 111.974 -177.224 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 73.5 mt -80.1 37.84 0.39 Allowed 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 124.065 0.946 . . . . 0.0 110.582 177.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -73.44 -23.85 60.17 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -172.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 84.8 mtp -110.2 13.37 23.11 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 121.488 0.661 . . . . 0.0 109.512 177.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -137.68 84.09 2.02 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.19 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 57.3 t -93.67 -68.37 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.464 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.073 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -134.66 16.6 3.62 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 173.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.408 ' HB3' ' HD2' ' A' ' 50' ' ' PRO . 16.3 m120 -64.65 163.92 24.15 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 113.863 -1.517 . . . . 0.0 109.29 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 49' ' ' ASN . 17.8 Cg_endo -58.51 -19.5 44.72 Favored 'Trans proline' 0 C--N 1.367 1.548 0 C-N-CA 122.595 2.196 . . . . 0.0 112.117 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -59.64 -23.64 63.2 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.51 175.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -70.2 -15.45 62.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.942 0.401 . . . . 0.0 111.471 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -74.96 0.7 14.93 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 122.189 -0.319 . . . . 0.0 110.8 176.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.629 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 26.6 pt20 -55.07 -54.05 48.01 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.65 0.78 . . . . 0.0 110.275 175.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.458 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.8 p-80 -74.75 -22.17 58.93 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.54 -176.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -70.3 -44.89 67.41 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 175.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 51.0 m -57.37 -36.3 71.06 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 123.563 0.54 . . . . 0.0 110.574 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.629 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 35.9 mt -80.85 -53.19 6.69 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.627 -178.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 19.6 t -66.2 -48.34 70.95 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.198 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.502 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 32.8 t -58.46 -34.23 70.63 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 117.868 0.304 . . . . 0.0 110.653 176.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -76.41 -24.68 54.02 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.626 0.727 . . . . 0.0 110.6 -178.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.497 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 6.1 tp-100 -85.58 -46.88 10.39 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.639 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.541 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -64.27 -31.61 72.88 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.673 -177.417 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.417 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 7.3 pt20 -70.87 -10.28 59.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.641 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -75.87 -21.07 57.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 122.062 0.934 . . . . 0.0 108.841 176.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.468 HG12 ' HB2' ' A' ' 70' ' ' CYS . 8.9 t -82.26 163.61 3.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 176.332 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.59 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 31.9 mt-10 -54.84 144.07 23.8 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-O 119.268 -0.396 . . . . 0.0 110.695 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.437 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 18.1 ptpt -57.8 -31.78 66.9 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -77.18 -20.17 55.79 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.075 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.468 ' HB2' HG12 ' A' ' 66' ' ' VAL . 63.0 m -103.97 -10.67 17.94 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.866 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.59 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 78.5 mt-30 -62.82 -37.76 88.03 Favored 'General case' 0 C--O 1.217 -0.637 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.498 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.8 p -80.96 -24.51 38.03 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.549 176.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.466 ' HG3' ' SG ' ' A' ' 22' ' ' CYS . 8.4 mm-40 -67.22 -36.1 80.97 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 177.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.412 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -61.1 -28.5 69.13 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 123.577 0.751 . . . . 0.0 110.645 178.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.541 HD11 HD22 ' A' ' 63' ' ' LEU . 31.5 mm -69.68 -37.51 74.16 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.598 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -65.55 -41.11 93.36 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -177.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.465 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.8 mt-30 -61.03 -38.63 86.82 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 113.505 -1.68 . . . . 0.0 110.621 -178.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.418 HG11 ' HB3' ' A' ' 32' ' ' CYS . 20.8 t -61.11 -44.58 98.58 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.906 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 29.0 t -65.63 -47.77 84.99 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.894 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -174.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.414 ' CD ' HH21 ' A' ' 20' ' ' ARG . 52.6 mt-10 -58.68 -50.63 73.15 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.68 -178.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 11.0 pt20 -71.82 -31.72 66.83 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.835 0.35 . . . . 0.0 111.886 -177.022 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.72 -38.23 54.67 Favored 'General case' 0 C--N 1.315 -0.908 0 O-C-N 122.131 -0.356 . . . . 0.0 111.307 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -72.95 -34.08 66.3 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.357 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.551 ' O ' ' HG2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -70.67 -38.12 73.74 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.46 -178.156 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -68.07 -37.97 81.87 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.136 -175.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.479 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.6 mm? -76.64 -33.73 58.33 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.872 178.21 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.417 ' HB2' ' NE2' ' A' ' 93' ' ' GLN . 61.9 tt0 -64.85 -37.3 87.16 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.252 0.549 . . . . 0.0 110.509 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 84' ' ' LYS . 4.6 pt20 -90.49 0.33 57.36 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.667 0.746 . . . . 0.0 110.422 178.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -99.29 -100.6 2.26 Favored Glycine 0 N--CA 1.421 -2.337 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.896 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -118.18 -5.88 10.89 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.008 0.432 . . . . 0.0 112.025 -174.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.479 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 116.57 -101.37 0.97 Allowed Glycine 0 CA--C 1.468 -2.867 0 N-CA-C 106.825 -2.51 . . . . 0.0 106.825 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.466 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 72.4 -34.81 0.67 Allowed Glycine 0 C--O 1.196 -2.229 0 N-CA-C 116.082 1.193 . . . . 0.0 116.082 170.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.417 ' NE2' ' HB2' ' A' ' 87' ' ' GLN . 90.8 mt-30 -46.53 -34.25 4.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 118.322 1.061 . . . . 0.0 112.866 -176.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -71.41 -42.19 68.63 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 120.982 0.42 . . . . 0.0 111.449 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 92' ' ' GLY . 20.5 pt20 -82.83 -47.88 11.39 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 -176.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.518 HG13 ' HA ' ' A' ' 37' ' ' THR . 80.7 t -59.04 -22.83 22.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 125.461 1.504 . . . . 0.0 110.725 178.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -44.48 -46.15 9.56 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 123.562 0.745 . . . . 0.0 112.502 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -67.57 -18.02 64.85 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -176.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.8 tpt -102.29 -48.24 4.25 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.0 p -63.72 -24.09 34.96 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 CA-C-O 121.06 0.457 . . . . 0.0 111.183 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -21.02 66.59 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.703 -0.623 . . . . 0.0 111.539 176.228 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -67.33 -27.89 67.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 176.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.454 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -62.99 -32.11 73.38 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 121.599 0.714 . . . . 0.0 109.807 175.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -74.4 -15.46 60.92 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.645 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 61.2 mtp -90.33 -18.29 25.81 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.793 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.454 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 96.4 mt -50.25 -51.23 65.0 Favored Pre-proline 0 C--N 1.323 -0.544 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -176.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.511 ' HD3' HG21 ' A' ' 75' ' ' ILE . 18.0 Cg_endo -60.79 -24.92 80.13 Favored 'Trans proline' 0 C--N 1.362 1.282 0 C-N-CA 121.73 1.62 . . . . 0.0 113.169 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -84.47 -41.0 17.03 Favored 'General case' 0 N--CA 1.414 -2.251 0 CA-C-O 121.157 0.503 . . . . 0.0 109.822 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -80.37 -37.32 32.58 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.123 -176.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.415 ' SG ' HD21 ' A' ' 112' ' ' LEU . 24.2 t -84.38 -6.04 59.34 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.199 0.524 . . . . 0.0 109.693 -178.229 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 57.45 65.03 1.43 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 122.989 1.376 . . . . 0.0 110.784 -177.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.42 HD21 HD11 ' A' ' 63' ' ' LEU . 41.9 mt -93.67 159.41 15.23 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 113.272 -1.785 . . . . 0.0 109.363 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -75.88 35.79 0.13 Allowed 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 121.658 0.742 . . . . 0.0 112.094 -174.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.401 ' H ' ' C ' ' A' ' 112' ' ' LEU . 78.7 m -154.0 149.06 26.82 Favored 'General case' 0 C--N 1.285 -2.23 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 -176.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 25.7 p -136.1 132.38 36.04 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 118.114 0.416 . . . . 0.0 110.189 -176.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 26.6 mm . . . . . 0 C--N 1.308 -1.205 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 178.738 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.591 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.481 ' HG2' HD21 ' A' ' 18' ' ' ASN . 12.0 mmt180 -95.14 127.52 41.26 Favored 'General case' 0 CA--C 1.471 -2.063 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 58.3 m -118.95 140.81 49.37 Favored 'General case' 0 C--N 1.26 -3.297 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.288 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.9 p -71.27 151.11 44.55 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.773 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -79.12 72.0 5.65 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.359 0.6 . . . . 0.0 110.355 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.9 t -149.08 163.92 36.17 Favored 'General case' 0 N--CA 1.419 -2.02 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.3 mt -129.75 118.82 18.87 Favored Pre-proline 0 C--N 1.304 -1.391 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -75.32 140.93 69.67 Favored 'Cis proline' 0 C--O 1.243 0.727 0 C-N-CA 123.809 -1.329 . . . . 0.0 110.876 -1.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.416 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 43.7 Cg_endo -67.08 152.01 80.76 Favored 'Trans proline' 0 C--O 1.244 0.79 0 C-N-CA 122.954 2.436 . . . . 0.0 113.21 -175.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.7 mm -102.81 118.26 49.45 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 75.8 m -105.81 130.75 53.73 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-O 121.62 0.724 . . . . 0.0 111.625 -176.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -114.05 152.53 45.86 Favored Pre-proline 0 C--N 1.29 -2.013 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.83 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -57.34 -46.02 30.76 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 122.417 2.078 . . . . 0.0 110.235 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.439 ' HA ' ' ND2' ' A' ' 18' ' ' ASN . 15.8 t0 -147.11 160.71 42.1 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 115.049 -0.978 . . . . 0.0 108.532 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -130.98 -13.54 1.96 Allowed Glycine 0 N--CA 1.413 -2.838 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.32 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -170.27 -50.49 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 117.124 0.462 . . . . 0.0 111.474 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -170.08 100.65 0.29 Allowed 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.764 -174.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.481 HD21 ' HG2' ' A' ' 2' ' ' ARG . 94.3 m-20 -117.93 85.67 23.61 Favored Pre-proline 0 C--N 1.312 -1.045 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.375 176.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -82.48 -15.65 8.55 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.006 1.804 . . . . 0.0 110.586 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.435 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 0.7 OUTLIER -140.91 -47.22 0.4 Allowed 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 176.901 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 144.7 -63.92 0.47 Allowed Glycine 0 CA--C 1.478 -2.236 0 N-CA-C 108.977 -1.649 . . . . 0.0 108.977 178.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.7 m -66.63 135.58 54.31 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 114.577 -0.811 . . . . 0.0 109.033 171.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -99.95 91.74 4.95 Favored 'General case' 0 N--CA 1.422 -1.831 0 CA-C-O 122.439 1.114 . . . . 0.0 110.978 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.409 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 3.5 mp -94.14 138.39 20.67 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.818 0 N-CA-C 105.328 -2.101 . . . . 0.0 105.328 177.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.463 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.5 ptt-85 -71.66 120.54 17.39 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.057 0.456 . . . . 0.0 110.0 -176.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -63.53 -16.31 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-O 121.288 0.566 . . . . 0.0 112.236 -176.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -77.14 -17.74 58.4 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.62 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.463 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.6 pt20 -86.62 -29.2 22.74 Favored 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 119.401 -0.919 . . . . 0.0 108.544 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -85.11 -7.79 58.93 Favored 'General case' 0 CA--C 1.473 -2.004 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.491 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 34' ' ' MET . 8.6 t30 -54.12 -34.84 61.32 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 124.335 1.022 . . . . 0.0 110.889 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -69.06 -55.12 11.74 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -52.29 -53.74 40.27 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 125.114 1.366 . . . . 0.0 108.347 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -49.55 -61.34 2.16 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 126.101 1.76 . . . . 0.0 112.45 175.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.3 ptm -69.82 -28.69 65.91 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -173.468 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.624 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 3.0 t-80 -72.48 -25.72 61.53 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-O 121.139 0.495 . . . . 0.0 109.834 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.5 mt -88.52 -32.17 18.33 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.41 177.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.492 ' HA ' HG13 ' A' ' 96' ' ' VAL . 58.9 p -82.75 -22.14 34.45 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 118.622 -1.231 . . . . 0.0 111.785 -178.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.8 t -90.94 127.73 36.51 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.256 0.551 . . . . 0.0 111.934 -178.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -105.2 -179.56 3.98 Favored 'General case' 0 N--CA 1.423 -1.791 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 171.16 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -139.92 172.71 12.38 Favored 'General case' 0 C--N 1.285 -2.236 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.6 p90 -96.53 -34.63 11.39 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -168.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.2 15.03 18.31 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.44 -175.091 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 68.4 mt -65.36 96.25 0.23 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.673 177.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -106.93 -24.72 11.93 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 69.9 mtm -137.15 87.63 2.29 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.483 ' HA ' ' HG3' ' A' ' 52' ' ' GLN . . . -131.46 12.95 5.01 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.695 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 22.0 t -73.3 -59.56 3.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-O 121.298 0.571 . . . . 0.0 110.035 -177.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -134.54 82.06 1.94 Allowed 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -140.3 136.61 17.0 Favored Pre-proline 0 C--N 1.297 -1.689 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.027 -174.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -41.25 -50.62 4.34 Favored 'Trans proline' 0 C--N 1.363 1.307 0 C-N-CA 124.856 3.704 . . . . 0.0 114.639 -176.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -75.86 -10.02 59.08 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -175.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.483 ' HG3' ' HA ' ' A' ' 46' ' ' ALA . 70.3 mm-40 -102.87 -11.63 18.13 Favored 'General case' 0 C--N 1.295 -1.787 0 C-N-CA 119.948 -0.701 . . . . 0.0 109.922 -178.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.5 pt20 -117.13 8.54 13.31 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 121.772 0.796 . . . . 0.0 109.789 178.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.483 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 13.7 pt20 -65.47 -28.88 69.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.035 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.624 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.6 OUTLIER -58.17 -26.62 62.96 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.349 179.494 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.3 tp -72.22 -52.03 18.33 Favored 'General case' 0 CA--C 1.489 -1.403 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.0 m -59.23 -21.76 60.05 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.614 -176.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 41.1 mt -89.76 -57.66 2.79 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.014 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 52.2 t -64.39 -50.51 67.39 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.155 0.982 . . . . 0.0 112.372 -175.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.547 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 12.1 t -59.23 -39.68 83.52 Favored 'General case' 0 CA--C 1.495 -1.145 0 CA-C-O 121.613 0.721 . . . . 0.0 109.281 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.425 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 27.9 t-20 -70.77 -28.03 64.36 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.956 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -81.13 -42.56 20.73 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.325 0.583 . . . . 0.0 110.446 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.547 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.7 pp -72.25 -31.65 65.99 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.908 -176.611 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.425 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 17.6 pt20 -68.9 -15.16 63.42 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.711 -176.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -81.7 -22.67 37.28 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.309 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.7 t -70.75 161.65 4.54 Favored 'Isoleucine or valine' 0 C--O 1.249 1.026 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.438 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.3 mt-10 -50.09 140.63 12.29 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 123.417 0.687 . . . . 0.0 112.298 178.061 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -55.17 -33.31 62.86 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.111 0.564 . . . . 0.0 112.471 -177.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.417 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 13.9 pt20 -81.9 -7.35 59.6 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.068 0.461 . . . . 0.0 110.576 -178.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.417 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 61.3 m -117.5 -11.28 10.51 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -174.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.536 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 75.9 mt-30 -57.96 -48.54 79.64 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.258 0.623 . . . . 0.0 112.03 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.408 ' HA ' HG12 ' A' ' 75' ' ' ILE . 14.7 p -74.82 -23.12 58.42 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.804 -0.759 . . . . 0.0 112.145 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -68.3 -32.54 72.75 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.613 0.721 . . . . 0.0 109.614 178.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.43 -28.75 67.24 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.704 177.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.561 HG21 ' HD3' ' A' ' 107' ' ' PRO . 27.8 mm -70.98 -32.95 50.03 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -176.249 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -66.46 -44.14 83.58 Favored 'General case' 0 CA--C 1.491 -1.32 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 -177.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.515 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.3 mt-30 -59.16 -46.22 88.95 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 113.103 -1.862 . . . . 0.0 110.349 -177.25 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 74' ' ' ALA . 19.6 t -53.42 -44.7 56.08 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 O-C-N 124.211 0.944 . . . . 0.0 110.138 -179.015 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 75' ' ' ILE . 26.1 t -70.12 -45.04 77.5 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -175.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -60.04 -52.58 64.75 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.678 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 20.7 pt20 -70.61 -31.76 68.86 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.855 -176.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.465 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -72.11 -41.46 67.21 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.76 0.314 . . . . 0.0 111.193 178.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -72.1 -37.84 69.47 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 119.99 -0.684 . . . . 0.0 110.089 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.451 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -68.77 -32.34 72.01 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -178.097 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 1.7 pt20 -71.19 -28.84 64.51 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 121.683 0.754 . . . . 0.0 109.755 -177.096 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.604 HD12 ' HA3' ' A' ' 92' ' ' GLY . 3.7 mm? -86.29 -37.28 18.7 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.965 176.039 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -58.18 -36.45 73.07 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.925 1.29 . . . . 0.0 111.333 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -80.19 -9.89 59.74 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-O 121.018 0.437 . . . . 0.0 111.302 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -113.82 -115.57 3.21 Favored Glycine 0 N--CA 1.43 -1.732 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.017 -177.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -71.24 -43.26 67.62 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 124.198 0.999 . . . . 0.0 111.371 -174.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.536 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 142.68 -85.95 0.19 Allowed Glycine 0 CA--C 1.478 -2.224 0 N-CA-C 107.007 -2.437 . . . . 0.0 107.007 -171.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.604 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 74.18 -44.55 1.36 Allowed Glycine 0 C--O 1.199 -2.08 0 N-CA-C 115.531 0.972 . . . . 0.0 115.531 171.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.466 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 50.9 mt-30 -44.37 -30.94 0.92 Allowed 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 125.292 1.437 . . . . 0.0 113.677 -176.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -75.88 -41.3 52.54 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 120.819 0.342 . . . . 0.0 111.321 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -85.51 -43.88 13.17 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.62 0.724 . . . . 0.0 110.227 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.492 HG13 ' HA ' ' A' ' 37' ' ' THR . 75.9 t -63.81 -22.72 31.62 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 C-N-CA 125.781 1.632 . . . . 0.0 110.547 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 64.5 tt0 -45.48 -45.65 13.22 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.478 0.711 . . . . 0.0 112.844 -178.135 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -67.25 -21.97 65.71 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -177.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.9 tpt -94.94 -49.55 5.51 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -176.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.9 p -61.51 -28.31 43.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.813 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -24.45 65.21 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 177.613 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -62.46 -38.03 88.22 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.507 ' HA ' HD13 ' A' ' 106' ' ' LEU . . . -52.07 -35.55 47.91 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.581 178.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -68.14 -17.25 64.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.134 0.492 . . . . 0.0 111.239 -178.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 40.8 mtt -91.81 -14.57 29.57 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -178.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.507 HD13 ' HA ' ' A' ' 103' ' ' ALA . 6.9 mp -53.16 -45.49 98.25 Favored Pre-proline 0 C--O 1.207 -1.182 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.561 ' HD3' HG21 ' A' ' 75' ' ' ILE . 19.6 Cg_endo -61.52 -26.49 80.88 Favored 'Trans proline' 0 C--N 1.358 1.07 0 CA-C-N 121.067 1.417 . . . . 0.0 112.125 176.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -83.51 -42.87 16.38 Favored 'General case' 0 N--CA 1.417 -2.124 0 CA-C-O 121.277 0.56 . . . . 0.0 110.277 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -79.92 -38.89 31.48 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -176.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 19.6 t -80.77 -5.73 57.55 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 45.4 t30 64.32 58.82 1.07 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 122.952 1.358 . . . . 0.0 109.873 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 49.5 mt -100.23 158.43 15.87 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-N 113.536 -1.666 . . . . 0.0 108.228 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -82.83 45.53 1.01 Allowed 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.62 0.724 . . . . 0.0 111.194 -174.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 48.7 m -157.35 160.55 38.59 Favored 'General case' 0 C--N 1.292 -1.893 0 C-N-CA 124.994 1.318 . . . . 0.0 107.889 -176.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.8 m -149.36 135.77 19.25 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 176.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 81.0 mt . . . . . 0 C--N 1.304 -1.402 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -178.673 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.167 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -94.92 141.68 28.36 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-N 116.982 0.391 . . . . 0.0 109.979 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 62.7 m -116.81 149.35 40.13 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.3 p -84.6 156.56 21.53 Favored 'General case' 0 C--N 1.296 -1.727 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -79.81 74.57 6.53 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 122.082 0.944 . . . . 0.0 109.595 174.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 47.5 t -136.92 157.72 46.1 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.101 -1.409 . . . . 0.0 107.286 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.6 mm -128.51 109.65 19.15 Favored Pre-proline 0 C--N 1.294 -1.819 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 176.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -73.97 150.81 96.17 Favored 'Cis proline' 0 C--O 1.253 1.271 0 C-N-CA 124.177 -1.176 . . . . 0.0 111.322 -3.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.417 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 57.9 Cg_endo -70.18 150.84 66.2 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.722 2.281 . . . . 0.0 113.178 -175.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.416 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 46.9 mm -97.31 114.19 33.73 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.052 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 82.3 m -106.6 129.04 54.59 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-O 121.277 0.56 . . . . 0.0 111.522 -176.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -73.38 151.93 89.86 Favored Pre-proline 0 C--N 1.307 -1.239 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.283 177.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -78.22 2.62 7.84 Favored 'Trans proline' 0 C--O 1.249 1.062 0 C-N-CA 122.685 2.256 . . . . 0.0 113.407 -176.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -167.21 -169.67 1.31 Allowed 'General case' 0 C--O 1.25 1.109 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 -177.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.8 0.26 48.92 Favored Glycine 0 CA--C 1.487 -1.696 0 N-CA-C 115.235 0.854 . . . . 0.0 115.235 173.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -152.4 120.32 6.17 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 118.655 -1.218 . . . . 0.0 110.139 -176.284 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.411 ' HB2' ' OE1' ' A' ' 69' ' ' GLN . 3.9 p30 -103.82 141.29 36.38 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 176.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -135.97 61.76 42.61 Favored Pre-proline 0 C--N 1.299 -1.612 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -173.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -72.89 -6.65 19.39 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.332 2.021 . . . . 0.0 113.597 -173.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.447 ' HD3' ' N ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -104.63 -25.26 12.8 Favored 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 178.789 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -102.38 18.22 51.69 Favored Glycine 0 N--CA 1.411 -3.001 0 CA-C-N 113.95 -1.477 . . . . 0.0 112.656 -177.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 29.9 m -65.66 113.36 4.19 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-O 121.036 0.446 . . . . 0.0 110.907 175.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -106.54 109.83 21.87 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-O 121.819 0.819 . . . . 0.0 108.882 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.603 ' HB ' ' OE1' ' A' ' 77' ' ' GLN . 2.7 mp -115.02 143.72 24.14 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.107 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.571 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 18.6 ptt180 -71.61 122.12 19.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.81 -13.34 16.69 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.045 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -75.72 -18.88 59.43 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.9 -178.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.571 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.4 pt20 -81.13 -16.97 51.51 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.525 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.458 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.2 mm? -96.59 2.59 52.42 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.138 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.444 ' O ' ' HG2' ' A' ' 34' ' ' MET . 28.6 t-20 -52.52 -39.27 61.17 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 124.343 1.027 . . . . 0.0 112.223 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.1 t-80 -69.2 -54.78 13.07 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.413 ' HB3' HG11 ' A' ' 78' ' ' VAL . 1.2 m -55.13 -47.25 75.32 Favored 'General case' 0 C--O 1.221 -0.418 0 O-C-N 123.467 0.48 . . . . 0.0 110.652 178.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -54.55 -55.39 29.79 Favored 'General case' 0 N--CA 1.437 -1.095 0 C-N-CA 123.457 0.703 . . . . 0.0 112.335 176.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 14.2 ptp -68.43 -41.74 79.88 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -176.26 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -70.25 -25.41 63.36 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.057 -175.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.451 ' O ' ' HB3' ' A' ' 99' ' ' MET . 86.9 mt -88.33 -25.13 22.92 Favored 'General case' 0 C--O 1.214 -0.816 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 177.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.507 ' HA ' HG13 ' A' ' 96' ' ' VAL . 29.9 p -87.78 -21.57 25.04 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 117.919 -1.512 . . . . 0.0 111.333 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.2 m -90.63 143.47 26.71 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.558 174.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.464 ' CZ ' ' HA ' ' A' ' 96' ' ' VAL . 48.8 m-85 -106.41 130.24 54.25 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.63 ' OD2' ' HD3' ' A' ' 42' ' ' LYS . 10.2 t70 -60.87 148.5 39.25 Favored 'General case' 0 N--CA 1.421 -1.897 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.26 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -124.65 -26.8 3.77 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.229 -172.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.63 ' HD3' ' OD2' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -91.95 9.52 32.73 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.806 -175.766 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.424 ' HG ' ' OD2' ' A' ' 40' ' ' ASP . 83.9 mt -49.43 113.15 0.76 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.764 173.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -105.15 -79.3 0.56 Allowed 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 67.0 mtt -102.56 3.04 36.96 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.309 0.576 . . . . 0.0 109.915 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.514 ' HA ' ' CG ' ' A' ' 49' ' ' ASN . . . -72.16 105.75 4.1 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.18 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 29.8 t -112.38 -62.53 2.18 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 176.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -134.72 33.07 3.23 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.514 ' CG ' ' HA ' ' A' ' 46' ' ' ALA . 2.9 m-20 -59.84 141.38 89.37 Favored Pre-proline 0 C--N 1.313 -0.999 0 CA-C-N 114.218 -1.355 . . . . 0.0 111.391 -177.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -59.44 -23.34 70.11 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.917 2.411 . . . . 0.0 111.913 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -69.17 -15.3 63.37 Favored 'General case' 0 C--O 1.218 -0.586 0 O-C-N 122.092 -0.38 . . . . 0.0 111.749 177.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -81.19 -9.08 59.85 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 121.306 0.574 . . . . 0.0 109.741 178.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -87.3 6.63 32.46 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.77 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.466 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 23.6 pt20 -49.47 -48.77 47.49 Favored 'General case' 0 C--O 1.249 1.05 0 C-N-CA 124.521 1.128 . . . . 0.0 111.084 178.136 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.439 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.4 p-80 -70.93 -22.68 62.21 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.267 -177.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.411 HD23 HD22 ' A' ' 106' ' ' LEU . 3.2 tm? -78.5 -46.15 20.29 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -178.523 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.9 m -55.06 -33.37 62.68 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.471 0.653 . . . . 0.0 110.519 178.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 58.3 mt -82.95 -56.13 3.99 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.858 178.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.8 t -58.68 -49.42 77.61 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.196 0.999 . . . . 0.0 111.348 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.486 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 38.5 t -57.82 -37.08 73.18 Favored 'General case' 0 C--O 1.212 -0.903 0 C-N-CA 123.028 0.531 . . . . 0.0 110.839 178.162 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.406 ' HA ' ' HG2' ' A' ' 64' ' ' GLN . 25.9 t-20 -76.42 -25.32 54.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.872 0.844 . . . . 0.0 110.816 -177.079 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.543 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 6.3 tp-100 -79.61 -48.61 13.49 Favored 'General case' 0 C--N 1.283 -2.311 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.369 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.581 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -69.05 -31.7 70.66 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.866 -177.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.406 ' HG2' ' HA ' ' A' ' 61' ' ' ASN . 2.2 pt20 -71.92 -11.18 60.66 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -176.3 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.35 -10.23 57.77 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.929 0.871 . . . . 0.0 109.785 175.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -82.73 163.68 2.98 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 172.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.573 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 27.7 mm-40 -50.55 149.4 3.21 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-N 118.101 0.409 . . . . 0.0 112.023 174.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.538 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 19.4 ptpt -62.51 -38.4 89.8 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.779 -171.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.411 ' OE1' ' HB2' ' A' ' 17' ' ' ASP . 24.5 pt20 -76.3 -19.59 58.12 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-O 121.534 0.683 . . . . 0.0 110.158 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 57.2 m -98.83 -11.5 21.72 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.541 -176.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 79.4 mt-30 -62.19 -38.84 90.65 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-O 121.414 0.626 . . . . 0.0 109.365 176.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.6 p -80.31 -24.84 39.68 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.125 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -71.32 -29.89 65.56 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.597 178.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.449 ' HB2' HG21 ' A' ' 24' ' ' ILE . . . -63.71 -30.44 71.54 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.42 176.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.581 HD11 HD22 ' A' ' 63' ' ' LEU . 31.4 mm -69.45 -33.94 59.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.539 -179.417 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -65.78 -41.11 92.41 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 -177.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.603 ' OE1' ' HB ' ' A' ' 24' ' ' ILE . 6.4 mt-30 -65.49 -33.13 75.2 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.743 -177.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.458 HG22 ' HB3' ' A' ' 29' ' ' LEU . 22.0 t -58.66 -46.7 90.26 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.03 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.477 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 42.7 t -64.46 -50.61 75.34 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.167 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 -176.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -50.5 -47.51 57.27 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.996 -1.457 . . . . 0.0 112.276 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.649 ' HA ' ' CD ' ' A' ' 84' ' ' LYS . 29.6 pt20 -83.1 -32.91 26.5 Favored 'General case' 0 N--CA 1.432 -1.342 0 C-N-CA 119.531 -0.868 . . . . 0.0 113.272 -176.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.463 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -71.27 -32.8 69.13 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-O 121.057 0.456 . . . . 0.0 110.493 -178.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 4.4 pt20 -74.1 -43.24 58.37 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.167 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.649 ' CD ' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -72.78 -25.08 61.04 Favored 'General case' 0 CA--C 1.498 -1.047 0 C-N-CA 118.197 -1.401 . . . . 0.0 111.824 -175.333 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -71.03 -34.12 70.99 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 119.777 -0.769 . . . . 0.0 109.863 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.444 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.2 mm? -84.16 -31.47 25.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.802 177.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -63.18 -38.32 90.71 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 122.871 0.469 . . . . 0.0 111.903 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -87.94 4.08 46.18 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.433 0.635 . . . . 0.0 112.156 -174.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -101.72 -130.65 7.1 Favored Glycine 0 C--N 1.286 -2.249 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.433 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -93.81 -8.1 41.45 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.647 0.737 . . . . 0.0 110.435 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.62 -150.65 17.32 Favored Glycine 0 N--CA 1.422 -2.28 0 N-CA-C 108.716 -1.754 . . . . 0.0 108.716 -176.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.409 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 112.91 -19.91 20.4 Favored Glycine 0 C--O 1.189 -2.671 0 C-N-CA 119.723 -1.227 . . . . 0.0 111.079 -177.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -51.38 -37.66 49.31 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 124.088 0.955 . . . . 0.0 111.252 -177.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -76.92 -33.25 57.76 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.014 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.418 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 29.8 pt20 -83.17 -44.51 14.97 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.349 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.507 HG13 ' HA ' ' A' ' 37' ' ' THR . 93.2 t -64.2 -22.54 31.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 C-N-CA 125.537 1.535 . . . . 0.0 110.687 177.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -45.95 -45.39 15.56 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.471 1.108 . . . . 0.0 112.285 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.8 pt20 -65.25 -18.75 65.56 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -178.214 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.451 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 3.6 tpt -98.87 -45.92 5.82 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.86 -25.02 36.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 120.891 0.376 . . . . 0.0 111.253 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -63.21 -22.66 67.01 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.374 -0.829 . . . . 0.0 111.831 174.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -66.45 -25.99 66.99 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 122.393 0.277 . . . . 0.0 110.444 175.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.49 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -60.97 -30.25 70.15 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 121.564 0.697 . . . . 0.0 110.487 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -70.51 -19.82 62.89 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.188 -178.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 56.0 mtp -92.4 -15.07 27.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.67 -178.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.5 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 97.5 mt -55.78 -45.93 99.81 Favored Pre-proline 0 C--N 1.317 -0.819 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.226 -178.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 14.5 Cg_endo -58.25 -25.01 70.28 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 122.222 1.948 . . . . 0.0 113.195 174.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.05 -47.71 13.19 Favored 'General case' 0 N--CA 1.419 -1.991 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -67.29 -38.45 85.04 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.595 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.454 ' SG ' HD21 ' A' ' 112' ' ' LEU . 15.9 t -90.33 -4.11 57.32 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-O 120.832 0.349 . . . . 0.0 110.336 -177.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 60.31 60.67 1.97 Allowed 'General case' 0 N--CA 1.477 0.916 0 CA-C-O 122.783 1.278 . . . . 0.0 109.67 -178.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.455 ' C ' ' H ' ' A' ' 114' ' ' CYS . 38.5 mt -91.65 160.06 15.56 Favored 'General case' 0 C--N 1.286 -2.192 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.133 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -70.0 26.96 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.477 1.111 . . . . 0.0 112.753 -177.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.455 ' H ' ' C ' ' A' ' 112' ' ' LEU . 85.2 m -157.66 158.81 36.15 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 -173.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.7 p -150.99 130.41 12.9 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 48.5 mt . . . . . 0 C--N 1.309 -1.153 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -178.119 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.453 ' HA2' ' O ' ' A' ' 14' ' ' ASP . . . . . . . . 0 CA--C 1.499 -0.915 0 N-CA-C 112.239 -0.345 . . . . 0.0 112.239 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.52 ' H ' ' HB3' ' A' ' 14' ' ' ASP . 35.1 mmt180 -88.59 127.94 35.57 Favored 'General case' 0 CA--C 1.477 -1.858 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 175.129 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 63.1 m -140.71 151.81 44.81 Favored 'General case' 0 C--N 1.266 -3.053 0 O-C-N 123.399 0.437 . . . . 0.0 110.36 -174.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.3 p -79.43 161.29 26.22 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.825 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.423 ' HD3' ' N ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -88.11 66.44 8.54 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.725 0.774 . . . . 0.0 109.312 177.285 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 64.8 p -138.57 160.16 40.29 Favored 'General case' 0 N--CA 1.42 -1.967 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.0 mm -128.77 112.85 18.98 Favored Pre-proline 0 C--N 1.302 -1.488 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 176.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -72.62 154.2 98.89 Favored 'Cis proline' 0 CA--C 1.547 1.139 0 C-N-CA 123.716 -1.368 . . . . 0.0 112.228 -0.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.88 150.85 30.76 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 122.264 1.976 . . . . 0.0 113.022 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -98.6 113.07 32.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 105.674 -1.972 . . . . 0.0 105.674 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 80.9 m -106.43 139.28 41.16 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 121.592 0.711 . . . . 0.0 111.963 -177.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -92.26 165.45 19.74 Favored Pre-proline 0 C--N 1.302 -1.471 0 CA-C-N 114.537 -1.21 . . . . 0.0 110.648 -178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -67.16 76.09 0.46 Allowed 'Trans proline' 0 C--N 1.367 1.528 0 C-N-CA 123.064 2.509 . . . . 0.0 111.428 175.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.52 ' HB3' ' H ' ' A' ' 2' ' ' ARG . 9.8 t70 -140.67 132.48 27.47 Favored 'General case' 0 C--N 1.279 -2.469 0 CA-C-N 113.662 -1.608 . . . . 0.0 106.756 175.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.41 23.78 49.67 Favored Glycine 0 C--N 1.304 -1.229 0 C-N-CA 120.296 -0.954 . . . . 0.0 110.935 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.623 HD23 ' H ' ' A' ' 16' ' ' LEU . 1.5 pt? -94.85 -20.88 19.07 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 121.916 0.865 . . . . 0.0 109.13 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -131.33 85.13 2.23 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 174.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -107.93 114.53 59.91 Favored Pre-proline 0 C--N 1.283 -2.294 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.246 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -74.03 -21.36 18.31 Favored 'Trans proline' 0 N--CA 1.451 -1.019 0 C-N-CA 121.319 1.346 . . . . 0.0 110.749 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.559 ' HD3' HE22 ' A' ' 77' ' ' GLN . 6.0 mpt_? -127.84 -63.2 1.03 Allowed 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 176.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 175.85 -72.2 0.08 OUTLIER Glycine 0 CA--C 1.479 -2.182 0 N-CA-C 108.81 -1.716 . . . . 0.0 108.81 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 32.8 m -74.79 132.92 41.95 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 171.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -100.51 110.17 22.33 Favored 'General case' 0 N--CA 1.414 -2.271 0 C-N-CA 118.165 -1.414 . . . . 0.0 108.817 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 mp -111.92 137.58 44.06 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.899 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 178.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.488 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 13.9 ptp180 -67.25 116.55 8.15 Favored 'General case' 0 N--CA 1.417 -2.111 0 CA-C-O 121.783 0.802 . . . . 0.0 109.335 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.65 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -67.69 -13.75 17.28 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.958 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.257 -174.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -77.43 -16.55 58.74 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.637 -178.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.1 pt20 -85.92 -20.31 29.19 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 119.116 -1.034 . . . . 0.0 109.29 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.475 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.5 mm? -91.54 -2.9 57.01 Favored 'General case' 0 CA--C 1.483 -1.607 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.52 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 -51.38 -35.4 38.6 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.58 -1.191 . . . . 0.0 110.959 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 t-160 -69.76 -54.42 13.77 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.43 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.7 OUTLIER -54.08 -52.21 61.67 Favored 'General case' 0 C--O 1.22 -0.487 0 O-C-N 123.737 0.648 . . . . 0.0 109.92 178.112 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 39.2 tt0 -50.31 -60.06 3.35 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.053 0.941 . . . . 0.0 112.44 177.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.9 ptt? -68.13 -39.54 82.68 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.682 -172.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -70.9 -26.26 63.14 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.282 -175.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 90.6 mt -87.62 -27.73 22.32 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.543 ' HA ' HG13 ' A' ' 96' ' ' VAL . 39.9 p -86.01 -22.02 27.5 Favored 'General case' 0 N--CA 1.422 -1.836 0 C-N-CA 118.032 -1.467 . . . . 0.0 111.787 179.213 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.9 p -90.89 148.07 22.72 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.414 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -111.62 157.72 20.09 Favored 'General case' 0 N--CA 1.417 -2.119 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.407 ' H ' ' CD1' ' A' ' 43' ' ' LEU . 9.2 t70 -121.18 177.92 4.96 Favored 'General case' 0 C--N 1.279 -2.487 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 -177.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.1 p90 -95.93 -35.83 11.3 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -170.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.48 8.88 14.98 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 119.382 -0.927 . . . . 0.0 111.576 -175.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.407 ' CD1' ' H ' ' A' ' 40' ' ' ASP . 28.9 mt -76.89 83.49 3.45 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.023 178.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -98.51 -25.24 14.83 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-O 122.4 1.095 . . . . 0.0 109.025 177.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.5 ptp -151.7 82.09 1.28 Allowed 'General case' 0 C--N 1.286 -2.189 0 CA-C-N 113.507 -1.678 . . . . 0.0 107.616 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.8 29.42 7.57 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 113.506 -1.679 . . . . 0.0 108.446 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.3 t -75.24 -61.1 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -144.36 87.77 1.9 Allowed 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -123.15 137.91 29.02 Favored Pre-proline 0 C--N 1.304 -1.4 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.842 -174.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.573 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 11.7 Cg_endo -55.7 -42.15 70.34 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 123.472 2.782 . . . . 0.0 114.298 -178.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -73.76 -18.06 61.02 Favored 'General case' 0 CA--C 1.5 -0.975 0 O-C-N 121.823 -0.548 . . . . 0.0 112.287 -176.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -69.92 -25.23 63.57 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.684 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.573 ' HG2' ' O ' ' A' ' 50' ' ' PRO . 12.7 pt20 -73.05 4.88 3.81 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.803 -177.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.498 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 14.0 pt20 -53.15 -46.55 68.9 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.995 0.918 . . . . 0.0 110.011 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -72.81 -21.47 60.96 Favored 'General case' 0 C--O 1.209 -1.047 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.423 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -77.91 -43.07 31.13 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.4 m -56.84 -34.6 67.92 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 123.655 0.597 . . . . 0.0 110.123 177.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 50.5 mt -79.75 -56.14 4.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.191 177.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 22.7 t -58.97 -49.27 78.49 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 124.186 0.994 . . . . 0.0 111.846 -175.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.498 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.7 t -58.99 -34.39 71.78 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 122.838 0.455 . . . . 0.0 110.651 177.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -77.53 -23.49 50.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.603 0.716 . . . . 0.0 110.852 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -83.17 -47.88 11.12 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.514 178.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.501 HD22 HD11 ' A' ' 75' ' ' ILE . 3.7 pp -66.48 -31.57 72.4 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.425 0.631 . . . . 0.0 111.014 -177.217 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.53 -14.6 63.12 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.134 -177.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -77.25 -22.91 51.45 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.453 0.644 . . . . 0.0 109.312 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.2 t -74.78 161.73 4.72 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.088 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.586 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 38.3 mt-10 -53.46 144.01 17.98 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -55.54 -31.24 61.95 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.99 0.916 . . . . 0.0 112.087 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.576 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.9 pt20 -84.94 -5.08 59.35 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.744 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.576 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 61.5 m -125.61 -6.27 6.93 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.991 -175.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.586 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 99.0 mt-30 -61.97 -41.88 98.51 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.433 0.635 . . . . 0.0 109.93 177.108 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.456 ' HA ' HG12 ' A' ' 75' ' ' ILE . 6.0 p -78.28 -23.55 47.17 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.329 177.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.432 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 14.7 mm-40 -72.0 -30.96 65.76 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.269 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.478 ' HA ' ' HG3' ' A' ' 77' ' ' GLN . . . -60.77 -24.27 65.64 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.267 176.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.609 HG21 ' HD3' ' A' ' 107' ' ' PRO . 32.6 mm -74.31 -29.97 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.683 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -71.54 -39.19 70.85 Favored 'General case' 0 CA--C 1.489 -1.383 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 -176.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.559 HE22 ' HD3' ' A' ' 20' ' ' ARG . 44.0 mm-40 -56.16 -46.75 79.19 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 112.286 -2.234 . . . . 0.0 109.075 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.475 HG22 ' HB3' ' A' ' 29' ' ' LEU . 12.2 t -57.89 -46.25 87.47 Favored 'Isoleucine or valine' 0 C--N 1.354 0.786 0 O-C-N 124.297 0.998 . . . . 0.0 109.667 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 75' ' ' ILE . 23.6 t -67.49 -41.3 85.84 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.813 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.898 -173.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -60.83 -52.83 63.42 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.107 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.65 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.1 pt20 -68.89 -37.27 78.9 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -176.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.62 -37.14 73.77 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 120.903 0.382 . . . . 0.0 111.508 -177.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -75.72 -38.43 58.55 Favored 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.233 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.499 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -67.34 -33.17 74.69 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 120.593 0.235 . . . . 0.0 111.07 -177.197 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.443 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 2.2 pt20 -72.2 -29.82 64.35 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.073 0.463 . . . . 0.0 110.769 -176.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.525 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.2 mm? -87.14 -33.11 19.53 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.534 0.683 . . . . 0.0 111.454 175.347 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -63.15 -36.5 83.82 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.256 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -81.99 -6.98 59.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.006 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -92.06 -133.08 5.97 Favored Glycine 0 N--CA 1.429 -1.827 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.161 -177.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -104.83 -18.95 14.05 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 120.891 0.377 . . . . 0.0 111.098 -176.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 154.61 -141.57 8.3 Favored Glycine 0 CA--C 1.477 -2.343 0 N-CA-C 109.159 -1.576 . . . . 0.0 109.159 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.404 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 96.06 -24.44 29.98 Favored Glycine 0 N--CA 1.424 -2.112 0 C-N-CA 120.358 -0.925 . . . . 0.0 113.267 176.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -54.05 -31.52 51.76 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -77.11 -35.17 56.57 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.327 179.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.404 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 14.2 pt20 -83.99 -43.54 15.07 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.61 0.719 . . . . 0.0 109.68 -177.284 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.543 HG13 ' HA ' ' A' ' 37' ' ' THR . 95.4 t -63.04 -23.15 32.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.507 177.207 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -46.48 -43.73 16.94 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.675 0.79 . . . . 0.0 112.936 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -69.4 -17.94 63.71 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.098 0.475 . . . . 0.0 111.865 -177.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.419 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 5.9 tpt -102.06 -47.38 4.57 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.143 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.5 p -64.73 -24.03 34.7 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.692 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.468 ' HG3' ' N ' ' A' ' 102' ' ' LYS . 34.9 pttt -59.23 -26.96 65.32 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.778 -0.576 . . . . 0.0 110.711 173.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.468 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 26.0 mtpp -65.02 -28.71 69.68 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.411 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -61.43 -43.49 98.78 Favored 'General case' 0 C--O 1.197 -1.659 0 O-C-N 123.931 0.769 . . . . 0.0 108.959 174.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -70.67 -16.89 62.84 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.197 -178.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 27.3 mtm -91.39 -13.38 32.52 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.095 -0.378 . . . . 0.0 111.29 177.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.51 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 95.7 mt -50.64 -45.35 85.62 Favored Pre-proline 0 CA--C 1.543 0.698 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.609 ' HD3' HG21 ' A' ' 75' ' ' ILE . 16.0 Cg_endo -58.25 -24.54 67.96 Favored 'Trans proline' 0 C--N 1.367 1.53 0 C-N-CA 122.172 1.915 . . . . 0.0 112.86 176.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -85.62 -44.06 12.94 Favored 'General case' 0 N--CA 1.413 -2.307 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -73.21 -35.86 66.39 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.315 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 25.0 t -90.05 -3.83 57.73 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-O 121.331 0.586 . . . . 0.0 109.797 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 61.7 t30 62.37 50.86 3.57 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 122.736 1.255 . . . . 0.0 110.853 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.435 HD21 HD11 ' A' ' 63' ' ' LEU . 66.3 mt -89.54 158.61 17.59 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.712 -178.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -80.3 43.79 0.65 Allowed 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 124.067 0.947 . . . . 0.0 112.06 -174.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 59.5 m -159.16 162.63 36.4 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.4 p -146.32 140.71 26.64 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 73.0 mt . . . . . 0 C--N 1.307 -1.262 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.48 -178.51 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.553 ' HA3' ' O ' ' A' ' 12' ' ' PHE . . . . . . . . 0 CA--C 1.503 -0.713 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 64.7 mtm-85 -94.7 127.16 40.49 Favored 'General case' 0 CA--C 1.493 -1.243 0 CA-C-N 117.161 0.481 . . . . 0.0 109.725 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 21.5 m -113.52 147.82 37.22 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -176.567 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.4 p -78.58 146.16 34.36 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 175.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -87.82 69.82 9.54 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.676 0.75 . . . . 0.0 109.358 177.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.8 t -146.85 171.47 15.15 Favored 'General case' 0 N--CA 1.418 -2.074 0 N-CA-C 106.7 -1.592 . . . . 0.0 106.7 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 37.9 mm -128.84 119.83 20.21 Favored Pre-proline 0 C--N 1.305 -1.362 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -71.72 146.91 86.89 Favored 'Cis proline' 0 C--O 1.249 1.049 0 C-N-CA 123.751 -1.354 . . . . 0.0 111.645 -1.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -73.97 139.66 27.48 Favored 'Trans proline' 0 N--CA 1.445 -1.353 0 C-N-CA 122.252 1.968 . . . . 0.0 111.347 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.3 mm -106.18 115.54 48.05 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.8 t -117.57 132.34 56.54 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 119.431 -0.908 . . . . 0.0 111.028 -176.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.553 ' O ' ' HA3' ' A' ' 1' ' ' GLY . 48.3 m-85 -97.45 150.47 36.83 Favored Pre-proline 0 C--N 1.302 -1.473 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.756 -179.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.36 11.98 2.48 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.839 2.359 . . . . 0.0 114.097 -175.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -120.91 137.94 54.35 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 178.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -167.55 -97.9 0.12 Allowed Glycine 0 N--CA 1.42 -2.426 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -143.49 165.14 28.39 Favored 'General case' 0 N--CA 1.405 -2.696 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 -178.374 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -129.38 4.75 5.18 Favored 'General case' 0 C--N 1.272 -2.776 0 CA-C-O 121.421 0.629 . . . . 0.0 111.524 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -105.28 104.56 48.15 Favored Pre-proline 0 C--N 1.299 -1.592 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 174.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.44 -31.82 86.97 Favored 'Trans proline' 0 C--O 1.24 0.598 0 C-N-CA 123.47 2.78 . . . . 0.0 113.822 -174.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.614 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 2.5 mpt_? -99.85 -50.03 4.16 Favored 'General case' 0 CA--C 1.488 -1.412 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.65 34.27 9.37 Favored Glycine 0 CA--C 1.465 -3.065 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 -178.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 64.0 m -63.41 137.46 58.17 Favored 'General case' 0 N--CA 1.417 -2.117 0 CA-C-N 113.95 -1.125 . . . . 0.0 110.146 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -101.7 121.96 43.02 Favored 'General case' 0 N--CA 1.417 -2.124 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 173.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mp -122.26 134.41 65.58 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.395 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 -178.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.1 ptp180 -66.75 121.98 16.64 Favored 'General case' 0 N--CA 1.426 -1.655 0 O-C-N 123.913 0.758 . . . . 0.0 110.203 -173.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -64.13 -17.13 20.2 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.267 -175.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -75.94 -13.62 60.25 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.219 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -96.46 -10.53 27.25 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.124 178.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.436 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.9 mm? -98.7 4.95 47.93 Favored 'General case' 0 CA--C 1.488 -1.42 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.18 176.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.502 ' O ' ' HG2' ' A' ' 34' ' ' MET . 7.8 t30 -50.57 -36.6 35.39 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.27 -1.332 . . . . 0.0 113.099 -179.233 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -72.23 -53.61 12.06 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -178.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -54.72 -51.36 65.84 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 124.493 1.121 . . . . 0.0 108.809 -178.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -52.25 -56.03 17.39 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 124.201 1.001 . . . . 0.0 112.792 176.4 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.502 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 15.6 ptp -67.88 -43.63 78.91 Favored 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 119.849 -0.74 . . . . 0.0 112.788 -175.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -65.29 -25.34 67.59 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 99' ' ' MET . 93.1 mt -85.53 -32.54 22.13 Favored 'General case' 0 C--O 1.209 -1.076 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.809 175.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.548 ' HA ' HG13 ' A' ' 96' ' ' VAL . 40.7 p -86.43 -21.13 27.26 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 118.645 -1.222 . . . . 0.0 112.621 -177.327 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.5 m -89.6 121.11 31.48 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 113.037 0.755 . . . . 0.0 113.037 -177.2 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -102.34 89.52 3.59 Favored 'General case' 0 C--N 1.29 -2.019 0 N-CA-C 103.436 -2.801 . . . . 0.0 103.436 165.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -74.32 172.69 11.4 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.688 -1.142 . . . . 0.0 112.076 -167.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -98.49 -32.05 11.67 Favored 'General case' 0 C--N 1.295 -1.77 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -168.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.07 5.07 31.13 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 119.003 -1.079 . . . . 0.0 111.554 -176.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 53.1 mt -77.87 86.51 4.1 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 174.174 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.9 mtt180 -110.32 -56.71 2.3 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.365 -174.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 66.6 mtt -98.14 -12.48 21.71 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 121.648 0.737 . . . . 0.0 110.051 177.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.42 90.73 8.48 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.469 176.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.46 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 49.1 t -124.82 -58.56 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 177.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -121.93 79.51 1.59 Allowed 'General case' 0 N--CA 1.433 -1.3 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 175.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -134.8 161.58 62.87 Favored Pre-proline 0 C--N 1.308 -1.196 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -59.56 -28.03 86.43 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.445 2.097 . . . . 0.0 110.492 173.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -66.59 -12.99 60.46 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.67 -0.695 . . . . 0.0 112.053 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' A' ' 47' ' ' VAL . 15.9 mm100 -85.41 -11.58 54.1 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.476 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -117.14 11.94 14.31 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 121.114 0.483 . . . . 0.0 110.094 177.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.555 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 11.1 pt20 -59.3 -33.16 70.75 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.91 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.11 -22.26 66.39 Favored 'General case' 0 C--O 1.204 -1.309 0 CA-C-N 114.823 -1.081 . . . . 0.0 111.433 -178.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -81.1 -44.94 17.21 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.1 m -56.99 -32.09 65.76 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 124.052 0.845 . . . . 0.0 109.671 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 54.7 mt -87.83 -49.52 7.05 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.213 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 52.5 t -61.09 -49.77 75.96 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.294 0.237 . . . . 0.0 111.383 -179.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.525 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 53.1 t -58.78 -32.27 69.16 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.581 0.352 . . . . 0.0 110.586 178.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.404 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 47.8 t30 -80.4 -26.04 38.74 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.489 0.661 . . . . 0.0 110.687 -177.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -82.85 -46.13 13.41 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.281 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.651 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -67.36 -32.45 73.38 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.554 -177.276 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.401 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 11.2 pt20 -70.85 -9.82 58.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.781 -178.688 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 12.9 mm-40 -78.67 -17.69 55.56 Favored 'General case' 0 C--O 1.247 0.935 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 176.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 8.4 t -85.23 162.48 2.9 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 175.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 2.5 mm-40 -49.89 144.62 6.33 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 124.155 0.982 . . . . 0.0 112.405 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -58.63 -33.51 70.14 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.316 0.579 . . . . 0.0 111.599 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -79.61 -11.49 59.87 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.073 -178.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 62.6 m -116.47 -9.49 11.43 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.929 -175.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 71.7 mt-30 -57.45 -49.37 76.47 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.387 0.675 . . . . 0.0 112.229 178.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.44 ' HA ' HG12 ' A' ' 75' ' ' ILE . 25.4 p -76.57 -23.7 53.52 Favored 'General case' 0 CA--C 1.499 -1.012 0 C-N-CA 119.494 -0.882 . . . . 0.0 111.841 177.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 15.0 mm-40 -66.56 -35.2 79.64 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 178.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.489 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.49 -26.66 66.98 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.372 0.669 . . . . 0.0 111.185 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.651 HD11 HD22 ' A' ' 63' ' ' LEU . 19.8 mm -72.94 -26.45 23.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.341 0.591 . . . . 0.0 109.537 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -75.88 -38.87 57.42 Favored 'General case' 0 CA--C 1.495 -1.152 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 -174.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 73' ' ' GLU . 63.6 mm-40 -58.09 -44.61 87.72 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 112.335 -2.212 . . . . 0.0 108.996 178.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.4 t -56.63 -46.38 82.76 Favored 'Isoleucine or valine' 0 C--N 1.359 0.987 0 O-C-N 124.428 1.08 . . . . 0.0 109.601 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 75' ' ' ILE . 41.7 t -65.9 -47.32 85.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -175.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.14 -40.62 86.07 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.297 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -82.02 -31.45 30.98 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.266 0.555 . . . . 0.0 111.275 -178.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.472 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -77.83 -31.23 51.51 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.021 0.439 . . . . 0.0 111.877 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -80.33 -33.75 37.19 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -33.5 63.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.382 -176.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.44 ' HG3' HD22 ' A' ' 86' ' ' LEU . 15.7 pt20 -67.4 -32.52 73.47 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.125 0.488 . . . . 0.0 110.416 -178.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.5 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.0 mm? -84.29 -29.21 26.58 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.993 177.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -66.91 -38.35 86.05 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.423 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -79.41 -4.64 52.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.447 0.641 . . . . 0.0 111.084 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -95.5 -133.96 7.59 Favored Glycine 0 N--CA 1.426 -2.021 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -92.13 -49.64 6.09 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.633 0.73 . . . . 0.0 109.726 -178.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.417 ' O ' HD12 ' A' ' 86' ' ' LEU . . . 178.11 -152.7 11.92 Favored Glycine 0 CA--C 1.484 -1.861 0 N-CA-C 107.348 -2.301 . . . . 0.0 107.348 -176.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.4 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 111.53 -23.69 17.25 Favored Glycine 0 C--O 1.201 -1.925 0 C-N-CA 119.975 -1.107 . . . . 0.0 111.872 178.449 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 48.1 mt-30 -49.96 -34.65 21.5 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 124.297 1.039 . . . . 0.0 112.376 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -75.46 -40.83 56.95 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.554 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 20.8 pt20 -80.08 -45.13 18.81 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-O 121.231 0.539 . . . . 0.0 109.67 -175.521 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.548 HG13 ' HA ' ' A' ' 37' ' ' THR . 88.1 t -63.04 -22.76 31.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 C-N-CA 124.893 1.277 . . . . 0.0 110.759 177.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.422 ' HA ' HG12 ' A' ' 100' ' ' VAL . 28.6 tt0 -54.25 -35.18 62.22 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.23 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.554 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 10.2 pt20 -69.41 -17.45 63.66 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.033 0.444 . . . . 0.0 111.199 -178.809 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.421 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 2.9 tpt -103.2 -44.03 5.3 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -177.041 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.422 HG12 ' HA ' ' A' ' 97' ' ' GLN . 9.2 p -66.82 -23.71 31.48 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 CA-C-O 121.079 0.466 . . . . 0.0 110.972 177.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -21.57 66.6 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 121.867 -0.52 . . . . 0.0 111.278 175.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -67.12 -28.07 67.85 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -68.93 -25.42 64.57 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-O 121.457 0.646 . . . . 0.0 110.131 176.21 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -70.71 -25.17 62.83 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 122.014 0.912 . . . . 0.0 108.883 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 38.8 mtp -92.3 -14.67 28.47 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.491 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.451 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.2 OUTLIER -52.07 -48.46 88.5 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 124.491 1.116 . . . . 0.0 111.305 -177.553 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 18.6 Cg_endo -59.28 -23.18 68.65 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 121.581 1.521 . . . . 0.0 113.494 177.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -89.19 -40.31 12.96 Favored 'General case' 0 N--CA 1.416 -2.139 0 C-N-CA 119.861 -0.735 . . . . 0.0 110.489 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -66.56 -41.73 88.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.276 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.409 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 30.3 t -88.49 -6.02 57.87 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.283 -176.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 60.56 61.45 1.73 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 123.116 1.436 . . . . 0.0 110.616 -178.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.451 HD21 HD11 ' A' ' 63' ' ' LEU . 54.8 mt -102.34 158.46 16.18 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 113.472 -1.695 . . . . 0.0 109.536 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -78.87 49.79 0.95 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.002 0.921 . . . . 0.0 111.391 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.441 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 18.2 m -158.19 159.08 35.73 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 123.939 0.896 . . . . 0.0 109.99 -176.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.5 p -147.78 116.83 6.82 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 176.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 72.0 mt . . . . . 0 C--N 1.305 -1.33 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 -176.387 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.317 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.7 mtp85 -94.93 147.98 22.8 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 81.0 m -143.03 149.38 38.18 Favored 'General case' 0 C--N 1.293 -1.85 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.114 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.4 p -74.37 160.85 30.48 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.184 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -94.3 71.91 3.85 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 120.112 -0.635 . . . . 0.0 110.707 -178.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.4 t -152.06 167.39 28.61 Favored 'General case' 0 N--CA 1.428 -1.53 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.5 mt -129.05 118.89 19.56 Favored Pre-proline 0 C--N 1.311 -1.104 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.95 148.41 90.73 Favored 'Cis proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.711 -1.37 . . . . 0.0 112.591 0.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -74.2 143.98 32.73 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.36 2.04 . . . . 0.0 112.555 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.6 mm -96.24 115.27 35.1 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 176.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 76.8 m -106.05 147.36 29.0 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -174.04 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.445 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 64.6 m-85 -125.62 135.53 27.09 Favored Pre-proline 0 N--CA 1.433 -1.29 0 C-N-CA 124.238 1.015 . . . . 0.0 111.651 -176.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 12.3 Cg_exo -64.97 -33.94 49.57 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 122.818 2.345 . . . . 0.0 112.078 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -120.2 -78.85 0.6 Allowed 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.03 -178.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 62.25 29.25 72.5 Favored Glycine 0 N--CA 1.439 -1.121 0 O-C-N 123.772 0.67 . . . . 0.0 112.925 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.24 -44.26 1.15 Allowed 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 117.507 0.654 . . . . 0.0 110.721 -175.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -106.14 103.02 12.4 Favored 'General case' 0 C--N 1.288 -2.09 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -134.63 124.31 16.82 Favored Pre-proline 0 C--N 1.304 -1.375 0 CA-C-N 115.92 -0.582 . . . . 0.0 112.412 -173.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -71.1 -37.02 6.54 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.375 2.05 . . . . 0.0 110.864 172.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.509 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 0.3 OUTLIER -112.12 -57.01 2.33 Favored 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.899 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 149.15 -66.85 0.38 Allowed Glycine 0 CA--C 1.481 -2.055 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.774 -177.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.0 m -65.81 130.22 42.52 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 115.105 -0.548 . . . . 0.0 110.45 176.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -106.75 114.38 28.44 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-O 122.196 0.998 . . . . 0.0 109.252 175.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 mp -113.45 128.87 70.07 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.551 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 -177.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.561 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.6 ptp180 -67.29 124.2 22.46 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-O 121.467 0.651 . . . . 0.0 111.609 -174.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.73 -19.74 21.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.539 -176.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -76.33 -11.71 59.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.314 -178.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 3.4 pt20 -98.63 -10.47 23.28 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 119.616 -0.834 . . . . 0.0 110.575 178.326 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -105.94 3.83 28.87 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.556 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 34' ' ' MET . 3.7 t-20 -57.4 -34.81 69.26 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.492 0.495 . . . . 0.0 111.528 -176.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -69.13 -53.83 18.12 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.17 -52.57 62.89 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.578 -1.192 . . . . 0.0 108.46 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -51.16 -60.77 2.75 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 125.022 1.329 . . . . 0.0 112.415 176.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.498 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.6 ptm -66.21 -39.61 89.74 Favored 'General case' 0 C--O 1.208 -1.108 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -173.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.415 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 2.5 t-80 -68.47 -27.08 65.84 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.543 -175.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.8 mt -82.97 -34.74 26.35 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.578 176.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.465 ' HA ' HG13 ' A' ' 96' ' ' VAL . 41.4 p -82.52 -21.68 35.32 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 118.447 -1.301 . . . . 0.0 112.007 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -90.15 121.73 32.46 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.682 -178.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -98.92 96.79 8.09 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 168.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.422 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 4.4 t70 -67.99 176.76 2.46 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.702 0.763 . . . . 0.0 112.941 -170.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 28.9 p90 -105.29 -32.43 8.62 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 124.004 0.922 . . . . 0.0 112.583 -170.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.82 6.09 29.65 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.866 -175.597 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.422 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 52.8 mt -75.01 89.79 2.43 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.522 179.039 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 72.6 mtm180 -117.66 -39.35 3.15 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 178.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 22.7 mmt -99.52 15.72 25.61 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 114.59 -1.187 . . . . 0.0 108.475 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -134.2 88.89 2.5 Favored 'General case' 0 N--CA 1.434 -1.251 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.216 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 59.7 t -109.58 -59.83 3.12 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -139.69 28.34 2.19 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 122.363 1.077 . . . . 0.0 108.189 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -78.28 150.46 77.14 Favored Pre-proline 0 C--N 1.31 -1.117 0 CA-C-N 113.847 -1.524 . . . . 0.0 111.073 -175.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.06 -30.36 89.92 Favored 'Trans proline' 0 C--O 1.216 -0.611 0 C-N-CA 123.509 2.806 . . . . 0.0 112.467 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -64.84 -7.42 11.13 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -178.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -70.31 -14.56 62.64 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-O 120.947 0.403 . . . . 0.0 110.481 175.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -72.52 -2.09 18.38 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.879 176.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.486 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 20.3 pt20 -55.92 -43.62 77.51 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 122.908 0.483 . . . . 0.0 111.703 -178.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.415 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -71.19 -20.55 62.26 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-O 120.988 0.423 . . . . 0.0 110.972 -179.802 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -80.5 -41.86 23.53 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 179.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.4 m -57.83 -28.99 64.58 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.374 0.606 . . . . 0.0 110.312 176.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 60.1 mt -86.82 -55.73 3.72 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.801 178.147 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 51.9 t -59.57 -48.16 82.74 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.291 0.636 . . . . 0.0 111.827 -177.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.56 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 24.9 t -60.49 -33.64 72.89 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 122.835 0.454 . . . . 0.0 110.583 178.351 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.425 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 64.2 t30 -78.31 -23.85 46.93 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.803 0.811 . . . . 0.0 110.035 -177.309 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -82.1 -47.93 11.97 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.774 178.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.56 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.8 pp -68.04 -30.71 69.99 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.508 -176.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.425 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 16.9 pt20 -69.05 -15.28 63.42 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.19 -176.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -82.42 -18.36 42.14 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.393 0.616 . . . . 0.0 110.306 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.418 HG12 ' HB2' ' A' ' 70' ' ' CYS . 12.0 t -76.76 163.27 3.97 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.513 ' HB2' ' SG ' ' A' ' 70' ' ' CYS . 46.0 mt-10 -47.73 147.48 1.88 Allowed 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 123.545 0.738 . . . . 0.0 112.295 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.416 ' HA ' HE21 ' A' ' 71' ' ' GLN . 22.0 ptmt -50.83 -38.62 50.02 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.068 0.947 . . . . 0.0 112.874 -176.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.517 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 25.0 pt20 -87.6 -19.55 27.64 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.504 0.669 . . . . 0.0 110.666 -177.372 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.517 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 44.6 m -96.97 -9.1 28.95 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.152 -171.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.444 ' HB3' HD22 ' A' ' 112' ' ' LEU . 47.3 mt-30 -57.11 -46.91 82.23 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-O 121.339 0.59 . . . . 0.0 109.844 175.032 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.425 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.5 p -76.87 -23.6 52.62 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.541 0.686 . . . . 0.0 111.546 179.483 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -72.87 -30.52 64.03 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.425 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.553 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -62.44 -27.42 69.1 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.398 176.415 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.526 HD11 HD22 ' A' ' 63' ' ' LEU . 32.4 mm -70.21 -27.69 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.528 -179.108 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -74.78 -41.78 59.38 Favored 'General case' 0 CA--C 1.5 -0.963 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 -176.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.436 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 50.2 mm-40 -59.05 -42.33 90.04 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 112.227 -2.26 . . . . 0.0 110.374 -179.198 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 74' ' ' ALA . 30.5 t -60.39 -43.95 95.02 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 75' ' ' ILE . 48.0 t -64.4 -47.29 90.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.836 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -177.097 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.63 -59.46 4.81 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.505 -179.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 18.4 pt20 -66.41 -30.24 70.56 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 120.931 0.396 . . . . 0.0 112.024 -175.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.3 -40.45 62.25 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 121.019 -0.273 . . . . 0.0 110.905 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -76.67 -36.94 57.0 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 119.794 -0.762 . . . . 0.0 110.646 -177.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.25 -26.46 62.91 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.618 -0.265 . . . . 0.0 110.869 -177.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -77.63 -30.28 52.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.493 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.573 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.0 mm? -86.18 -40.81 15.24 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.809 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.44 -31.76 70.73 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.629 0.772 . . . . 0.0 112.12 -177.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -77.55 -12.9 60.01 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.782 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -129.09 -100.83 0.97 Allowed Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 119.766 -1.207 . . . . 0.0 113.894 -175.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -71.2 -22.46 62.02 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -173.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.573 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 106.45 -88.54 0.56 Allowed Glycine 0 CA--C 1.472 -2.62 0 N-CA-C 107.917 -2.073 . . . . 0.0 107.917 -174.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.535 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 79.03 -46.56 2.97 Favored Glycine 0 C--O 1.189 -2.712 0 CA-C-O 118.98 -0.9 . . . . 0.0 114.559 171.315 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.468 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 52.3 mt-30 -46.45 -27.62 1.14 Allowed 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 125.001 1.321 . . . . 0.0 114.399 -175.284 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.438 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 7.8 pt20 -71.98 -46.56 56.87 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.783 0.325 . . . . 0.0 111.019 176.199 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.438 ' N ' ' HG3' ' A' ' 94' ' ' GLN . 28.9 pt20 -85.63 -47.17 10.09 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.632 0.73 . . . . 0.0 110.265 -176.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.465 HG13 ' HA ' ' A' ' 37' ' ' THR . 69.6 t -59.82 -22.56 24.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 C-N-CA 126.331 1.852 . . . . 0.0 110.679 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 53.8 tt0 -46.2 -44.73 16.34 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.085 0.554 . . . . 0.0 112.469 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -68.17 -18.74 64.69 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 3.9 tpt -100.33 -46.69 5.18 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -175.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.6 p -65.74 -25.85 37.44 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.194 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -24.54 67.93 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 121.93 -0.481 . . . . 0.0 111.335 176.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -65.46 -29.29 69.94 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 122.963 0.505 . . . . 0.0 110.447 178.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.548 ' HA ' HD13 ' A' ' 106' ' ' LEU . . . -58.26 -32.08 68.03 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-O 121.383 0.611 . . . . 0.0 110.556 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.56 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 37.1 mt-30 -68.78 -18.19 64.16 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.864 -178.477 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 42.9 mtp -91.56 -15.09 29.19 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 103' ' ' ALA . 6.4 mp -53.44 -49.07 90.42 Favored Pre-proline 0 C--N 1.319 -0.728 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 25.5 Cg_endo -61.64 -22.31 74.14 Favored 'Trans proline' 0 C--N 1.364 1.39 0 C-N-CA 121.567 1.511 . . . . 0.0 113.077 177.715 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -85.09 -41.59 15.59 Favored 'General case' 0 N--CA 1.411 -2.385 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -75.88 -42.45 49.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.858 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.449 ' SG ' HD11 ' A' ' 63' ' ' LEU . 8.9 t -84.09 -2.08 56.08 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.649 -174.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 60.69 61.47 1.69 Allowed 'General case' 0 CA--C 1.508 -0.67 0 CA-C-O 122.991 1.377 . . . . 0.0 109.84 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.444 HD22 ' HB3' ' A' ' 71' ' ' GLN . 39.4 mt -96.86 158.03 15.62 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 114.106 -1.406 . . . . 0.0 109.53 178.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -81.37 43.74 0.75 Allowed 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 122.071 0.938 . . . . 0.0 111.57 -174.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 98.3 m -163.39 149.98 12.18 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 104.637 -2.357 . . . . 0.0 104.637 -177.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.7 m -142.38 139.48 31.73 Favored 'General case' 0 C--N 1.288 -2.072 0 CA-C-N 118.632 0.651 . . . . 0.0 109.602 178.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.56 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 55.1 mt . . . . . 0 C--N 1.3 -1.55 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -178.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.662 0 N-CA-C 111.321 -0.712 . . . . 0.0 111.321 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -76.81 127.79 33.4 Favored 'General case' 0 CA--C 1.49 -1.33 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 176.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.475 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 72.2 m -138.65 151.54 47.29 Favored 'General case' 0 C--N 1.282 -2.347 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.117 -176.071 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.9 p -81.79 172.37 13.43 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 120.96 0.409 . . . . 0.0 110.151 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -97.6 81.99 3.01 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.614 0.721 . . . . 0.0 109.87 176.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.1 t -156.27 164.56 38.18 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.4 mm -129.18 116.62 18.83 Favored Pre-proline 0 C--N 1.305 -1.358 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 177.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -72.65 146.53 86.9 Favored 'Cis proline' 0 C--O 1.244 0.778 0 C-N-CA 124.024 -1.24 . . . . 0.0 111.33 -1.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.475 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 61.2 Cg_endo -70.57 153.25 65.31 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.498 2.132 . . . . 0.0 112.263 -177.241 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.1 mm -95.66 107.92 20.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 N-CA-C 106.46 -1.682 . . . . 0.0 106.46 176.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 80.9 m -104.77 137.77 42.06 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-O 121.687 0.756 . . . . 0.0 112.144 -176.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -81.28 162.38 59.16 Favored Pre-proline 0 C--N 1.295 -1.798 0 CA-C-N 114.185 -1.371 . . . . 0.0 109.811 178.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.0 42.58 1.13 Allowed 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 123.073 2.515 . . . . 0.0 111.266 178.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -78.83 79.43 5.23 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.453 -178.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -140.96 33.27 2.04 Favored Glycine 0 C--N 1.289 -2.072 0 N-CA-C 106.964 -2.454 . . . . 0.0 106.964 174.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 pp -135.92 -11.2 2.02 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.215 -1.493 . . . . 0.0 113.32 -172.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -92.76 87.22 5.78 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-O 121.979 0.895 . . . . 0.0 109.188 178.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -135.38 96.26 14.0 Favored Pre-proline 0 C--N 1.289 -2.038 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 -177.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.501 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . 85.8 Cg_exo -51.7 -51.55 10.94 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.344 2.696 . . . . 0.0 111.975 -175.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.617 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 1.3 mpt_? -104.58 -51.26 3.12 Favored 'General case' 0 CA--C 1.486 -1.493 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 176.312 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 170.94 -49.42 0.19 Allowed Glycine 0 N--CA 1.405 -3.432 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 88.4 m -84.19 130.09 34.85 Favored 'General case' 0 C--N 1.271 -2.807 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 173.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -106.43 94.07 4.94 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 122.11 0.957 . . . . 0.0 108.923 177.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.426 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.1 mp -98.05 130.62 46.55 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.606 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 -176.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.504 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 35.7 ptt180 -67.37 116.26 7.92 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-O 121.15 0.5 . . . . 0.0 111.402 -176.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.512 ' HB ' ' OE1' ' A' ' 81' ' ' GLN . 2.6 pp -60.82 -18.5 17.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.918 -176.225 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -73.67 -16.57 61.21 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.879 -178.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.9 pt20 -89.56 -15.86 31.95 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.482 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.7 mm? -97.67 6.37 48.07 Favored 'General case' 0 CA--C 1.485 -1.555 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.417 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -56.59 -34.15 66.89 Favored 'General case' 0 C--N 1.31 -1.136 0 O-C-N 124.068 0.855 . . . . 0.0 111.655 -178.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -70.58 -52.88 18.56 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.5 t -54.51 -50.57 67.52 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.759 -1.109 . . . . 0.0 108.166 -178.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -52.94 -58.49 6.77 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 124.401 1.08 . . . . 0.0 112.161 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -66.14 -39.04 89.55 Favored 'General case' 0 C--O 1.214 -0.788 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.607 -173.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.411 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 1.9 t-80 -73.05 -24.87 60.75 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.183 -175.426 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.429 ' O ' ' HB3' ' A' ' 99' ' ' MET . 95.7 mt -88.68 -23.44 23.0 Favored 'General case' 0 C--O 1.21 -0.979 0 C-N-CA 120.866 -0.333 . . . . 0.0 111.781 177.334 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.54 ' HA ' HG13 ' A' ' 96' ' ' VAL . 40.8 p -89.52 -21.61 22.83 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 118.382 -1.327 . . . . 0.0 111.338 178.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.5 m -90.29 152.96 20.81 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.846 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.413 ' CE2' ' HA ' ' A' ' 96' ' ' VAL . 52.4 m-85 -129.88 -178.64 4.8 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.806 0.812 . . . . 0.0 111.658 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.742 ' OD1' ' HD3' ' A' ' 42' ' ' LYS . 11.8 t70 -127.86 -179.88 5.19 Favored 'General case' 0 N--CA 1.386 -3.666 0 N-CA-C 102.175 -3.269 . . . . 0.0 102.175 175.462 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -149.86 -33.61 0.19 Allowed 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 119.267 0.94 . . . . 0.0 110.728 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.742 ' HD3' ' OD1' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -86.21 7.43 25.13 Favored 'General case' 0 N--CA 1.425 -1.686 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.092 -177.094 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.507 ' HG ' ' OD1' ' A' ' 40' ' ' ASP . 95.7 mt -58.74 102.28 0.11 Allowed 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.48 0.712 . . . . 0.0 110.303 174.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -89.45 -26.67 20.84 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-O 121.774 0.797 . . . . 0.0 109.495 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 18.2 ptt? -148.01 87.31 1.6 Allowed 'General case' 0 N--CA 1.416 -2.147 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.81 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -100.95 19.79 16.68 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.338 177.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 46.2 t -68.69 -54.57 20.16 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.455 -176.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -142.64 91.33 2.3 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-O 121.75 0.786 . . . . 0.0 110.983 -177.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.543 ' HB2' ' HG2' ' A' ' 52' ' ' GLN . 14.1 m120 -129.97 151.57 78.49 Favored Pre-proline 0 C--N 1.303 -1.452 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 178.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -58.6 -34.61 98.98 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.458 2.106 . . . . 0.0 109.802 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.602 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 55.1 mtmt -67.07 -16.57 64.42 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 114.167 -1.379 . . . . 0.0 113.175 -178.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.543 ' HG2' ' HB2' ' A' ' 49' ' ' ASN . 65.9 mm-40 -74.96 -23.46 58.29 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 118.601 -1.24 . . . . 0.0 110.782 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.405 ' O ' ' HB3' ' A' ' 56' ' ' LEU . 11.5 pt20 -113.98 13.43 18.24 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 119.851 -0.74 . . . . 0.0 110.925 177.634 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.612 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 30.1 pt20 -63.78 -47.73 79.78 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.411 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 1.0 OUTLIER -66.91 -20.29 65.88 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.433 178.715 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.405 ' HB3' ' O ' ' A' ' 53' ' ' GLN . 12.0 tp -72.71 -54.27 9.42 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 174.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.5 m -57.94 -21.03 41.99 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.057 -179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 58.4 mt -90.19 -57.79 2.72 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.507 176.277 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 50.7 t -67.3 -50.4 60.42 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.119 0.568 . . . . 0.0 111.849 -176.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.594 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 43.4 t -61.71 -34.94 76.68 Favored 'General case' 0 CA--C 1.495 -1.14 0 CA-C-O 121.645 0.736 . . . . 0.0 109.262 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.488 ' O ' ' HG2' ' A' ' 64' ' ' GLN . 8.9 t30 -72.49 -35.93 68.28 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.631 178.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -76.06 -38.99 56.44 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-O 120.875 0.369 . . . . 0.0 111.376 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.667 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -71.83 -30.96 66.03 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 121.05 0.452 . . . . 0.0 110.617 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 24.2 pt20 -73.36 -4.27 32.36 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.189 0.518 . . . . 0.0 110.883 -177.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 7.9 mm-40 -84.94 -17.92 36.21 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 122.017 0.913 . . . . 0.0 108.578 176.074 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 10.2 t -85.07 164.19 2.56 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.471 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 4.9 mp0 -54.21 141.83 28.05 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 124.362 1.065 . . . . 0.0 110.616 177.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -57.6 -33.02 67.76 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -174.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.49 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 16.7 pt20 -80.22 -9.6 59.73 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.597 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.49 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.3 m -112.29 -9.57 13.87 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.215 -174.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 79.5 mt-30 -61.52 -40.24 93.92 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 121.123 0.487 . . . . 0.0 110.774 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 1.9 p -79.47 -27.24 41.58 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.317 0.579 . . . . 0.0 111.295 177.005 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 8.3 mm-40 -69.35 -33.46 73.13 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.483 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.06 -30.75 68.28 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.003 177.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.667 HD11 HD22 ' A' ' 63' ' ' LEU . 31.6 mm -66.94 -34.81 72.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.045 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -71.84 -40.07 69.3 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 -172.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 73' ' ' GLU . 7.2 mm100 -62.31 -37.12 84.35 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 112.579 -2.101 . . . . 0.0 109.439 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 74' ' ' ALA . 33.3 t -60.86 -48.48 88.71 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 75' ' ' ILE . 40.6 t -64.71 -46.82 91.09 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.724 -173.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -57.11 -49.67 75.19 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.614 -1.175 . . . . 0.0 112.129 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.512 ' OE1' ' HB ' ' A' ' 26' ' ' ILE . 28.8 pt20 -74.29 -30.33 62.04 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.359 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.402 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -75.18 -40.0 59.78 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 120.95 0.405 . . . . 0.0 111.095 -178.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.494 ' HB2' HE22 ' A' ' 93' ' ' GLN . 13.8 pt20 -72.92 -30.3 63.79 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.244 -177.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -75.91 -31.07 59.0 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.484 -179.147 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -75.66 -28.37 58.7 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.202 0.525 . . . . 0.0 111.62 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.492 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.4 mm? -84.6 -35.04 23.0 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.802 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -67.09 -32.22 73.23 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.13 0.491 . . . . 0.0 110.526 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -77.81 -11.04 59.85 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.875 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -89.24 -134.27 5.15 Favored Glycine 0 N--CA 1.424 -2.112 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -103.92 -49.78 3.55 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 120.756 0.312 . . . . 0.0 110.67 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -157.02 -148.18 5.01 Favored Glycine 0 N--CA 1.446 -0.637 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 100.53 -31.95 7.94 Favored Glycine 0 C--O 1.205 -1.663 0 CA-C-O 118.918 -0.934 . . . . 0.0 114.185 176.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.494 HE22 ' HB2' ' A' ' 83' ' ' GLN . 14.8 mm100 -48.95 -33.88 11.81 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -177.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -77.26 -37.17 53.6 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.039 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.564 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 29.2 pt20 -82.58 -44.46 15.81 Favored 'General case' 0 CA--C 1.497 -1.072 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.243 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.54 HG13 ' HA ' ' A' ' 37' ' ' THR . 95.8 t -58.55 -23.84 23.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.805 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -49.84 -44.11 49.3 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.912 178.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.564 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 29.0 pt20 -66.4 -18.24 65.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.854 0.359 . . . . 0.0 111.777 -177.141 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.429 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 6.4 tpt -101.37 -48.69 4.28 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -176.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.6 p -64.97 -24.21 35.05 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 CA-C-O 120.969 0.414 . . . . 0.0 111.499 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.432 ' HG3' ' N ' ' A' ' 102' ' ' LYS . 27.8 pttt -64.27 -23.77 67.42 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.918 -0.489 . . . . 0.0 110.578 176.067 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.432 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 24.6 mtpp -64.52 -32.71 74.46 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.706 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.566 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -64.0 -37.27 86.79 Favored 'General case' 0 C--O 1.196 -1.758 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.148 176.131 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -68.18 -18.62 64.65 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.226 0.536 . . . . 0.0 110.704 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 29.8 mtm -91.79 -14.8 29.24 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.566 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.6 OUTLIER -52.68 -44.32 95.09 Favored Pre-proline 0 N--CA 1.475 0.794 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -177.368 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.446 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 18.2 Cg_endo -60.34 -24.0 76.22 Favored 'Trans proline' 0 C--N 1.368 1.594 0 CA-C-N 120.935 1.37 . . . . 0.0 112.862 176.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -89.24 -37.67 14.8 Favored 'General case' 0 N--CA 1.408 -2.564 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.138 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -76.88 -34.09 57.79 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 12.4 t -91.97 -2.81 56.56 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 59.7 t30 66.3 56.09 0.82 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 122.42 1.105 . . . . 0.0 109.696 178.202 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 107' ' ' PRO . 36.8 mt -101.48 157.1 17.06 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.102 -179.223 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -78.47 39.83 0.35 Allowed 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.876 0.87 . . . . 0.0 112.979 -173.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 86.3 m -154.8 158.48 39.51 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 -174.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 24.0 p -147.01 141.23 26.2 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 43.1 mm . . . . . 0 C--N 1.313 -1.012 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -179.898 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.057 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 49.3 mtm180 -91.7 127.05 37.01 Favored 'General case' 0 CA--C 1.472 -2.035 0 C-N-CA 119.392 -0.923 . . . . 0.0 108.775 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 60.6 m -124.74 140.5 52.87 Favored 'General case' 0 C--N 1.27 -2.878 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 177.224 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.6 p -69.0 140.38 55.0 Favored 'General case' 0 N--CA 1.415 -2.214 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -84.86 69.13 10.71 Favored 'General case' 0 N--CA 1.421 -1.907 0 CA-C-O 121.602 0.715 . . . . 0.0 109.912 -175.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 t -148.5 171.79 15.53 Favored 'General case' 0 N--CA 1.417 -2.094 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 39.7 mm -128.45 118.21 20.17 Favored Pre-proline 0 C--N 1.303 -1.451 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -72.93 145.75 84.95 Favored 'Cis proline' 0 C--O 1.245 0.835 0 C-N-CA 123.877 -1.301 . . . . 0.0 112.668 1.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -77.66 136.86 15.72 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 122.401 2.067 . . . . 0.0 112.154 -178.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 42.9 mm -95.88 110.03 23.69 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.126 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 79.0 m -105.38 135.95 45.83 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -176.249 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -111.37 154.93 43.53 Favored Pre-proline 0 C--N 1.305 -1.363 0 C-N-CA 125.59 1.556 . . . . 0.0 108.801 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -47.78 -56.51 3.03 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.868 3.045 . . . . 0.0 113.335 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -159.42 -153.34 0.35 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 105.222 -2.14 . . . . 0.0 105.222 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -157.58 -65.41 0.01 OUTLIER Glycine 0 CA--C 1.474 -2.514 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 179.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -137.49 -61.86 0.63 Allowed 'General case' 0 N--CA 1.422 -1.872 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -146.78 107.55 4.13 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.07 178.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -136.38 115.09 10.69 Favored Pre-proline 0 C--N 1.301 -1.502 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.418 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . 36.4 Cg_exo -62.32 -42.79 26.24 Favored 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 121.964 1.776 . . . . 0.0 110.195 177.137 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.514 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 2.9 mpt_? -126.08 -50.86 1.55 Allowed 'General case' 0 CA--C 1.491 -1.314 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 172.13 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.43 65.77 1.06 Allowed Glycine 0 N--CA 1.407 -3.284 0 N-CA-C 108.643 -1.783 . . . . 0.0 108.643 -174.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 m -91.43 150.39 21.28 Favored 'General case' 0 C--N 1.272 -2.763 0 CA-C-N 114.439 -0.881 . . . . 0.0 109.907 176.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -107.39 98.91 8.48 Favored 'General case' 0 C--N 1.276 -2.599 0 CA-C-O 122.144 0.973 . . . . 0.0 110.05 178.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.49 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 3.3 mp -105.29 138.99 27.73 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.813 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.623 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 16.8 ptt180 -68.51 117.41 10.24 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-O 121.171 0.51 . . . . 0.0 110.734 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.473 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -64.06 -13.53 13.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -176.144 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -77.36 -20.12 55.26 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.953 -178.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.623 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 14.9 pt20 -86.68 -15.91 38.16 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 119.884 -0.726 . . . . 0.0 109.382 -178.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.422 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.6 mm? -98.69 1.77 46.49 Favored 'General case' 0 CA--C 1.483 -1.623 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.79 177.217 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.478 ' O ' ' HG2' ' A' ' 34' ' ' MET . 27.7 t-20 -56.18 -32.96 64.82 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.898 -178.248 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -71.98 -52.9 14.87 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -177.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.416 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -54.72 -53.73 51.12 Favored 'General case' 0 CA--C 1.516 -0.353 0 O-C-N 123.682 0.613 . . . . 0.0 109.863 177.717 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 40.4 tt0 -49.42 -58.45 5.12 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 123.88 0.872 . . . . 0.0 112.63 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 11.8 ptp -65.96 -43.02 89.15 Favored 'General case' 0 CA--C 1.498 -1.055 0 C-N-CA 119.95 -0.7 . . . . 0.0 111.72 -175.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -67.7 -32.79 73.67 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 123.835 0.71 . . . . 0.0 110.825 -174.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.433 ' O ' ' HB3' ' A' ' 99' ' ' MET . 94.7 mt -78.46 -25.69 45.91 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-O 121.135 0.493 . . . . 0.0 111.171 178.046 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.467 HG22 HG11 ' A' ' 96' ' ' VAL . 68.0 p -91.69 -0.27 57.55 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.709 174.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.8 t -88.29 121.79 31.08 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.747 -175.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -128.34 94.85 3.99 Favored 'General case' 0 N--CA 1.419 -2.017 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 169.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -77.37 178.28 7.28 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.624 -177.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -102.19 -30.95 10.81 Favored 'General case' 0 C--N 1.279 -2.457 0 C-N-CA 123.59 0.756 . . . . 0.0 111.657 -173.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.82 14.28 17.82 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.988 -175.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.5 mt -60.03 103.22 0.2 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.929 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -120.49 -14.92 8.61 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.171 0.51 . . . . 0.0 110.161 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 94.9 mmm -133.83 31.2 3.65 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.31 23.27 12.24 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.599 -176.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 46.9 t -76.76 -61.38 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 178.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -148.99 110.81 4.55 Favored 'General case' 0 CA--C 1.496 -1.131 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 174.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.408 ' HB3' ' HG2' ' A' ' 52' ' ' GLN . 45.7 t-20 -149.76 133.55 8.79 Favored Pre-proline 0 C--N 1.288 -2.083 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 -174.383 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -53.25 -35.61 74.76 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.056 2.504 . . . . 0.0 112.188 178.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -68.11 -20.17 64.9 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.408 ' HG2' ' HB3' ' A' ' 49' ' ' ASN . 23.7 mm-40 -65.43 -26.38 67.94 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.136 178.16 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -78.05 5.3 10.24 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -178.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.49 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 29.6 pt20 -57.31 -37.34 72.31 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.21 0.604 . . . . 0.0 110.48 177.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.59 -22.59 66.13 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.838 -178.154 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -74.3 -43.82 55.21 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 177.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.2 m -61.66 -26.7 68.18 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.172 0.511 . . . . 0.0 110.783 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 59.3 mt -84.45 -53.37 5.48 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.397 177.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.5 t -65.4 -48.03 74.25 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.11 0.964 . . . . 0.0 111.16 -175.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.526 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.7 t -59.4 -33.3 71.04 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 122.97 0.508 . . . . 0.0 110.53 177.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -81.45 -23.43 37.48 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.712 0.767 . . . . 0.0 110.373 -178.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -83.13 -40.02 20.32 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.326 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.526 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.9 pp -67.5 -32.57 73.47 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 121.229 0.538 . . . . 0.0 110.522 -178.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.402 ' N ' HD12 ' A' ' 63' ' ' LEU . 16.4 pt20 -71.73 -7.25 46.94 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.656 -179.081 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -78.44 -22.31 47.83 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.747 0.784 . . . . 0.0 109.15 175.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.412 HG12 ' HB2' ' A' ' 70' ' ' CYS . 7.3 t -82.15 163.95 2.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.224 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -50.79 144.02 8.97 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.06 0.544 . . . . 0.0 110.579 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.484 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 21.8 ptmt -62.19 -31.02 71.49 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -174.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -79.27 -10.57 59.85 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.545 0.688 . . . . 0.0 109.94 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.412 ' HB2' HG12 ' A' ' 66' ' ' VAL . 59.8 m -108.44 -10.48 15.28 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.943 -176.143 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.484 ' NE2' ' HA ' ' A' ' 68' ' ' LYS . 77.3 mt-30 -59.3 -40.61 86.74 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 178.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.515 ' HA ' HG12 ' A' ' 75' ' ' ILE . 8.7 p -83.93 -23.76 31.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 120.024 -0.67 . . . . 0.0 112.625 177.702 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.03 -36.03 82.15 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.697 0.76 . . . . 0.0 109.534 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.412 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -58.05 -29.54 65.45 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.265 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.576 HG21 ' HD3' ' A' ' 107' ' ' PRO . 28.5 mm -67.39 -35.79 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.09 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.377 -177.584 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.491 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 14.3 mmmm -69.05 -41.78 77.16 Favored 'General case' 0 CA--C 1.489 -1.385 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 -176.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.52 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 6.7 mt-30 -59.58 -39.35 83.81 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 113.689 -1.596 . . . . 0.0 111.425 -177.26 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.422 HG22 ' HB3' ' A' ' 29' ' ' LEU . 21.9 t -56.99 -44.6 82.96 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 O-C-N 123.743 0.652 . . . . 0.0 109.52 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 23.7 t -65.55 -48.55 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 CA-C-N 115.507 -0.769 . . . . 0.0 108.966 -176.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 43.1 mt-10 -55.71 -52.68 63.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.558 -1.201 . . . . 0.0 111.054 -177.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.52 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -71.29 -34.82 71.0 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -177.138 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.433 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -71.8 -37.64 70.36 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -177.593 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -76.95 -37.01 56.1 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.753 -179.002 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.432 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -69.38 -30.62 68.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.693 0.282 . . . . 0.0 111.309 -177.75 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 2.3 pt20 -73.23 -31.47 64.16 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.141 0.496 . . . . 0.0 110.058 -177.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.1 mm? -82.7 -30.48 29.14 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.929 175.398 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -59.95 -40.1 87.86 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 123.36 0.664 . . . . 0.0 110.045 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -83.34 -5.75 59.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.701 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -94.58 -136.71 8.46 Favored Glycine 0 N--CA 1.418 -2.515 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.839 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -93.35 -19.02 21.74 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -175.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 148.17 -118.48 0.99 Allowed Glycine 0 CA--C 1.483 -1.924 0 N-CA-C 108.444 -1.863 . . . . 0.0 108.444 -175.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.56 -33.29 2.32 Favored Glycine 0 C--O 1.201 -1.93 0 CA-C-O 118.683 -1.065 . . . . 0.0 114.903 173.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -47.2 -33.08 4.97 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 -177.094 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -77.15 -37.0 54.83 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 120.797 0.332 . . . . 0.0 111.361 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.559 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 14.0 pt20 -85.59 -41.29 15.38 Favored 'General case' 0 C--O 1.212 -0.905 0 CA-C-O 121.452 0.644 . . . . 0.0 110.038 -177.696 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.467 HG11 HG22 ' A' ' 37' ' ' THR . 73.2 t -62.32 -23.48 32.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 C-N-CA 124.9 1.28 . . . . 0.0 111.045 176.336 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.448 ' HA ' HG12 ' A' ' 100' ' ' VAL . 35.5 tt0 -53.22 -37.32 61.94 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -177.515 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.6 pt20 -68.96 -18.6 64.1 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.89 0.376 . . . . 0.0 111.629 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.433 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 6.3 tpt -106.04 -45.13 4.42 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -174.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.448 HG12 ' HA ' ' A' ' 97' ' ' GLN . 14.8 p -62.72 -24.9 36.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.987 178.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -61.31 -22.97 65.37 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.862 -0.524 . . . . 0.0 111.173 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -67.58 -23.59 65.41 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 122.055 -0.403 . . . . 0.0 110.484 177.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.453 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -63.92 -34.92 79.05 Favored 'General case' 0 C--O 1.202 -1.429 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 174.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.481 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 44.7 mt-30 -75.39 -19.41 59.55 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.547 -179.095 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 48.2 mtt -86.92 -15.65 38.29 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.796 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.453 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 95.8 mt -52.37 -50.7 78.26 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -178.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.576 ' HD3' HG21 ' A' ' 75' ' ' ILE . 29.9 Cg_endo -62.96 -22.63 73.92 Favored 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 121.981 1.788 . . . . 0.0 112.524 178.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -83.72 -41.79 17.3 Favored 'General case' 0 N--CA 1.408 -2.546 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -176.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -81.41 -33.84 31.97 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.303 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.403 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 23.2 t -87.52 -1.51 57.98 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 53.34 60.22 3.87 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.146 1.378 . . . . 0.0 110.33 -179.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.462 HD21 HD11 ' A' ' 63' ' ' LEU . 79.5 mt -91.19 159.73 15.91 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-N 113.984 -1.462 . . . . 0.0 110.087 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -74.37 35.83 0.1 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.088 0.955 . . . . 0.0 112.221 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.426 ' H ' ' C ' ' A' ' 112' ' ' LEU . 57.3 m -157.62 149.27 21.95 Favored 'General case' 0 N--CA 1.417 -2.097 0 C-N-CA 125.702 1.601 . . . . 0.0 107.645 -175.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 4.5 p -134.59 131.96 38.48 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-O 120.99 0.424 . . . . 0.0 110.45 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.481 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 62.0 mt . . . . . 0 C--N 1.303 -1.451 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 178.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -1.001 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -75.23 149.6 38.84 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.467 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 61.8 m -127.89 148.19 50.48 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.7 p -68.29 154.99 40.65 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 176.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -92.04 71.41 5.49 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.713 0.768 . . . . 0.0 109.246 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.0 t -147.12 169.71 18.71 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.4 mp -128.82 114.72 19.09 Favored Pre-proline 0 C--N 1.31 -1.138 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -75.53 147.09 87.63 Favored 'Cis proline' 0 C--O 1.237 0.426 0 C-N-CA 124.075 -1.219 . . . . 0.0 111.816 0.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.467 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 59.1 Cg_endo -72.74 141.46 33.98 Favored 'Trans proline' 0 N--CA 1.446 -1.293 0 C-N-CA 122.118 1.878 . . . . 0.0 111.941 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.7 mm -92.03 113.1 26.77 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 177.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 84.4 m -104.28 133.8 48.57 Favored 'General case' 0 C--N 1.284 -2.241 0 CA-C-O 121.373 0.606 . . . . 0.0 111.798 -174.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -90.28 149.49 41.32 Favored Pre-proline 0 N--CA 1.413 -2.309 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.688 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -56.97 -31.15 88.9 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.887 2.391 . . . . 0.0 110.299 175.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -152.86 -67.4 0.16 Allowed 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 114.082 -1.417 . . . . 0.0 108.15 174.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 142.61 -35.67 1.7 Allowed Glycine 0 CA--C 1.482 -2.019 0 CA-C-N 114.428 -1.26 . . . . 0.0 110.532 -177.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.442 HD11 ' HA ' ' A' ' 114' ' ' CYS . 17.9 tp -147.3 -28.84 0.36 Allowed 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -175.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.454 ' HA ' ' NZ ' ' A' ' 76' ' ' LYS . 30.2 t70 -135.6 95.24 3.22 Favored 'General case' 0 C--N 1.296 -1.734 0 C-N-CA 119.408 -0.917 . . . . 0.0 113.137 -174.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -144.07 72.54 16.53 Favored Pre-proline 0 C--N 1.302 -1.493 0 CA-C-O 121.567 0.699 . . . . 0.0 112.124 174.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.468 ' HD2' ' NH1' ' A' ' 20' ' ' ARG . 83.9 Cg_endo -82.01 7.7 4.92 Favored 'Trans proline' 0 CA--C 1.534 0.484 0 C-N-CA 122.439 2.092 . . . . 0.0 111.641 176.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.468 ' NH1' ' HD2' ' A' ' 19' ' ' PRO . 2.6 mpt_? -91.64 -42.94 9.9 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 177.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -73.06 -47.04 25.8 Favored Glycine 0 N--CA 1.426 -2.028 0 CA-C-N 114.313 -1.312 . . . . 0.0 110.398 177.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 56.0 m -78.05 113.24 15.79 Favored 'General case' 0 N--CA 1.406 -2.63 0 CA-C-O 121.316 0.579 . . . . 0.0 110.69 176.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -96.68 102.43 14.21 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.967 0.889 . . . . 0.0 109.827 177.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.2 mp -109.91 138.53 37.13 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.262 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 178.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.486 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 39.8 ptt180 -79.03 122.19 25.88 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.536 -177.669 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.494 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.5 pp -62.7 -15.82 15.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -176.182 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -79.3 -15.89 57.24 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.927 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.1 pt20 -84.88 -27.93 26.35 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 119.265 -0.974 . . . . 0.0 108.531 178.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.462 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.6 mm? -87.31 1.74 52.32 Favored 'General case' 0 CA--C 1.481 -1.707 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.41 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -53.26 -34.72 58.39 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.171 0.919 . . . . 0.0 110.591 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -69.47 -53.41 19.34 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.856 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.8 OUTLIER -55.96 -51.69 66.8 Favored 'General case' 0 CA--C 1.503 -0.843 0 O-C-N 123.164 0.29 . . . . 0.0 110.309 178.442 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 -49.51 -55.74 12.27 Favored 'General case' 0 N--CA 1.426 -1.658 0 C-N-CA 123.667 0.787 . . . . 0.0 111.713 176.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.7 ptm -68.69 -38.09 80.05 Favored 'General case' 0 C--O 1.209 -1.028 0 C-N-CA 121.088 -0.245 . . . . 0.0 111.497 -176.04 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.856 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -70.89 -19.45 62.61 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.009 0.433 . . . . 0.0 111.158 -177.444 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 84.6 mt -88.5 -34.09 17.55 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.902 175.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.499 ' HB ' HD21 ' A' ' 86' ' ' LEU . 82.8 p -85.94 -21.04 28.11 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 119.344 -0.942 . . . . 0.0 111.211 -178.085 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -89.26 127.07 35.74 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.31 -178.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -102.74 109.4 20.98 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 171.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.425 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 4.7 t70 -68.35 165.83 17.88 Favored 'General case' 0 C--N 1.319 -0.728 0 O-C-N 123.454 0.471 . . . . 0.0 110.346 -173.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 31.6 p90 -102.54 -33.6 9.43 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.628 -169.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.36 5.53 17.14 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 119.678 -0.809 . . . . 0.0 111.596 -173.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.425 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 24.7 mt -76.13 80.08 2.95 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.222 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -107.08 -61.83 1.49 Allowed 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 173.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 16.3 mmt -105.65 -17.28 14.45 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 114.08 -1.418 . . . . 0.0 107.847 178.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.19 97.53 6.96 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.195 -1.366 . . . . 0.0 109.958 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 54.1 t -127.67 -73.14 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 179.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -101.74 107.19 18.33 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -160.66 149.06 13.12 Favored Pre-proline 0 C--N 1.308 -1.231 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 -176.009 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -48.86 -41.16 39.62 Favored 'Trans proline' 0 C--N 1.361 1.19 0 C-N-CA 123.223 2.615 . . . . 0.0 112.454 176.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -73.95 -11.14 60.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.885 0.374 . . . . 0.0 111.533 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -97.11 -15.31 21.02 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.541 179.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -110.32 6.27 22.28 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.157 0.503 . . . . 0.0 110.138 178.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.545 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 3.7 pt20 -51.79 -39.76 59.2 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.059 -178.683 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.484 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 0.8 OUTLIER -66.37 -23.76 66.39 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 114.903 -1.044 . . . . 0.0 113.158 -176.152 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -75.31 -43.34 51.45 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.1 m -62.93 -25.71 68.46 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 123.658 0.599 . . . . 0.0 110.539 179.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 63.9 mt -84.83 -46.99 10.81 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.538 177.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -68.83 -50.63 48.41 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -176.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.506 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.2 t -58.27 -34.29 70.34 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 120.921 0.391 . . . . 0.0 110.169 178.117 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.421 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 9.7 t30 -76.22 -27.21 56.73 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.294 0.568 . . . . 0.0 111.506 -178.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -82.78 -41.81 18.71 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.796 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.571 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -70.64 -33.59 71.15 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.026 -178.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.421 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 3.4 pt20 -70.23 -14.97 62.85 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -176.539 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -79.74 -13.12 59.68 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.514 177.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 18.5 t -77.45 163.68 3.75 Favored 'Isoleucine or valine' 0 C--O 1.254 1.338 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 174.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -48.38 142.44 5.66 Favored 'General case' 0 CA--C 1.508 -0.654 0 C-N-CA 123.566 0.746 . . . . 0.0 110.782 176.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -61.17 -29.13 69.61 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -173.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.493 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 12.1 pt20 -80.31 -22.15 41.85 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-O 121.487 0.66 . . . . 0.0 109.96 178.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.493 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.4 m -99.77 -8.32 24.38 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.051 -172.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.5 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 76.1 mt-30 -60.93 -41.62 96.56 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.197 0.522 . . . . 0.0 110.869 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.42 ' HA ' HG12 ' A' ' 75' ' ' ILE . 5.3 p -78.31 -23.79 46.93 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.637 176.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.431 ' HA ' ' HG2' ' A' ' 76' ' ' LYS . 33.5 mm-40 -69.85 -30.79 68.36 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.935 177.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.446 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -62.7 -27.33 69.18 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.83 176.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.571 HD11 HD22 ' A' ' 63' ' ' LEU . 28.3 mm -73.36 -24.61 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.052 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.454 ' NZ ' ' HA ' ' A' ' 17' ' ' ASP . 32.1 mmtp -74.49 -41.94 59.83 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 -176.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.467 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 64.7 mm-40 -56.12 -46.4 79.19 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 111.818 -2.446 . . . . 0.0 110.052 -179.38 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.462 HG22 ' HB3' ' A' ' 29' ' ' LEU . 22.9 t -54.94 -46.05 76.32 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 O-C-N 124.204 0.94 . . . . 0.0 110.152 -179.172 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 75' ' ' ILE . 26.0 t -67.78 -47.87 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.748 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -175.157 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.76 -45.85 85.33 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.104 -1.407 . . . . 0.0 111.945 -176.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.494 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.7 pt20 -77.29 -35.24 55.25 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 111.448 0.166 . . . . 0.0 111.448 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.409 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . . . -71.07 -38.87 72.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.884 0.373 . . . . 0.0 111.483 -177.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -72.35 -36.74 68.86 Favored 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.059 -178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.452 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -73.19 -32.47 64.84 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.761 -0.375 . . . . 0.0 111.231 -176.971 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.409 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 3.3 pt20 -71.9 -28.96 63.85 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.745 -176.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.502 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.2 mm? -85.27 -33.79 22.08 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.208 174.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -59.69 -35.73 75.08 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.552 0.741 . . . . 0.0 111.251 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 85' ' ' GLN . 29.6 pt20 -73.14 -11.72 60.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.137 -178.064 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -92.79 -126.69 4.15 Favored Glycine 0 N--CA 1.427 -1.96 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.016 -177.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -107.56 -22.4 12.54 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 120.929 0.395 . . . . 0.0 110.588 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 165.91 -128.78 1.82 Allowed Glycine 0 N--CA 1.434 -1.446 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -178.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.41 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 91.12 -28.86 7.52 Favored Glycine 0 C--O 1.202 -1.848 0 CA-C-O 119.549 -0.584 . . . . 0.0 112.479 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -52.76 -34.38 52.83 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 123.97 0.908 . . . . 0.0 111.714 -176.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.417 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 8.7 pt20 -75.57 -37.2 60.09 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.579 -179.493 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.569 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 13.1 pt20 -82.59 -45.71 14.24 Favored 'General case' 0 CA--C 1.498 -1.047 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.033 -177.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.502 HG21 ' HG ' ' A' ' 86' ' ' LEU . 96.0 t -57.66 -23.2 19.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 124.376 1.07 . . . . 0.0 110.725 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.482 ' HA ' HG12 ' A' ' 100' ' ' VAL . 53.0 tt0 -50.73 -40.36 54.18 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.803 0.441 . . . . 0.0 111.78 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.2 pt20 -68.76 -18.36 64.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.633 -176.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.453 ' O ' HD22 ' A' ' 36' ' ' LEU . 8.1 tpt -102.44 -48.55 4.12 Favored 'General case' 0 CA--C 1.485 -1.546 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -177.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.482 HG12 ' HA ' ' A' ' 97' ' ' GLN . 14.3 p -60.37 -24.27 30.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.747 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.81 -24.86 64.5 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.851 -0.531 . . . . 0.0 111.688 174.337 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -64.46 -30.39 71.43 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 120.773 0.321 . . . . 0.0 110.188 177.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.506 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -62.8 -28.79 70.24 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-O 121.418 0.628 . . . . 0.0 109.989 177.212 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -73.58 -18.6 61.04 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.163 -178.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 42.3 mtt -92.11 -18.28 23.78 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.808 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.9 OUTLIER -48.18 -48.28 64.74 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 123.884 0.873 . . . . 0.0 113.121 -178.326 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.491 ' HG2' HG12 ' A' ' 116' ' ' ILE . 22.5 Cg_exo -61.35 -26.09 81.08 Favored 'Trans proline' 0 C--N 1.359 1.104 0 C-N-CA 121.533 1.488 . . . . 0.0 113.355 178.314 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -89.17 -37.44 15.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.812 177.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -74.68 -34.17 62.61 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 12.8 t -93.75 -2.7 53.38 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 64.1 t30 57.27 63.64 1.83 Allowed 'General case' 0 C--O 1.244 0.785 0 CA-C-O 123.01 1.386 . . . . 0.0 110.885 -179.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.7 mt -100.36 157.88 16.3 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 113.039 -1.891 . . . . 0.0 109.401 178.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -78.22 31.25 0.18 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.747 1.219 . . . . 0.0 112.944 -173.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.442 ' HA ' HD11 ' A' ' 16' ' ' LEU . 91.8 m -150.3 167.84 25.81 Favored 'General case' 0 C--N 1.269 -2.923 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -174.085 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 69.6 m -150.79 133.72 15.93 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 175.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.491 HG12 ' HG2' ' A' ' 107' ' ' PRO . 46.1 mm . . . . . 0 C--O 1.263 1.764 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -177.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.901 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.0 mmm180 -76.68 141.46 40.93 Favored 'General case' 0 CA--C 1.494 -1.193 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.9 m -137.33 150.87 48.05 Favored 'General case' 0 C--N 1.276 -2.61 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.6 p -69.27 155.4 40.48 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.291 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -87.75 73.61 9.27 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 175.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.2 t -150.04 167.23 27.36 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.9 mm -128.49 118.79 20.25 Favored Pre-proline 0 C--N 1.306 -1.311 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.76 147.63 89.91 Favored 'Cis proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.763 -1.349 . . . . 0.0 111.876 -1.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.28 136.08 25.94 Favored 'Trans proline' 0 C--O 1.247 0.94 0 C-N-CA 122.184 1.923 . . . . 0.0 112.063 -178.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.8 mm -96.15 124.01 48.65 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 178.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.1 m -109.82 141.21 42.81 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-O 121.579 0.704 . . . . 0.0 112.06 -175.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -107.15 158.47 32.93 Favored Pre-proline 0 C--N 1.298 -1.659 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.019 -177.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -82.81 54.5 4.86 Favored 'Trans proline' 0 C--O 1.248 1.007 0 C-N-CA 122.857 2.372 . . . . 0.0 109.253 174.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -143.39 153.56 42.82 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 114.071 -1.422 . . . . 0.0 107.291 -176.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 118.09 -82.68 0.33 Allowed Glycine 0 CA--C 1.468 -2.88 0 N-CA-C 107.931 -2.067 . . . . 0.0 107.931 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.0 pp -175.4 146.24 0.79 Allowed 'General case' 0 N--CA 1.423 -1.794 0 CA-C-N 114.822 -0.689 . . . . 0.0 109.35 175.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.603 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 5.6 p-10 -135.02 16.89 3.49 Favored 'General case' 0 C--N 1.281 -2.383 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 170.044 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.434 ' OD1' ' HA2' ' A' ' 21' ' ' GLY . 2.2 t-20 -99.33 91.23 1.36 Allowed Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 113.645 -1.616 . . . . 0.0 107.012 176.301 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.609 ' HD2' ' OE1' ' A' ' 73' ' ' GLU . 33.5 Cg_exo -58.17 -54.8 2.73 Favored 'Trans proline' 0 C--N 1.357 1.005 0 C-N-CA 123.89 3.06 . . . . 0.0 115.016 -171.665 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.483 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 5.4 mpt_? -85.8 -48.29 8.93 Favored 'General case' 0 CA--C 1.47 -2.114 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 -177.049 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.434 ' HA2' ' OD1' ' A' ' 18' ' ' ASN . . . 99.05 42.58 2.78 Favored Glycine 0 CA--C 1.458 -3.485 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -174.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.6 m -73.15 140.15 46.86 Favored 'General case' 0 N--CA 1.405 -2.68 0 CA-C-N 114.201 -1.0 . . . . 0.0 110.116 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -99.84 124.48 45.18 Favored 'General case' 0 N--CA 1.415 -2.193 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 173.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.429 HD11 ' HB2' ' A' ' 73' ' ' GLU . 4.1 mp -119.93 145.47 26.15 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -176.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.496 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 35.1 ptt180 -66.14 120.68 13.63 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-O 121.599 0.714 . . . . 0.0 110.06 -178.231 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.47 -14.99 19.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.261 0.553 . . . . 0.0 111.97 -175.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -75.53 -20.84 58.43 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.54 -177.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 6.8 pt20 -85.41 -34.95 21.59 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 119.334 -0.946 . . . . 0.0 109.828 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.423 HD11 ' HB1' ' A' ' 74' ' ' ALA . 2.0 mm? -79.54 -7.81 58.74 Favored 'General case' 0 CA--C 1.475 -1.921 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.21 -177.59 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -54.08 -33.82 58.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 124.246 0.966 . . . . 0.0 110.192 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -69.52 -57.63 4.98 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.449 ' HB3' HG11 ' A' ' 78' ' ' VAL . 0.7 OUTLIER -56.1 -47.5 77.95 Favored 'General case' 0 C--O 1.215 -0.718 0 O-C-N 123.909 0.756 . . . . 0.0 110.392 179.738 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -52.76 -57.95 8.45 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 124.316 1.046 . . . . 0.0 111.842 176.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -67.41 -38.24 84.33 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.818 -175.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -74.0 -28.74 61.6 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.3 mt -78.53 -24.33 45.76 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 120.176 -0.609 . . . . 0.0 110.757 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.509 ' HB ' HD21 ' A' ' 86' ' ' LEU . 73.6 p -89.87 -12.77 38.04 Favored 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 118.734 -1.186 . . . . 0.0 111.25 176.735 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.6 t -88.71 144.9 25.96 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.403 178.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -120.59 129.23 53.67 Favored 'General case' 0 N--CA 1.438 -1.041 0 CA-C-O 121.247 0.546 . . . . 0.0 111.206 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.406 ' OD2' HD11 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -70.89 107.41 4.02 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 122.669 1.224 . . . . 0.0 112.885 178.946 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -105.16 -15.67 15.0 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 112.538 -2.119 . . . . 0.0 109.508 -177.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.81 13.76 3.66 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.581 -178.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.586 ' HB3' ' O ' ' A' ' 46' ' ' ALA . 90.6 mt -66.88 105.99 1.76 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.904 177.432 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -98.96 -68.27 0.81 Allowed 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.362 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 88.8 mtp -109.31 5.77 23.91 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.462 0.649 . . . . 0.0 110.068 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.586 ' O ' ' HB3' ' A' ' 43' ' ' LEU . . . -109.35 131.91 54.62 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.461 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 43.6 t -106.36 -51.0 8.0 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.994 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 171.017 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -131.93 139.35 48.68 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 104.939 -2.245 . . . . 0.0 104.939 172.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.455 ' HB3' ' HG2' ' A' ' 52' ' ' GLN . 26.6 t-20 -158.97 143.54 11.47 Favored Pre-proline 0 C--N 1.303 -1.421 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -176.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -49.46 -38.13 43.14 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 123.835 3.023 . . . . 0.0 113.248 178.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -72.18 -12.11 61.03 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -177.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.455 ' HG2' ' HB3' ' A' ' 49' ' ' ASN . 79.4 mm-40 -81.91 -24.55 35.58 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -94.09 14.27 20.46 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.489 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.557 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 24.4 pt20 -52.5 -38.41 59.47 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.464 0.706 . . . . 0.0 110.17 177.069 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.406 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 0.8 OUTLIER -56.46 -29.59 61.87 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-N 114.702 -1.136 . . . . 0.0 112.523 -178.842 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -82.5 -42.36 18.54 Favored 'General case' 0 CA--C 1.49 -1.357 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.3 m -60.42 -31.09 70.07 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.399 0.619 . . . . 0.0 109.93 178.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 44.9 mt -81.8 -53.13 6.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.116 177.56 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 25.3 t -59.13 -49.72 76.78 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 123.443 0.697 . . . . 0.0 111.731 -177.276 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.529 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.0 t -58.55 -35.56 72.52 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.45 0.643 . . . . 0.0 110.419 179.238 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -82.05 -23.69 35.71 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.874 0.845 . . . . 0.0 110.762 -176.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.401 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 64.6 tt0 -86.84 -38.63 16.62 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.7 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.562 HD22 HD11 ' A' ' 75' ' ' ILE . 4.1 pp -68.76 -32.33 72.01 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.11 0.481 . . . . 0.0 109.865 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.464 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 14.6 pt20 -68.61 -10.32 55.28 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.903 -178.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.42 -15.49 59.31 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.516 0.674 . . . . 0.0 109.223 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.6 t -86.49 163.37 2.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 174.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.512 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.6 mt-10 -49.38 143.05 6.88 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 122.938 0.495 . . . . 0.0 110.675 175.443 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.491 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 9.1 ptpp? -59.8 -32.46 70.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -175.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.514 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 27.8 pt20 -72.89 -24.01 60.79 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.612 0.72 . . . . 0.0 109.972 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.514 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.0 m -100.22 -9.14 22.75 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.047 -174.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.512 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 79.0 mt-30 -61.5 -39.17 90.0 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.894 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.415 ' HA ' HG12 ' A' ' 75' ' ' ILE . 11.0 p -83.55 -23.99 31.79 Favored 'General case' 0 CA--C 1.502 -0.874 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.692 177.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.609 ' OE1' ' HD2' ' A' ' 19' ' ' PRO . 7.0 mm-40 -66.03 -34.36 77.91 Favored 'General case' 0 C--O 1.248 1.024 0 CA-C-O 122.073 0.939 . . . . 0.0 108.763 178.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.423 ' HB1' HD11 ' A' ' 29' ' ' LEU . . . -61.21 -31.52 71.29 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.7 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.562 HD11 HD22 ' A' ' 63' ' ' LEU . 31.0 mm -69.62 -33.62 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.638 -176.401 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.541 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 30.7 mmtp -67.88 -41.15 83.22 Favored 'General case' 0 CA--C 1.487 -1.445 0 CA-C-N 115.234 -0.894 . . . . 0.0 108.871 -178.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 6.6 mt-30 -61.05 -36.37 79.41 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.161 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.449 HG11 ' HB3' ' A' ' 32' ' ' CYS . 23.6 t -57.8 -46.57 87.08 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.702 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 178.224 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 45.1 t -62.51 -45.49 98.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.359 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.541 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 35.6 mt-10 -57.87 -52.23 66.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.236 -177.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 3.5 pt20 -75.06 -31.95 61.4 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.102 -175.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.16 -37.34 58.07 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -177.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -73.85 -32.86 63.86 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.575 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.95 -32.28 59.45 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.578 -175.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -71.83 -27.49 62.94 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.246 0.546 . . . . 0.0 110.261 -178.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.509 HD21 ' HB ' ' A' ' 37' ' ' THR . 3.8 mm? -83.94 -35.11 24.26 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.988 174.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.536 ' HA ' HE21 ' A' ' 93' ' ' GLN . 29.6 tt0 -60.59 -33.5 72.83 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.515 0.726 . . . . 0.0 111.647 178.413 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -86.8 -1.55 57.86 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.258 0.551 . . . . 0.0 111.329 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -95.86 -144.83 17.72 Favored Glycine 0 N--CA 1.419 -2.434 0 CA-C-O 121.753 0.641 . . . . 0.0 113.023 -177.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -100.23 -41.28 7.16 Favored 'General case' 0 C--N 1.279 -2.458 0 CA-C-N 114.84 -0.68 . . . . 0.0 111.045 -174.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 179.69 -176.84 47.86 Favored Glycine 0 N--CA 1.418 -2.547 0 N-CA-C 108.919 -1.672 . . . . 0.0 108.919 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.481 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 119.66 -25.14 7.75 Favored Glycine 0 N--CA 1.408 -3.205 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.27 -177.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.536 HE21 ' HA ' ' A' ' 87' ' ' GLN . 19.4 mp0 -47.35 -40.3 17.02 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.931 0.892 . . . . 0.0 112.092 -178.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -77.11 -37.31 54.48 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.583 -176.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.663 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 12.3 pt20 -80.66 -43.52 20.29 Favored 'General case' 0 C--O 1.209 -1.065 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.147 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.428 HG21 ' HG ' ' A' ' 86' ' ' LEU . 69.0 t -61.06 -23.51 30.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 C-N-CA 124.594 1.158 . . . . 0.0 110.541 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -54.57 -37.62 65.69 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.873 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.663 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 30.0 pt20 -71.8 -18.35 62.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.866 0.365 . . . . 0.0 111.143 -178.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.2 tpt -96.78 -47.26 5.94 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 -176.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -62.45 -27.75 43.37 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.319 178.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.1 pptp? -63.85 -21.2 66.33 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.912 -0.492 . . . . 0.0 111.286 176.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -65.36 -28.82 69.55 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.383 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.43 -30.92 69.94 Favored 'General case' 0 C--O 1.207 -1.135 0 CA-C-O 121.186 0.517 . . . . 0.0 110.313 178.236 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.445 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 38.6 mt-30 -68.83 -19.31 64.26 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.253 0.549 . . . . 0.0 109.887 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 49.4 mtp -91.97 -19.94 21.89 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 7.0 mp -53.55 -47.5 96.2 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.59 -22.32 73.86 Favored 'Trans proline' 0 C--N 1.362 1.243 0 CA-C-N 120.74 1.3 . . . . 0.0 112.658 176.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -85.09 -49.5 8.21 Favored 'General case' 0 N--CA 1.411 -2.399 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -73.46 -38.92 65.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.062 -175.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.451 ' SG ' HD21 ' A' ' 112' ' ' LEU . 34.0 t -82.82 -0.83 49.78 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 66.5 t30 63.12 40.71 8.75 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.886 1.274 . . . . 0.0 110.477 173.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.451 HD21 ' SG ' ' A' ' 110' ' ' CYS . 48.8 mt -80.97 159.55 24.87 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.314 -177.162 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -69.36 41.55 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 C-N-CA 125.062 1.345 . . . . 0.0 112.657 -176.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 56.7 m -158.06 146.13 18.67 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -176.032 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 40.1 m -134.03 119.25 18.74 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-O 121.062 0.458 . . . . 0.0 110.063 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.445 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 67.1 mt . . . . . 0 C--N 1.304 -1.404 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.11 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 44.3 mtp180 -95.96 131.95 41.79 Favored 'General case' 0 CA--C 1.492 -1.262 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 74.3 m -134.15 146.36 50.13 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 175.275 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.6 p -75.87 160.85 29.51 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 121.087 0.47 . . . . 0.0 110.357 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -91.29 66.33 5.56 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.8 t -152.44 172.35 16.65 Favored 'General case' 0 N--CA 1.421 -1.901 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -177.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.8 mm -128.35 118.29 20.31 Favored Pre-proline 0 C--N 1.313 -1.009 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 177.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.62 146.41 86.51 Favored 'Cis proline' 0 C--O 1.244 0.796 0 C-N-CA 123.817 -1.326 . . . . 0.0 111.608 0.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -68.45 126.82 14.71 Favored 'Trans proline' 0 N--CA 1.446 -1.304 0 C-N-CA 121.799 1.666 . . . . 0.0 110.126 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.4 mm -89.58 112.37 24.35 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.187 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -178.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 63.2 m -104.46 136.71 43.53 Favored 'General case' 0 C--N 1.287 -2.147 0 CA-C-O 121.581 0.705 . . . . 0.0 110.82 -176.52 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.434 ' C ' ' H ' ' A' ' 14' ' ' ASP . 71.5 m-85 -93.16 159.13 36.08 Favored Pre-proline 0 C--N 1.287 -2.126 0 CA-C-N 114.401 -1.272 . . . . 0.0 110.321 -178.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -73.65 36.49 0.39 Allowed 'Trans proline' 0 N--CA 1.486 1.038 0 C-N-CA 123.555 2.837 . . . . 0.0 112.057 178.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.434 ' H ' ' C ' ' A' ' 12' ' ' PHE . 14.8 t70 -90.59 130.46 36.61 Favored 'General case' 0 N--CA 1.424 -1.767 0 C-N-CA 125.275 1.43 . . . . 0.0 110.015 -176.361 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 167.14 -53.11 0.24 Allowed Glycine 0 C--N 1.281 -2.489 0 N-CA-C 110.324 -1.111 . . . . 0.0 110.324 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.75 -60.39 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 179.325 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -156.45 155.86 32.79 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -161.25 87.03 1.66 Allowed Pre-proline 0 C--N 1.303 -1.413 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -173.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -65.99 -31.81 45.84 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 123.62 2.88 . . . . 0.0 116.572 -171.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.536 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 2.5 mpt_? -83.82 -34.03 24.77 Favored 'General case' 0 CA--C 1.473 -1.997 0 C-N-CA 119.172 -1.011 . . . . 0.0 109.802 -175.286 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.97 24.63 27.69 Favored Glycine 0 C--N 1.277 -2.712 0 CA-C-N 114.098 -1.41 . . . . 0.0 113.21 -178.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.1 m -60.92 124.58 20.9 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 123.827 0.369 . . . . 0.0 111.273 174.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -106.73 116.82 32.58 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.867 0.842 . . . . 0.0 109.727 177.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.428 HG21 ' HB2' ' A' ' 74' ' ' ALA . 3.4 mp -120.49 132.58 69.71 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 -177.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.541 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 21.7 ptt180 -67.49 117.06 8.94 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 121.148 0.499 . . . . 0.0 111.484 -177.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.566 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.7 pp -61.98 -14.37 11.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -177.424 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -79.24 -17.33 54.97 Favored 'General case' 0 N--CA 1.423 -1.8 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.257 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.0 pt20 -79.98 -23.57 41.5 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.507 ' HB2' ' OE1' ' A' ' 81' ' ' GLN . 2.5 mm? -93.73 4.46 53.9 Favored 'General case' 0 CA--C 1.489 -1.381 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.048 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -55.02 -31.95 61.45 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 123.624 0.577 . . . . 0.0 111.595 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.424 ' O ' ' HB3' ' A' ' 35' ' ' HIS . 25.4 t-80 -71.67 -53.11 14.63 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 107.84 -1.171 . . . . 0.0 107.84 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.51 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -55.86 -50.29 71.02 Favored 'General case' 0 C--N 1.314 -0.97 0 O-C-N 124.357 1.036 . . . . 0.0 109.188 -177.988 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -49.92 -58.26 5.79 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 125.148 1.379 . . . . 0.0 111.83 174.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.2 ptm -66.8 -37.88 85.41 Favored 'General case' 0 C--O 1.192 -1.972 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.03 -177.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.424 ' HB3' ' O ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -58.66 -33.87 70.58 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 123.555 0.742 . . . . 0.0 111.246 179.0 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 89.4 mt -81.48 -41.27 22.0 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.147 178.461 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.445 ' HA ' HG13 ' A' ' 96' ' ' VAL . 45.8 p -85.24 -21.33 29.13 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.108 -175.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.6 t -90.76 121.23 32.47 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.214 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -98.67 98.92 10.01 Favored 'General case' 0 C--N 1.282 -2.355 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 170.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.434 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 6.7 t70 -73.18 174.59 7.77 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.931 -1.032 . . . . 0.0 109.516 -176.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 28.2 p90 -95.31 -36.52 11.37 Favored 'General case' 0 C--N 1.282 -2.351 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -167.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.4 -0.27 32.15 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-O 121.621 0.724 . . . . 0.0 110.952 -175.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.434 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 47.3 mt -77.55 2.44 16.41 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.419 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.8 ptt180 -62.14 -13.95 32.25 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 124.375 1.07 . . . . 0.0 111.823 178.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 22.1 ptp -151.7 11.68 0.59 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.476 ' HA ' ' OD1' ' A' ' 49' ' ' ASN . . . -139.82 91.75 2.5 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.783 -170.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 45.2 t -130.11 -65.1 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 177.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -98.84 69.56 1.81 Allowed 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.774 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.476 ' OD1' ' HA ' ' A' ' 46' ' ' ALA . 11.2 m120 -130.37 150.48 76.34 Favored Pre-proline 0 C--N 1.303 -1.454 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -49.78 -50.77 12.29 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 123.453 2.769 . . . . 0.0 114.312 -176.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -80.02 -8.54 59.42 Favored 'General case' 0 CA--C 1.5 -0.947 0 C-N-CA 120.44 -0.504 . . . . 0.0 112.05 -176.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.422 ' HG2' ' HB2' ' A' ' 49' ' ' ASN . 86.5 mm-40 -84.94 -24.87 28.19 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 176.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -69.45 -4.69 19.7 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.252 -179.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.632 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 11.1 pt20 -49.89 -41.18 45.11 Favored 'General case' 0 C--O 1.199 -1.558 0 C-N-CA 123.942 0.897 . . . . 0.0 110.844 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.429 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 0.1 OUTLIER -61.17 -30.19 70.25 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.405 0.621 . . . . 0.0 112.431 -177.996 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -86.21 -40.11 15.92 Favored 'General case' 0 CA--C 1.496 -1.111 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 -179.101 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 t -59.27 -24.0 62.86 Favored 'General case' 0 C--O 1.209 -1.054 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.693 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.632 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 88.6 mt -87.63 -56.04 3.52 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.769 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 27.4 t -57.88 -51.75 68.32 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.471 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 11.0 t -59.31 -33.42 71.08 Favored 'General case' 0 N--CA 1.428 -1.542 0 C-N-CA 124.197 0.999 . . . . 0.0 110.748 178.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 61.9 t30 -81.25 -23.19 38.18 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.129 -176.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 21.2 tp60 -80.06 -46.38 16.65 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.28 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.56 ' O ' ' HG2' ' A' ' 71' ' ' GLN . 3.6 pp -69.14 -35.44 76.37 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.291 -175.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -68.88 -17.38 63.97 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 122.991 0.516 . . . . 0.0 111.735 -175.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 63.6 mm-40 -83.61 -13.31 54.61 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 121.377 0.608 . . . . 0.0 109.713 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.3 t -79.63 162.68 3.77 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -50.52 141.59 12.06 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 123.492 0.717 . . . . 0.0 110.98 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.418 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 18.8 ptpt -57.83 -31.77 66.96 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -174.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.447 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 4.1 pt20 -82.11 -12.71 58.05 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.26 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.447 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 42.7 m -110.75 -12.6 14.28 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.584 -174.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.56 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 67.4 mt-30 -56.28 -46.47 79.73 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.434 0.694 . . . . 0.0 110.796 176.591 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.412 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.0 p -75.09 -23.86 58.05 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.324 0.583 . . . . 0.0 111.468 178.327 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 64.7 mm-40 -73.98 -29.52 62.02 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.402 0.62 . . . . 0.0 110.287 177.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.432 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -64.24 -23.13 67.2 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.586 176.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.533 HD11 HD22 ' A' ' 63' ' ' LEU . 35.2 mm -72.87 -27.75 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.362 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -73.03 -41.0 64.67 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 -175.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.47 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 12.1 mm100 -56.6 -47.95 78.49 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 111.676 -2.511 . . . . 0.0 110.133 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.462 HG22 ' HB3' ' A' ' 29' ' ' LEU . 20.0 t -56.23 -44.59 79.8 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 O-C-N 124.03 0.832 . . . . 0.0 109.771 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 75' ' ' ILE . 31.0 t -68.09 -42.34 85.01 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.686 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -174.567 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -61.95 -53.0 61.7 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.597 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.566 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.7 pt20 -71.55 -31.05 66.58 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.791 0.329 . . . . 0.0 111.852 -176.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.2 -40.97 64.32 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.881 -0.327 . . . . 0.0 110.954 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -70.55 -41.38 72.56 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.154 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.486 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -65.33 -35.99 82.67 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.299 -176.168 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.486 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 1.3 pt20 -71.94 -33.6 68.35 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.604 -174.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.505 HD12 ' HA3' ' A' ' 92' ' ' GLY . 2.7 mm? -84.46 -39.29 19.1 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.391 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -57.48 -41.28 80.37 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 123.804 0.842 . . . . 0.0 111.06 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 84' ' ' LYS . 29.8 pt20 -90.98 -8.67 48.55 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.322 0.582 . . . . 0.0 110.737 -178.081 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -89.9 -78.88 1.34 Allowed Glycine 0 N--CA 1.426 -1.996 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.846 -176.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -132.76 -12.54 2.96 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.74 -106.79 1.42 Allowed Glycine 0 C--N 1.285 -2.254 0 N-CA-C 106.865 -2.494 . . . . 0.0 106.865 -173.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.505 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 77.26 -37.29 1.55 Allowed Glycine 0 C--O 1.185 -2.908 0 CA-C-O 119.039 -0.867 . . . . 0.0 115.04 172.143 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.427 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 14.0 mm100 -52.29 -21.06 3.12 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -175.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -79.2 -39.72 32.56 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.084 0.469 . . . . 0.0 110.877 174.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -86.0 -38.95 17.37 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 121.625 0.726 . . . . 0.0 110.217 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.445 HG13 ' HA ' ' A' ' 37' ' ' THR . 72.2 t -69.71 -22.52 25.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.207 0 C-N-CA 125.631 1.572 . . . . 0.0 110.633 176.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.427 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 53.6 tt0 -45.91 -44.75 14.89 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -59.87 -28.13 67.27 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 123.069 0.548 . . . . 0.0 112.04 178.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.415 ' O ' HD22 ' A' ' 36' ' ' LEU . 5.2 tpt -96.59 -48.08 5.67 Favored 'General case' 0 CA--C 1.494 -1.206 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -174.426 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.2 p -60.38 -27.98 41.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.603 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -25.16 68.18 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.958 -0.464 . . . . 0.0 111.265 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -64.54 -25.58 68.04 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 122.661 0.384 . . . . 0.0 110.855 177.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.443 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -60.36 -36.26 77.59 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-O 121.495 0.664 . . . . 0.0 110.032 176.779 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -73.24 -16.51 61.4 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.74 0.781 . . . . 0.0 110.297 -177.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 54.3 mtp -92.67 -15.85 26.27 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.978 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.45 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 92.6 mt -55.1 -47.07 99.4 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.927 -177.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.471 ' HD3' HG21 ' A' ' 75' ' ' ILE . 12.3 Cg_endo -58.78 -22.28 60.95 Favored 'Trans proline' 0 C--N 1.366 1.497 0 C-N-CA 121.759 1.639 . . . . 0.0 113.127 175.361 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -84.82 -47.83 9.98 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.044 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -68.49 -47.41 67.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.1 -176.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 97.8 m -81.3 2.05 29.83 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 47.9 t30 53.58 64.48 1.83 Allowed 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 122.97 1.367 . . . . 0.0 110.697 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.422 HD21 HD11 ' A' ' 63' ' ' LEU . 62.9 mt -98.59 158.19 15.76 Favored 'General case' 0 C--N 1.275 -2.673 0 CA-C-N 113.396 -1.729 . . . . 0.0 108.659 -178.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -81.08 45.1 0.81 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.814 0.816 . . . . 0.0 111.068 -175.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 57.2 m -160.88 155.3 23.3 Favored 'General case' 0 C--N 1.285 -2.226 0 C-N-CA 125.722 1.609 . . . . 0.0 106.712 -176.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 41.5 m -150.32 136.76 18.88 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 38.0 mm . . . . . 0 C--N 1.309 -1.158 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.001 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.488 -1.63 0 N-CA-C 110.705 -0.958 . . . . 0.0 110.705 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.7 mmm180 -94.63 139.87 30.63 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 -178.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 58.1 m -116.47 150.75 37.35 Favored 'General case' 0 C--N 1.277 -2.582 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.607 -176.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.6 p -82.53 166.1 19.57 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.781 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -90.55 76.98 6.51 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 175.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t -152.67 163.95 38.67 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.1 mm -128.79 115.91 19.26 Favored Pre-proline 0 C--N 1.305 -1.334 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 176.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.59 147.18 88.98 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.869 -1.305 . . . . 0.0 111.692 -1.27 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.85 140.16 45.46 Favored 'Trans proline' 0 C--O 1.247 0.959 0 C-N-CA 122.661 2.241 . . . . 0.0 111.789 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 40.3 mm -95.32 116.99 38.22 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 65.8 m -104.85 131.3 52.5 Favored 'General case' 0 C--N 1.284 -2.281 0 CA-C-O 121.462 0.649 . . . . 0.0 110.893 -177.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -98.53 142.03 23.92 Favored Pre-proline 0 N--CA 1.426 -1.666 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.477 -178.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.9 -17.51 36.87 Favored 'Trans proline' 0 C--O 1.242 0.708 0 C-N-CA 123.359 2.706 . . . . 0.0 114.79 -175.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -158.36 162.25 37.64 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 -177.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.39 66.06 0.59 Allowed Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 121.569 -0.348 . . . . 0.0 113.026 176.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.407 HD12 ' N ' ' A' ' 17' ' ' ASP . 1.8 pp -99.69 -16.61 18.11 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.723 0.773 . . . . 0.0 110.83 177.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.407 ' N ' HD12 ' A' ' 16' ' ' LEU . 27.4 t70 -100.99 103.74 14.89 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.807 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -124.4 104.33 31.63 Favored Pre-proline 0 C--N 1.292 -1.906 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -178.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.493 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . 53.1 Cg_exo -56.56 -41.02 80.37 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 123.034 2.49 . . . . 0.0 112.342 -178.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.493 ' HD2' ' HB2' ' A' ' 19' ' ' PRO . 2.1 mpt_? -123.04 -49.32 1.96 Allowed 'General case' 0 CA--C 1.496 -1.112 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 175.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 90.29 48.95 3.38 Favored Glycine 0 CA--C 1.468 -2.901 0 N-CA-C 109.013 -1.635 . . . . 0.0 109.013 -176.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 86.3 m -75.98 138.87 41.22 Favored 'General case' 0 C--N 1.279 -2.468 0 CA-C-N 114.159 -1.02 . . . . 0.0 110.088 179.263 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -101.83 102.95 13.62 Favored 'General case' 0 N--CA 1.423 -1.81 0 CA-C-O 122.269 1.033 . . . . 0.0 109.2 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.516 HD11 ' HB2' ' A' ' 73' ' ' GLU . 3.1 mp -102.08 144.16 13.75 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.568 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -178.074 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.443 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.8 ptt180 -70.58 115.28 9.57 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.161 0.505 . . . . 0.0 110.736 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.415 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -65.64 -10.9 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.417 ' HG2' ' HB2' ' A' ' 25' ' ' ARG . 4.1 pt20 -78.08 -21.02 51.16 Favored 'General case' 0 N--CA 1.427 -1.609 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.098 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.447 ' HG3' HD22 ' A' ' 29' ' ' LEU . 1.0 OUTLIER -82.06 -26.54 33.63 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 119.492 -0.883 . . . . 0.0 108.813 -179.98 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.491 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.4 mm? -86.58 -1.7 57.87 Favored 'General case' 0 CA--C 1.487 -1.474 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.152 -178.757 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.573 ' O ' ' HG2' ' A' ' 34' ' ' MET . 8.2 t30 -51.65 -32.65 30.19 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 124.265 0.978 . . . . 0.0 111.692 179.791 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 30.9 t-80 -70.31 -56.42 6.78 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.507 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.452 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -53.84 -53.28 54.67 Favored 'General case' 0 CA--C 1.507 -0.709 0 O-C-N 123.918 0.761 . . . . 0.0 110.052 178.717 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -47.88 -56.14 8.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.201 1.001 . . . . 0.0 112.283 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.573 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 14.3 ptp -70.66 -44.11 67.78 Favored 'General case' 0 C--O 1.202 -1.402 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.261 -176.11 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 43.0 m80 -68.28 -22.88 64.71 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -178.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 89.0 mt -81.7 -34.24 30.74 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.663 174.627 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.473 ' HA ' HG13 ' A' ' 96' ' ' VAL . 62.0 p -84.2 -22.16 31.0 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 117.84 -1.544 . . . . 0.0 112.212 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.6 p -90.69 145.95 24.41 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-O 121.735 0.779 . . . . 0.0 112.559 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -122.12 124.49 44.02 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 104.645 -2.354 . . . . 0.0 104.645 169.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.484 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 6.9 t0 -78.46 160.54 27.65 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.912 -174.131 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -95.08 -31.79 13.41 Favored 'General case' 0 C--N 1.27 -2.872 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.772 -167.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.5 6.35 38.22 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 118.911 -1.116 . . . . 0.0 111.462 -175.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.484 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 56.2 mt -72.23 84.9 1.05 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.408 177.206 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 82.5 mtp180 -119.7 -22.53 6.84 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 121.22 0.533 . . . . 0.0 109.683 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.4 mmm -117.23 15.68 14.89 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.5 ' HA ' ' CG ' ' A' ' 49' ' ' ASN . . . -137.27 28.03 2.82 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.523 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 59.5 t -56.24 -46.34 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 O-C-N 123.934 0.771 . . . . 0.0 109.029 -178.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -133.39 102.08 5.4 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 169.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.5 ' CG ' ' HA ' ' A' ' 46' ' ' ALA . 0.7 OUTLIER -139.39 151.83 67.83 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.101 -175.746 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.529 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 58.5 Cg_endo -69.6 -15.44 37.69 Favored 'Trans proline' 0 N--CA 1.476 0.487 0 C-N-CA 122.891 2.394 . . . . 0.0 111.019 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -68.49 -15.76 63.65 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.162 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -66.01 -25.74 67.21 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 50' ' ' PRO . 11.3 pt20 -80.45 8.8 6.92 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 120.466 -0.494 . . . . 0.0 111.556 -178.538 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.505 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 25.5 pt20 -51.15 -46.1 61.9 Favored 'General case' 0 C--O 1.245 0.818 0 C-N-CA 124.34 1.056 . . . . 0.0 111.273 178.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.46 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.6 p-80 -72.3 -21.64 61.31 Favored 'General case' 0 N--CA 1.426 -1.627 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.561 -176.031 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -80.22 -42.69 22.79 Favored 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.3 m -59.82 -27.23 66.43 Favored 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.732 0.645 . . . . 0.0 110.718 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 47.0 mt -88.15 -51.17 5.93 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.775 176.037 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.7 t -59.72 -48.14 82.85 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.429 0.692 . . . . 0.0 111.895 -177.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.512 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 42.1 t -57.86 -35.94 71.65 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.269 0.557 . . . . 0.0 110.091 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.552 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 4.1 t-20 -76.56 -25.67 54.29 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.16 -176.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -85.57 -44.9 12.26 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.954 178.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.566 HD22 HD11 ' A' ' 75' ' ' ILE . 3.7 pp -66.26 -31.9 73.0 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.365 0.603 . . . . 0.0 110.24 -177.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.552 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 3.3 pt20 -71.97 -9.24 58.08 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.684 -178.294 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -78.29 -15.91 58.28 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.416 0.627 . . . . 0.0 109.819 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.0 t -84.05 161.61 3.22 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 174.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 33.7 mt-10 -49.31 142.2 7.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.287 0.635 . . . . 0.0 111.306 177.095 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.459 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 15.5 ptpt -56.38 -33.42 65.72 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -174.06 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.502 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.8 pt20 -77.57 -22.81 50.38 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 121.758 0.79 . . . . 0.0 110.176 -179.504 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.502 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 66.3 m -98.57 -13.15 20.56 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.672 -173.142 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 76.8 mt-30 -57.04 -40.69 77.25 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 123.234 0.614 . . . . 0.0 111.802 178.198 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.456 ' HA ' HG12 ' A' ' 75' ' ' ILE . 20.4 p -83.47 -24.06 31.95 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 119.409 -0.917 . . . . 0.0 111.981 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.516 ' HB2' HD11 ' A' ' 24' ' ' ILE . 9.4 mm-40 -64.92 -36.8 85.55 Favored 'General case' 0 CA--C 1.553 1.091 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 177.725 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.466 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -58.12 -31.79 67.52 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.093 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.566 HD11 HD22 ' A' ' 63' ' ' LEU . 28.2 mm -69.91 -32.6 52.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.322 -176.337 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.477 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 14.6 mmmm -68.92 -41.07 78.66 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 -178.224 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.489 ' NE2' ' HB ' ' A' ' 24' ' ' ILE . 5.9 mt-30 -61.01 -37.87 84.07 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 113.598 -1.637 . . . . 0.0 110.639 -179.431 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.491 HG22 ' HB3' ' A' ' 29' ' ' LEU . 40.3 t -55.91 -46.85 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 123.94 0.775 . . . . 0.0 109.233 178.721 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 38.4 t -62.95 -46.08 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.357 -175.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 38.6 mt-10 -56.88 -52.3 65.7 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.307 -178.093 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -73.33 -32.12 64.38 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.816 -176.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.414 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -71.35 -39.69 71.14 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.045 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -72.56 -41.08 66.15 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.545 -179.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.427 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -66.67 -27.92 68.04 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 120.841 0.353 . . . . 0.0 111.62 -176.822 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.428 ' HA ' ' NE2' ' A' ' 88' ' ' GLN . 1.1 pt20 -77.67 -30.33 51.95 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.824 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.495 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.2 mm? -87.04 -41.64 13.7 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.165 0.507 . . . . 0.0 111.982 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -58.66 -32.13 68.81 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.727 1.211 . . . . 0.0 112.412 -177.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.428 ' NE2' ' HA ' ' A' ' 85' ' ' GLN . 11.4 pt20 -73.72 -9.48 58.7 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -174.315 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -154.86 -73.6 0.01 OUTLIER Glycine 0 C--N 1.304 -1.206 0 C-N-CA 118.649 -1.738 . . . . 0.0 113.975 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -61.18 -43.03 99.52 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -175.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.495 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 101.49 -106.1 2.98 Favored Glycine 0 CA--C 1.473 -2.54 0 N-CA-C 105.728 -2.949 . . . . 0.0 105.728 -170.004 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.403 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 75.61 -24.94 1.44 Allowed Glycine 0 C--O 1.186 -2.892 0 N-CA-C 115.555 0.982 . . . . 0.0 115.555 169.75 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -58.61 -21.6 53.97 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 118.887 1.344 . . . . 0.0 113.719 -174.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -77.65 -38.11 48.49 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.503 174.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.402 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 13.3 pt20 -85.19 -43.0 14.2 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 122.025 0.917 . . . . 0.0 109.38 -178.898 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.473 HG13 ' HA ' ' A' ' 37' ' ' THR . 72.1 t -63.2 -22.71 31.42 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 C-N-CA 125.821 1.648 . . . . 0.0 110.146 177.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -45.14 -47.45 12.26 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.436 0.694 . . . . 0.0 112.527 -179.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 29.7 pt20 -69.32 -17.6 63.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.041 -177.074 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 4.9 tpt -100.14 -45.45 5.64 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -178.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.7 p -66.55 -25.85 36.07 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.186 179.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.88 -26.26 67.28 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 122.025 -0.422 . . . . 0.0 111.395 175.219 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -63.0 -31.9 73.14 Favored 'General case' 0 C--O 1.208 -1.08 0 C-N-CA 122.802 0.441 . . . . 0.0 110.015 178.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -61.58 -31.81 71.88 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-O 121.147 0.499 . . . . 0.0 110.486 178.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -72.62 -20.91 61.2 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.728 0.775 . . . . 0.0 109.629 -179.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' MET . . . . . 0.433 ' O ' ' HB2' ' A' ' 108' ' ' ASN . 48.2 mtp -92.4 -17.3 24.8 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.563 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.434 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 3.6 mp -53.17 -46.52 97.75 Favored Pre-proline 0 N--CA 1.471 0.603 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 16.3 Cg_endo -60.94 -22.31 74.01 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 121.216 1.278 . . . . 0.0 112.577 176.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 105' ' ' MET . 16.0 m120 -84.71 -49.42 8.51 Favored 'General case' 0 N--CA 1.415 -2.196 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -74.2 -33.3 63.36 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.757 -174.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.472 ' SG ' HD21 ' A' ' 112' ' ' LEU . 34.8 t -89.32 -6.98 56.25 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 60.0 64.33 1.29 Allowed 'General case' 0 C--O 1.241 0.633 0 CA-C-O 123.499 1.619 . . . . 0.0 110.653 -178.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.472 HD21 ' SG ' ' A' ' 110' ' ' CYS . 40.4 mt -101.83 159.24 15.51 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 112.412 -2.176 . . . . 0.0 109.555 178.706 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -74.32 45.28 0.22 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.092 0.957 . . . . 0.0 111.952 -175.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 56.0 m -162.12 164.49 27.97 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 124.046 0.938 . . . . 0.0 109.297 -175.683 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 55.0 m -150.64 123.74 8.8 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 66.4 mt . . . . . 0 C--N 1.311 -1.085 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -178.329 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.52 0 N-CA-C 109.195 -1.562 . . . . 0.0 109.195 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 49.7 mtm105 -76.79 127.63 33.11 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 117.698 0.749 . . . . 0.0 109.738 179.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 64.5 m -136.48 144.97 44.64 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.209 -175.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.1 p -73.48 148.25 43.34 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -87.75 79.47 8.18 Favored 'General case' 0 N--CA 1.42 -1.93 0 CA-C-O 121.799 0.809 . . . . 0.0 108.876 177.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.4 p -140.98 164.91 28.99 Favored 'General case' 0 N--CA 1.417 -2.108 0 CA-C-N 113.984 -1.462 . . . . 0.0 107.99 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 34.1 mm -128.72 110.93 18.89 Favored Pre-proline 0 C--N 1.3 -1.578 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -73.06 151.49 97.14 Favored 'Cis proline' 0 C--O 1.248 1.004 0 C-N-CA 124.341 -1.108 . . . . 0.0 112.192 -0.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -74.02 156.98 47.3 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.258 1.972 . . . . 0.0 111.998 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.7 mm -114.65 117.2 54.87 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 N-CA-C 107.03 -1.471 . . . . 0.0 107.03 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 85.8 m -106.59 145.15 32.26 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-O 121.826 0.822 . . . . 0.0 111.879 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -98.89 152.09 37.67 Favored Pre-proline 0 N--CA 1.416 -2.151 0 CA-C-N 114.0 -1.455 . . . . 0.0 110.155 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.38 45.32 1.55 Allowed 'Trans proline' 0 C--O 1.247 0.949 0 C-N-CA 123.139 2.559 . . . . 0.0 111.541 179.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -153.52 132.57 12.56 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.972 -178.016 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -161.09 -119.66 0.52 Allowed Glycine 0 N--CA 1.425 -2.034 0 N-CA-C 109.273 -1.531 . . . . 0.0 109.273 177.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -151.4 -52.48 0.13 Allowed 'General case' 0 C--N 1.296 -1.731 0 CA-C-O 121.222 0.534 . . . . 0.0 110.937 177.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -95.86 17.13 15.86 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-O 121.788 0.804 . . . . 0.0 110.199 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -130.01 121.45 19.8 Favored Pre-proline 0 C--N 1.295 -1.772 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.767 -178.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.431 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . 66.9 Cg_exo -57.03 -48.01 20.24 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.692 2.261 . . . . 0.0 110.421 174.209 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.442 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 1.7 mpt_? -109.21 -59.16 1.93 Allowed 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 107.996 -1.112 . . . . 0.0 107.996 174.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.45 58.25 0.96 Allowed Glycine 0 CA--C 1.466 -2.983 0 N-CA-C 108.739 -1.744 . . . . 0.0 108.739 -173.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.1 m -83.31 134.69 34.91 Favored 'General case' 0 N--CA 1.404 -2.736 0 CA-C-N 114.362 -0.919 . . . . 0.0 112.08 -177.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.454 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 3.3 pt20 -101.12 101.05 11.7 Favored 'General case' 0 N--CA 1.416 -2.143 0 CA-C-O 122.443 1.116 . . . . 0.0 110.276 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.446 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 2.4 mp -115.08 132.37 64.54 Favored 'Isoleucine or valine' 0 C--N 1.261 -3.241 0 N-CA-C 105.628 -1.99 . . . . 0.0 105.628 176.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.527 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.6 ptt180 -68.55 118.13 11.18 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -65.67 -16.42 20.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.226 0.536 . . . . 0.0 111.926 -176.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -74.87 -16.52 60.67 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.254 -178.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 7.0 pt20 -89.18 -19.63 25.22 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.277 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.424 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.7 mm? -89.88 -0.23 57.44 Favored 'General case' 0 CA--C 1.477 -1.859 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.743 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -50.38 -37.66 38.49 Favored 'General case' 0 C--O 1.218 -0.598 0 O-C-N 124.413 1.071 . . . . 0.0 111.146 178.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -66.81 -52.98 37.43 Favored 'General case' 0 C--O 1.215 -0.747 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.839 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.7 OUTLIER -58.28 -51.94 67.68 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 123.274 0.359 . . . . 0.0 110.639 179.523 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -50.05 -52.34 35.2 Favored 'General case' 0 N--CA 1.434 -1.233 0 C-N-CA 124.162 0.985 . . . . 0.0 111.608 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptm -71.71 -41.05 69.06 Favored 'General case' 0 C--O 1.211 -0.946 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.521 -177.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.839 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 1.4 p80 -68.16 -24.68 65.0 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.995 0.426 . . . . 0.0 111.954 -176.228 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.416 HD22 ' O ' ' A' ' 99' ' ' MET . 95.2 mt -83.39 -40.61 19.15 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.81 176.428 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.471 ' HA ' HG13 ' A' ' 96' ' ' VAL . 58.5 p -83.7 -21.0 32.49 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 118.947 -1.101 . . . . 0.0 112.929 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.6 m -90.66 121.54 32.66 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -100.94 97.91 8.44 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 169.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.439 ' HB3' ' CD1' ' A' ' 43' ' ' LEU . 8.0 t70 -80.78 174.31 11.74 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.843 -170.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 43.7 p90 -98.15 -37.84 9.55 Favored 'General case' 0 C--N 1.29 -2.022 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -167.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.74 2.19 43.17 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 119.446 -0.901 . . . . 0.0 111.043 -174.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.439 ' CD1' ' HB3' ' A' ' 40' ' ' ASP . 54.2 mt -81.12 86.67 6.13 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.773 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.404 ' HG3' ' HG3' ' A' ' 45' ' ' MET . 37.9 ptt180 -110.36 -32.95 6.77 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.194 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.404 ' HG3' ' HG3' ' A' ' 44' ' ' ARG . 66.1 mtt -109.47 27.52 9.46 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.137 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -141.08 87.13 2.07 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.572 -1.195 . . . . 0.0 109.918 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 45.2 t -132.33 -57.78 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 177.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -136.58 87.12 2.27 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 104.718 -2.327 . . . . 0.0 104.718 172.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -153.12 164.27 20.92 Favored Pre-proline 0 C--N 1.299 -1.619 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 -172.236 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.89 -24.22 37.91 Favored 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 123.116 2.544 . . . . 0.0 111.6 174.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.555 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 31.3 mmmt -71.07 -10.97 60.66 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.831 178.758 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -88.92 -10.93 46.01 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 122.069 0.938 . . . . 0.0 108.929 176.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -93.93 -10.08 34.96 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.19 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.572 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 29.6 pt20 -60.39 -48.33 82.22 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.347 0.594 . . . . 0.0 110.502 -176.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -74.78 -20.26 59.87 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.05 -179.33 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -72.88 -45.45 58.2 Favored 'General case' 0 C--O 1.214 -0.796 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 174.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.2 m -58.05 -26.89 63.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 122.876 0.471 . . . . 0.0 111.282 177.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 59.3 mt -81.71 -56.39 4.03 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.319 175.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.9 t -62.37 -48.52 79.4 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.2 0.6 . . . . 0.0 112.408 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.539 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.0 t -59.03 -32.27 69.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.444 0.698 . . . . 0.0 110.117 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.471 ' O ' ' HG2' ' A' ' 64' ' ' GLN . 8.1 t30 -76.88 -41.32 44.31 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.89 0.852 . . . . 0.0 110.322 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.405 HE21 ' HB2' ' A' ' 28' ' ' GLN . 5.9 tp60 -65.13 -36.44 84.26 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.12 -179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.567 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -80.21 -33.24 38.29 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.161 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 4.0 pt20 -68.68 -23.11 64.35 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -174.706 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.93 -22.85 63.15 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.227 0.537 . . . . 0.0 110.053 176.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.8 t -74.66 158.16 5.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 177.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.413 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 1.3 mp0 -42.69 140.67 1.23 Allowed 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 125.03 1.332 . . . . 0.0 111.818 177.523 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -58.82 -32.97 69.87 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -173.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.587 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.5 pt20 -81.62 -11.8 58.97 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.587 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.3 m -112.5 -8.23 13.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.891 -172.579 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 99.1 mt-30 -60.64 -43.37 97.63 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.776 0.798 . . . . 0.0 109.819 177.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 2.9 p -77.71 -25.24 49.2 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.144 179.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 77' ' ' GLN . 4.1 mm-40 -73.62 -29.27 62.26 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.08 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.515 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.03 -32.92 70.17 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.497 176.224 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.567 HD11 HD22 ' A' ' 63' ' ' LEU . 22.5 mm -70.22 -32.15 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.926 -176.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.416 ' HE2' HD11 ' A' ' 116' ' ' ILE . 31.8 mmtp -70.16 -40.52 74.67 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 -175.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 7.2 mt-30 -64.04 -36.86 85.37 Favored 'General case' 0 CA--C 1.497 -1.071 0 CA-C-N 113.681 -1.599 . . . . 0.0 109.968 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 74' ' ' ALA . 43.7 t -56.73 -46.86 83.24 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.812 0 O-C-N 124.649 1.218 . . . . 0.0 108.569 178.133 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 41.2 t -64.29 -46.77 92.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.275 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 44.3 mt-10 -57.91 -50.33 73.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.942 -178.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -73.89 -28.3 61.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.94 0.4 . . . . 0.0 111.635 -178.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.48 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.67 -38.54 58.67 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 120.962 0.41 . . . . 0.0 111.135 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 80' ' ' GLU . 13.9 pt20 -71.11 -38.17 72.35 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -30.72 65.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.685 -176.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 3.3 pt20 -74.68 -31.19 61.83 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.24 0.543 . . . . 0.0 110.499 -178.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.583 HD12 ' HA3' ' A' ' 92' ' ' GLY . 2.7 mm? -86.4 -37.31 18.51 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.172 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.18 -35.78 76.14 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.395 -178.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -83.35 -3.24 57.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.26 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -91.51 -70.99 1.19 Allowed Glycine 0 N--CA 1.437 -1.266 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.631 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.42 -37.56 0.14 Allowed 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.483 0.658 . . . . 0.0 110.29 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.2 -93.86 0.11 Allowed Glycine 0 N--CA 1.419 -2.448 0 N-CA-C 107.101 -2.4 . . . . 0.0 107.101 -178.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.583 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 75.42 -31.35 1.18 Allowed Glycine 0 C--O 1.2 -1.999 0 CA-C-O 119.413 -0.66 . . . . 0.0 114.721 173.428 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -47.83 -35.38 10.12 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 124.681 1.192 . . . . 0.0 112.201 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -74.17 -42.16 60.35 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.467 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 19.4 pt20 -77.45 -44.71 28.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.48 0.657 . . . . 0.0 110.133 -178.398 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.471 HG13 ' HA ' ' A' ' 37' ' ' THR . 94.1 t -64.5 -22.85 32.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 C-N-CA 124.789 1.236 . . . . 0.0 110.355 177.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -45.83 -46.0 15.29 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.004 0.522 . . . . 0.0 112.407 -178.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -65.08 -18.22 65.11 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.914 0.388 . . . . 0.0 111.957 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.416 ' O ' HD22 ' A' ' 36' ' ' LEU . 7.6 tpt -101.65 -49.25 4.06 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.3 p -63.02 -23.95 34.67 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.824 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -23.07 66.93 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 121.827 -0.546 . . . . 0.0 110.565 175.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 99' ' ' MET . 22.7 mtpp -67.56 -26.43 66.29 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.301 176.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.95 -32.26 73.65 Favored 'General case' 0 C--O 1.211 -0.949 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.47 ' HB3' HG21 ' A' ' 116' ' ' ILE . 14.1 mm100 -69.69 -19.98 63.56 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 122.079 0.943 . . . . 0.0 109.243 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 52.9 mtp -92.15 -19.12 22.6 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.03 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.409 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 3.3 mp -54.1 -45.52 99.05 Favored Pre-proline 0 N--CA 1.47 0.543 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -176.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 17.7 Cg_endo -61.19 -22.23 74.02 Favored 'Trans proline' 0 C--N 1.366 1.471 0 CA-C-N 120.791 1.318 . . . . 0.0 112.552 176.12 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -86.84 -45.19 11.1 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -69.53 -43.39 73.1 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.303 -177.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.413 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 13.9 t -86.36 -0.82 56.75 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -176.638 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 56.88 59.5 3.46 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 122.957 1.361 . . . . 0.0 109.973 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.439 HD21 HD11 ' A' ' 63' ' ' LEU . 57.5 mt -96.87 157.42 15.91 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 113.638 -1.619 . . . . 0.0 110.344 -178.726 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -78.77 43.87 0.51 Allowed 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 124.825 1.25 . . . . 0.0 112.492 -173.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 54.2 m -156.96 157.1 34.14 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 -176.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.0 m -136.83 140.88 42.75 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.47 HG21 ' HB3' ' A' ' 104' ' ' GLN . 38.4 mm . . . . . 0 N--CA 1.434 -1.253 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 175.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.431 ' HA3' ' HA ' ' A' ' 14' ' ' ASP . . . . . . . . 0 CA--C 1.49 -1.527 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -81.46 165.7 21.01 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.425 0.155 . . . . 0.0 110.78 179.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.823 ' SG ' ' HB2' ' A' ' 9' ' ' PRO . 4.1 t -152.78 153.85 34.01 Favored 'General case' 0 N--CA 1.427 -1.602 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 177.154 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 74.9 p -77.37 149.57 35.2 Favored 'General case' 0 C--N 1.271 -2.816 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.94 71.12 5.57 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 119.372 -0.931 . . . . 0.0 109.655 178.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 t -143.65 168.37 20.06 Favored 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 74.3 mt -129.7 115.35 18.07 Favored Pre-proline 0 C--N 1.308 -1.222 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.71 146.38 86.56 Favored 'Cis proline' 0 C--O 1.246 0.887 0 C-N-CA 123.863 -1.307 . . . . 0.0 111.981 0.089 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.823 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 91.1 Cg_endo -77.22 152.66 31.12 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.371 2.047 . . . . 0.0 112.802 -178.109 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 mm -109.36 111.64 37.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.0 m -104.05 149.34 25.28 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.229 -173.38 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -106.15 151.76 40.23 Favored Pre-proline 0 C--N 1.293 -1.867 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.972 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -51.73 -53.89 6.26 Favored 'Trans proline' 0 C--N 1.364 1.388 0 C-N-CA 123.085 2.523 . . . . 0.0 110.146 178.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.431 ' HA ' ' HA3' ' A' ' 1' ' ' GLY . 26.5 t70 -140.92 -77.41 0.29 Allowed 'General case' 0 N--CA 1.419 -1.99 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 174.76 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -113.62 -124.96 4.19 Favored Glycine 0 CA--C 1.471 -2.691 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 177.344 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER -105.38 -50.99 3.1 Favored 'General case' 0 C--N 1.284 -2.245 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.291 -175.75 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.482 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 32.6 t70 -137.95 96.46 3.22 Favored 'General case' 0 C--N 1.278 -2.532 0 CA-C-N 115.061 -0.972 . . . . 0.0 108.973 -178.18 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -105.61 94.63 8.89 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 17' ' ' ASP . 6.6 Cg_exo -74.82 -32.12 5.95 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.053 1.835 . . . . 0.0 114.098 -176.32 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.435 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 1.0 OUTLIER -99.74 -54.98 2.77 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-O 121.896 0.855 . . . . 0.0 108.955 -176.655 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.29 46.7 0.91 Allowed Glycine 0 N--CA 1.43 -1.759 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -172.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 67.4 m -84.48 131.91 34.61 Favored 'General case' 0 N--CA 1.419 -1.977 0 CA-C-N 114.124 -1.038 . . . . 0.0 112.338 -177.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -106.95 101.83 11.23 Favored 'General case' 0 N--CA 1.42 -1.975 0 CA-C-O 122.176 0.989 . . . . 0.0 109.186 176.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -108.39 132.56 55.91 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.452 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.528 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.7 ptt-85 -67.58 114.19 6.02 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 121.832 0.825 . . . . 0.0 109.432 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.55 ' HB ' HE22 ' A' ' 81' ' ' GLN . 2.5 pp -68.0 -9.65 11.25 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 CA-C-N 115.254 -0.885 . . . . 0.0 113.203 -174.563 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -77.42 -20.52 54.46 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.519 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.3 pt20 -81.52 -20.98 38.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -89.27 -4.86 58.0 Favored 'General case' 0 CA--C 1.477 -1.84 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.623 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -55.92 -32.71 64.03 Favored 'General case' 0 C--O 1.218 -0.597 0 O-C-N 124.03 0.831 . . . . 0.0 110.808 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -66.28 -56.66 10.14 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.406 ' HB3' HG11 ' A' ' 78' ' ' VAL . 0.1 OUTLIER -54.22 -51.21 65.17 Favored 'General case' 0 C--O 1.218 -0.59 0 O-C-N 123.827 0.704 . . . . 0.0 109.715 178.98 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -50.68 -60.52 2.95 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 124.062 0.945 . . . . 0.0 112.422 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -67.84 -35.33 78.4 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.736 -173.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -73.99 -30.27 62.39 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.681 -177.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 99' ' ' MET . 95.9 mt -84.54 -24.64 29.21 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 179.007 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.463 ' HA ' HG13 ' A' ' 96' ' ' VAL . 71.3 p -84.76 -12.93 52.69 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.196 -1.402 . . . . 0.0 110.129 175.092 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.0 t -88.49 149.97 23.37 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.645 177.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.442 ' CZ ' ' HA ' ' A' ' 96' ' ' VAL . 50.7 m-85 -130.07 153.77 48.13 Favored 'General case' 0 N--CA 1.434 -1.264 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.513 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.42 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 6.9 t70 -108.82 174.9 5.66 Favored 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -101.32 -34.75 9.5 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -170.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.43 7.47 16.75 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 119.397 -0.921 . . . . 0.0 111.672 -175.29 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.42 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 39.6 mt -73.52 68.79 1.18 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.379 177.776 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 20.8 mmt180 -123.35 -5.43 8.28 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.81 0.814 . . . . 0.0 108.817 178.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -148.93 16.15 0.96 Allowed 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.623 -1.171 . . . . 0.0 109.237 -179.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -130.71 135.92 48.28 Favored 'General case' 0 N--CA 1.424 -1.767 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.609 -172.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 41.9 t -130.01 -68.17 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.361 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -129.74 96.13 4.16 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.413 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 16.0 m120 -120.39 144.48 38.32 Favored Pre-proline 0 C--N 1.293 -1.88 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -43.95 -50.82 7.07 Favored 'Trans proline' 0 C--N 1.355 0.921 0 C-N-CA 123.978 3.119 . . . . 0.0 114.849 -174.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -76.65 -7.22 54.85 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -175.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -96.26 -28.05 14.71 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 176.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 49' ' ' ASN . 50.3 mt-30 -84.31 11.87 7.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.946 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.512 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 11.3 pt20 -61.21 -32.33 72.1 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.404 178.022 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -64.51 -24.61 67.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.422 178.091 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -73.76 -45.05 54.22 Favored 'General case' 0 CA--C 1.491 -1.294 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.2 m -56.63 -36.38 69.41 Favored 'General case' 0 C--O 1.213 -0.837 0 O-C-N 123.907 0.754 . . . . 0.0 110.333 179.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 40.2 mt -79.3 -47.35 16.0 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.955 -178.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.6 t -69.28 -50.39 47.35 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.765 -175.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.423 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 7.5 t -52.36 -43.43 64.67 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 124.178 0.991 . . . . 0.0 110.048 175.257 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.451 ' HA ' ' CD ' ' A' ' 64' ' ' GLN . 8.1 t30 -72.06 -23.76 61.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.373 -176.275 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -83.83 -48.18 10.33 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.255 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.541 ' O ' ' HG2' ' A' ' 71' ' ' GLN . 3.7 pp -65.21 -34.0 77.34 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-O 121.214 0.531 . . . . 0.0 111.037 -177.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.451 ' CD ' ' HA ' ' A' ' 61' ' ' ASN . 13.4 pt20 -69.31 -15.57 63.37 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.178 0.591 . . . . 0.0 111.865 -176.143 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -84.58 -11.44 56.01 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.479 0.657 . . . . 0.0 110.301 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 11.6 t -82.74 163.45 3.03 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 174.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 46.0 mt-10 -47.47 144.06 3.25 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.408 0.683 . . . . 0.0 111.657 176.213 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -63.19 -28.93 70.39 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -175.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.52 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 13.9 pt20 -80.0 -14.86 58.25 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.507 0.67 . . . . 0.0 110.399 177.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.52 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.7 m -110.94 -7.09 14.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.156 -173.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 72.0 mt-30 -62.95 -40.33 97.36 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.092 0.472 . . . . 0.0 110.347 177.545 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 114' ' ' CYS . 32.1 p -77.34 -23.83 50.86 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.419 176.408 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 14.1 mm-40 -71.0 -32.03 68.73 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.328 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.08 -27.01 68.81 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.815 177.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.491 HD11 HD22 ' A' ' 63' ' ' LEU . 31.0 mm -69.55 -32.5 53.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.734 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -70.8 -41.64 71.37 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 106.465 -1.679 . . . . 0.0 106.465 -174.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.426 HE21 ' HA ' ' A' ' 77' ' ' GLN . 0.1 OUTLIER -56.99 -44.07 82.34 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 112.492 -2.14 . . . . 0.0 110.584 -179.025 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.406 HG11 ' HB3' ' A' ' 32' ' ' CYS . 15.8 t -59.41 -45.96 93.09 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.584 0 O-C-N 124.079 0.862 . . . . 0.0 109.59 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 75' ' ' ILE . 40.1 t -65.53 -46.25 90.27 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.89 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -175.343 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -54.64 -51.85 64.12 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.196 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.55 HE22 ' HB ' ' A' ' 26' ' ' ILE . 3.6 pt20 -76.43 -34.46 58.77 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -175.544 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.54 -33.89 67.15 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.834 0.349 . . . . 0.0 111.098 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -76.37 -35.69 58.55 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.892 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.484 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -71.1 -35.87 71.97 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.088 -176.984 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.414 ' HG3' HD22 ' A' ' 86' ' ' LEU . 2.4 pt20 -68.63 -30.04 68.67 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 121.221 0.534 . . . . 0.0 110.7 -176.371 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.61 HD12 ' HA3' ' A' ' 92' ' ' GLY . 4.1 mm? -86.28 -37.48 18.51 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.982 175.188 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -60.91 -34.81 75.24 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.983 0.913 . . . . 0.0 111.868 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -75.62 -4.83 42.32 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.507 0.67 . . . . 0.0 111.738 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -105.24 -132.52 7.38 Favored Glycine 0 N--CA 1.428 -1.837 0 N-CA-C 110.984 -0.847 . . . . 0.0 110.984 178.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -88.62 -23.78 22.98 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 120.781 0.325 . . . . 0.0 111.686 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 157.98 -94.44 0.14 Allowed Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.61 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 73.05 -36.91 0.76 Allowed Glycine 0 C--O 1.202 -1.847 0 N-CA-C 115.421 0.929 . . . . 0.0 115.421 176.263 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -49.32 -29.23 5.74 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 124.118 0.967 . . . . 0.0 113.462 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -77.03 -40.1 47.71 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 122.227 0.211 . . . . 0.0 111.204 178.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.403 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 4.1 pt20 -79.63 -45.88 18.25 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.55 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.518 HG21 ' HG ' ' A' ' 86' ' ' LEU . 84.4 t -62.22 -23.03 30.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 C-N-CA 125.29 1.436 . . . . 0.0 111.07 177.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -42.58 -52.34 4.82 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.427 1.091 . . . . 0.0 112.732 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 20.6 pt20 -60.12 -18.21 45.65 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.752 0.821 . . . . 0.0 112.778 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 5.6 tpt -106.01 -47.09 3.93 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -177.616 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.1 p -64.78 -23.78 34.15 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-O 120.899 0.381 . . . . 0.0 111.527 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.516 ' O ' ' HG3' ' A' ' 105' ' ' MET . 0.0 OUTLIER -61.69 -25.31 67.33 Favored 'General case' 0 C--O 1.218 -0.599 0 O-C-N 121.791 -0.568 . . . . 0.0 110.966 173.567 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -65.47 -27.93 68.85 Favored 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 122.499 0.32 . . . . 0.0 110.207 177.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.462 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -63.36 -36.18 82.87 Favored 'General case' 0 C--O 1.202 -1.401 0 CA-C-O 121.948 0.88 . . . . 0.0 109.001 175.634 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -76.82 -16.06 59.55 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.3 -178.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' MET . . . . . 0.516 ' HG3' ' O ' ' A' ' 101' ' ' LYS . 68.4 mtp -91.57 -14.7 29.83 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.057 178.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.462 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 96.9 mt -51.46 -50.09 78.61 Favored Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 123.559 0.537 . . . . 0.0 112.351 -178.494 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' PRO . . . . . 0.489 ' HD3' HG21 ' A' ' 75' ' ' ILE . 19.5 Cg_endo -61.38 -26.3 81.28 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.817 1.678 . . . . 0.0 112.663 177.102 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -83.1 -28.3 29.58 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-O 121.358 0.599 . . . . 0.0 109.616 -177.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -84.33 -47.85 10.31 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.452 0.644 . . . . 0.0 111.022 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 88.4 m -82.63 0.58 42.44 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -175.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 60.2 t30 56.87 61.68 2.53 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 122.175 0.988 . . . . 0.0 109.963 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 74.9 mt -95.09 158.52 15.43 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.735 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -72.55 17.65 0.11 Allowed 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.93 0.892 . . . . 0.0 113.318 -172.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 72' ' ' CYS . 83.1 m -148.31 158.01 43.83 Favored 'General case' 0 C--N 1.268 -2.949 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 -169.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 31.9 p -134.69 146.88 49.9 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.403 HG12 ' HG3' ' A' ' 107' ' ' PRO . 33.6 mm . . . . . 0 C--N 1.303 -1.431 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 177.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 66.7 m . . . . . 0 N--CA 1.427 -1.603 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 51.8 p -83.38 154.71 23.88 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.85 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -85.86 69.58 10.58 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.5 m -158.6 168.23 27.45 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 81.5 mt -128.22 123.16 22.38 Favored Pre-proline 0 C--N 1.309 -1.192 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -71.53 142.76 74.42 Favored 'Cis proline' 0 C--O 1.244 0.809 0 C-N-CA 123.642 -1.399 . . . . 0.0 112.61 0.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.88 142.49 39.15 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 122.353 2.035 . . . . 0.0 110.857 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.496 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 44.8 mm -101.68 107.72 22.13 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.262 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.5 m . . . . . 0 C--N 1.301 -1.521 0 CA-C-O 121.899 0.856 . . . . 0.0 111.618 -178.479 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.431 -1.39 0 CA-C-O 120.952 0.406 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -101.73 112.46 25.06 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 122.092 0.948 . . . . 0.0 109.994 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.406 HG21 ' CB ' ' A' ' 74' ' ' ALA . 3.0 mp -120.08 131.22 73.02 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.284 0 N-CA-C 105.637 -1.986 . . . . 0.0 105.637 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.471 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 24.4 ptt-85 -73.03 123.52 23.69 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 121.099 0.476 . . . . 0.0 109.744 -176.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.75 -16.65 21.38 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -174.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.437 ' CD ' ' HB2' ' A' ' 25' ' ' ARG . 17.8 pm0 -75.77 -18.31 59.57 Favored 'General case' 0 N--CA 1.421 -1.915 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.973 -178.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 6.3 pt20 -83.83 -19.53 34.8 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.408 HD22 ' HG2' ' A' ' 28' ' ' GLN . 2.4 mm? -91.75 3.26 55.52 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.624 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -59.11 -34.47 72.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 123.762 0.664 . . . . 0.0 109.317 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -69.73 -50.35 44.35 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.057 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.813 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.5 OUTLIER -58.11 -48.73 79.31 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 120.772 0.32 . . . . 0.0 110.338 178.408 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.453 HE21 ' HG3' ' A' ' 81' ' ' GLN . 19.0 tt0 -52.52 -52.15 56.05 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 123.44 0.696 . . . . 0.0 111.651 176.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.4 ptm -70.64 -38.41 73.86 Favored 'General case' 0 C--O 1.205 -1.288 0 C-N-CA 120.676 -0.41 . . . . 0.0 111.062 -177.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.813 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 1.4 p80 -70.83 -23.36 62.34 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.371 -0.532 . . . . 0.0 111.926 -176.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.449 HD22 ' O ' ' A' ' 99' ' ' MET . 91.5 mt -88.86 -39.08 14.09 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.218 174.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.529 ' HA ' HG13 ' A' ' 96' ' ' VAL . 41.1 p -83.61 -22.79 32.13 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 118.21 -1.396 . . . . 0.0 112.31 -175.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 t -92.5 121.74 34.25 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.903 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 . . . . . 0 C--N 1.296 -1.719 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 169.619 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.446 -0.647 0 CA-C-O 121.365 0.602 . . . . 0.0 111.344 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -83.13 -41.6 18.34 Favored 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.8 m -56.67 -31.52 64.51 Favored 'General case' 0 C--O 1.212 -0.882 0 O-C-N 123.708 0.63 . . . . 0.0 110.121 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 65.8 mt -82.99 -48.06 11.06 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.232 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.2 t -65.94 -50.07 65.72 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -178.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.536 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.7 t -59.31 -30.8 68.61 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.101 0.56 . . . . 0.0 110.29 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.486 ' HA ' ' NE2' ' A' ' 64' ' ' GLN . 27.5 t-20 -78.7 -25.04 44.69 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.43 0.633 . . . . 0.0 111.471 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -84.9 -42.9 14.58 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.198 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.569 HD22 HD11 ' A' ' 75' ' ' ILE . 3.7 pp -68.49 -31.99 71.65 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.647 -177.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.486 ' NE2' ' HA ' ' A' ' 61' ' ' ASN . 9.3 pt20 -71.2 -10.36 59.63 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -177.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -86.11 -12.43 50.04 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 121.816 0.817 . . . . 0.0 109.424 176.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 15.6 t -83.46 163.28 2.97 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.24 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 174.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.439 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 1.6 mp0 -48.2 142.23 5.58 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 124.187 0.995 . . . . 0.0 111.738 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -53.65 -35.58 61.15 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 124.767 1.227 . . . . 0.0 112.915 -174.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -87.49 -20.81 26.02 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.221 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 59.5 m -95.17 -8.84 35.16 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.681 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.554 ' HB3' HD22 ' A' ' 112' ' ' LEU . 23.0 mt-30 -57.33 -43.12 83.1 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.87 176.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 6.5 p -80.87 -24.21 38.49 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.163 0.506 . . . . 0.0 111.177 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -67.92 -33.18 74.19 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.483 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.441 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.72 -31.29 68.15 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.459 177.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.569 HD11 HD22 ' A' ' 63' ' ' LEU . 21.1 mm -73.18 -27.57 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.238 0 CA-C-N 115.095 -0.957 . . . . 0.0 109.94 -177.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -74.54 -39.81 62.11 Favored 'General case' 0 CA--C 1.484 -1.589 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 -175.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -56.22 -40.42 74.04 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 112.626 -2.079 . . . . 0.0 109.215 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 74' ' ' ALA . 25.9 t -60.64 -47.9 90.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.929 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 42.3 t -61.6 -48.71 87.51 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.198 -174.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -61.75 -41.53 97.79 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.655 -175.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.453 ' HG3' HE21 ' A' ' 33' ' ' GLN . 11.3 pt20 -79.97 -28.82 39.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.634 0.254 . . . . 0.0 111.163 -179.009 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.98 -41.12 60.15 Favored 'General case' 0 C--N 1.311 -1.077 0 O-C-N 122.19 -0.319 . . . . 0.0 111.314 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -69.48 -35.63 75.78 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.126 -178.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.434 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -72.01 -36.23 69.66 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.178 -178.388 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.434 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 5.8 pt20 -72.8 -34.51 66.94 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.355 -174.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.472 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 2.4 mm? -76.79 -36.62 56.85 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.62 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -66.39 -40.35 89.62 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.623 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -75.12 -17.46 60.42 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.367 0.604 . . . . 0.0 110.157 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -83.08 -65.52 1.59 Allowed Glycine 0 N--CA 1.421 -2.357 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -158.43 -26.2 0.08 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -175.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.472 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 146.38 -114.97 0.77 Allowed Glycine 0 CA--C 1.492 -1.397 0 N-CA-C 108.476 -1.85 . . . . 0.0 108.476 -174.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.23 -32.17 2.3 Favored Glycine 0 C--O 1.196 -2.252 0 CA-C-O 118.909 -0.94 . . . . 0.0 114.488 172.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -48.1 -32.66 7.11 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.921 0.888 . . . . 0.0 113.396 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -72.87 -38.12 67.11 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.964 0.412 . . . . 0.0 111.429 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.46 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 20.0 pt20 -85.43 -44.19 12.96 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 121.475 0.655 . . . . 0.0 109.662 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.529 HG13 ' HA ' ' A' ' 37' ' ' THR . 92.0 t -61.19 -22.53 27.55 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 C-N-CA 125.412 1.485 . . . . 0.0 110.933 176.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.41 ' HA ' HG12 ' A' ' 100' ' ' VAL . 53.3 tt0 -46.44 -46.23 18.63 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 20.1 pt20 -63.55 -18.5 63.92 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -178.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.449 ' O ' HD22 ' A' ' 36' ' ' LEU . 4.7 tpt -100.43 -46.83 5.11 Favored 'General case' 0 N--CA 1.438 -1.072 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -177.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' A' ' 97' ' ' GLN . 7.9 p -62.08 -26.17 39.38 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-O 120.834 0.35 . . . . 0.0 111.771 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -23.42 67.34 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.805 -0.559 . . . . 0.0 111.345 177.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -65.93 -25.59 67.21 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.024 178.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.22 -28.82 69.04 Favored 'General case' 0 C--O 1.203 -1.385 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.332 176.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.17 -24.52 62.26 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.265 1.031 . . . . 0.0 109.083 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 49.0 mtm -92.37 -13.02 30.78 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.528 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.46 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.1 OUTLIER -54.0 -46.75 98.52 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.226 0.61 . . . . 0.0 111.06 -177.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.597 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 20.3 Cg_endo -60.72 -26.89 83.88 Favored 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 121.382 1.388 . . . . 0.0 112.666 175.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -77.97 -46.98 19.62 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -64.64 -47.96 76.61 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.305 -0.862 . . . . 0.0 112.44 -177.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.4 ' SG ' HD11 ' A' ' 63' ' ' LEU . 10.2 t -84.08 -3.32 57.99 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.2 0.524 . . . . 0.0 109.701 -175.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.2 t30 58.17 64.23 1.55 Allowed 'General case' 0 C--O 1.247 0.944 0 CA-C-O 123.072 1.415 . . . . 0.0 110.717 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 71' ' ' GLN . 31.6 mt -101.63 158.52 16.03 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 112.992 -1.913 . . . . 0.0 109.015 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -72.92 44.68 0.14 Allowed 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 124.368 1.067 . . . . 0.0 112.988 -176.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.597 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 67.0 m -160.47 152.14 19.75 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -175.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.8 m -151.33 114.92 4.87 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 6.3 pt . . . . . 0 N--CA 1.428 -1.547 0 CA-C-O 118.459 -0.781 . . . . 0.0 112.546 -177.448 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 72.6 m . . . . . 0 N--CA 1.434 -1.256 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.4 p -75.65 142.43 42.58 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 176.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.66 68.88 10.55 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.825 0.821 . . . . 0.0 109.976 178.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.1 t -150.5 170.96 17.86 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 105.936 -1.875 . . . . 0.0 105.936 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.3 mp -127.39 125.35 23.91 Favored Pre-proline 0 C--N 1.298 -1.635 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.29 143.26 76.7 Favored 'Cis proline' 0 C--O 1.243 0.76 0 C-N-CA 123.722 -1.366 . . . . 0.0 111.985 -1.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.77 129.76 21.72 Favored 'Trans proline' 0 C--O 1.254 1.282 0 C-N-CA 122.122 1.882 . . . . 0.0 111.43 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.416 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 37.6 mm -92.41 111.69 24.75 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 75.9 m . . . . . 0 C--N 1.29 -2.003 0 CA-C-O 121.449 0.642 . . . . 0.0 111.305 -175.325 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 60.0 m . . . . . 0 N--CA 1.409 -2.494 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -107.6 117.07 33.12 Favored 'General case' 0 N--CA 1.416 -2.137 0 CA-C-O 121.871 0.843 . . . . 0.0 108.948 172.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.408 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.3 mp -111.69 143.34 21.69 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.64 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 -177.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.524 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.2 ptt180 -69.72 116.27 9.92 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 118.399 0.545 . . . . 0.0 110.382 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 pp -63.66 -14.8 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.395 0.617 . . . . 0.0 112.393 -175.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -73.43 -22.9 60.09 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.698 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.524 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.0 pt20 -83.73 -18.5 37.67 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.431 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.4 mm? -94.87 -0.7 53.8 Favored 'General case' 0 CA--C 1.48 -1.715 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.441 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -59.14 -30.97 68.53 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 123.751 0.657 . . . . 0.0 111.273 -178.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.404 ' O ' ' HG2' ' A' ' 34' ' ' MET . 3.4 t-160 -71.08 -52.56 18.68 Favored 'General case' 0 C--O 1.216 -0.662 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.825 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 1.6 t -56.47 -46.79 80.22 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 124.173 0.989 . . . . 0.0 109.032 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -53.11 -56.02 19.48 Favored 'General case' 0 N--CA 1.425 -1.692 0 C-N-CA 124.926 1.291 . . . . 0.0 111.349 174.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 31' ' ' HIS . 24.7 ptm -70.29 -33.66 71.82 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.397 -173.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.825 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -69.89 -23.42 63.25 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.631 -178.72 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.9 mt -88.54 -36.14 16.54 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.862 175.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.414 ' HB ' HD21 ' A' ' 86' ' ' LEU . 72.4 p -80.15 -19.78 46.41 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 119.161 -1.016 . . . . 0.0 112.809 -176.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 66.4 p -89.57 135.43 33.61 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -178.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 . . . . . 0 C--N 1.305 -1.344 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 172.489 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.413 ' HB2' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER . . . . . 0 N--CA 1.443 -0.81 0 CA-C-O 121.736 0.779 . . . . 0.0 110.252 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.92 -38.73 61.74 Favored 'General case' 0 CA--C 1.495 -1.166 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.082 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 m -56.97 -35.59 69.33 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 42.4 mt -73.41 -51.67 16.45 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.247 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.6 t -60.78 -50.5 73.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 122.776 0.43 . . . . 0.0 111.277 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.542 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.4 t -59.44 -33.63 71.51 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 124.168 0.987 . . . . 0.0 110.161 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.43 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 16.9 t-20 -79.22 -23.21 43.93 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.517 0.675 . . . . 0.0 110.411 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -82.26 -48.26 11.44 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.857 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.593 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -67.41 -33.36 75.02 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.431 -177.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -69.59 -12.77 61.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.982 -176.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 68.6 mm-40 -89.39 -11.01 44.43 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.464 0.649 . . . . 0.0 109.569 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -80.84 164.45 3.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 174.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -45.6 136.5 5.81 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.828 0.451 . . . . 0.0 110.9 173.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.452 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 17.2 ptpt -57.9 -33.99 69.33 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -174.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.429 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 24.5 pt20 -76.11 -20.46 57.62 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.835 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.429 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 58.8 m -102.29 -9.38 20.44 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.776 -174.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.452 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 29.6 mt-30 -59.45 -42.62 92.38 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 121.17 0.509 . . . . 0.0 110.773 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.2 p -78.82 -24.22 44.62 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.279 0.562 . . . . 0.0 111.406 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -71.43 -32.54 68.49 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.442 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.477 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.84 -29.85 69.75 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.766 176.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.593 HD11 HD22 ' A' ' 63' ' ' LEU . 28.2 mm -68.9 -35.64 70.27 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.654 -178.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -63.48 -44.62 93.88 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -176.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 4.6 mt-30 -61.65 -41.92 98.18 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 113.322 -1.763 . . . . 0.0 110.32 -177.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 74' ' ' ALA . 38.2 t -53.31 -47.56 57.23 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.082 0 O-C-N 124.413 1.07 . . . . 0.0 109.359 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 75' ' ' ILE . 41.4 t -67.76 -45.83 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.091 0 CA-C-N 115.476 -0.783 . . . . 0.0 108.939 -174.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -56.94 -51.61 68.48 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.208 -178.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.465 ' HA ' ' HG3' ' A' ' 84' ' ' LYS . 20.3 pt20 -72.61 -31.74 65.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.648 -177.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.18 -38.46 66.15 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.871 0.367 . . . . 0.0 111.37 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -75.72 -34.75 60.37 Favored 'General case' 0 C--N 1.312 -1.043 0 C-N-CA 120.014 -0.674 . . . . 0.0 110.144 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.465 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -72.82 -31.7 65.0 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.14 -178.415 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -71.32 -33.33 69.57 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.579 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.591 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 4.1 mm? -78.66 -37.04 42.87 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.009 175.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -58.03 -41.73 83.85 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.924 0.89 . . . . 0.0 110.732 179.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -79.28 -14.41 59.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.777 -176.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -96.75 -105.88 2.3 Favored Glycine 0 N--CA 1.425 -2.04 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.988 -176.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -102.92 -17.35 15.53 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.145 0.498 . . . . 0.0 111.649 -175.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.591 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 128.08 -93.12 0.36 Allowed Glycine 0 N--CA 1.428 -1.889 0 N-CA-C 108.601 -1.8 . . . . 0.0 108.601 -173.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.576 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 72.25 -37.37 0.67 Allowed Glycine 0 C--O 1.193 -2.46 0 N-CA-C 115.77 1.068 . . . . 0.0 115.77 172.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -49.63 -27.7 4.93 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 118.538 1.169 . . . . 0.0 113.111 -178.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.439 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 4.5 pt20 -67.3 -45.0 77.84 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 120.67 0.271 . . . . 0.0 110.477 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 19.2 pt20 -86.51 -42.64 13.37 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 121.521 0.677 . . . . 0.0 111.075 -175.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.449 HG21 ' HG ' ' A' ' 86' ' ' LEU . 91.0 t -64.57 -22.95 32.33 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.191 0 C-N-CA 125.108 1.363 . . . . 0.0 111.766 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -48.1 -45.09 32.37 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 28.8 pt20 -61.3 -21.79 64.29 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 122.961 0.504 . . . . 0.0 112.322 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 3.3 tpt -100.42 -44.89 5.75 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -175.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.95 -24.13 34.88 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.516 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -23.66 67.38 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.755 -0.59 . . . . 0.0 110.578 176.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -63.26 -29.25 70.61 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -63.71 -29.88 71.05 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 121.191 0.52 . . . . 0.0 110.266 177.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -73.14 -17.23 61.41 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.792 0.806 . . . . 0.0 109.511 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 50.7 mtp -92.14 -20.61 21.06 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.331 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 5.0 mp -52.15 -45.51 93.84 Favored Pre-proline 0 N--CA 1.468 0.43 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.425 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 14.1 Cg_endo -59.79 -22.5 68.3 Favored 'Trans proline' 0 C--N 1.369 1.624 0 C-N-CA 121.141 1.227 . . . . 0.0 112.862 176.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -89.45 -45.82 9.16 Favored 'General case' 0 N--CA 1.411 -2.39 0 CA-C-O 121.126 0.488 . . . . 0.0 109.971 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -68.31 -38.95 82.09 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.868 -176.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.456 ' SG ' HD21 ' A' ' 112' ' ' LEU . 16.7 t -87.3 -6.46 58.51 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -179.01 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.1 t30 57.74 64.4 1.57 Allowed 'General case' 0 CA--C 1.508 -0.638 0 C-N-CA 124.91 1.284 . . . . 0.0 110.082 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.456 HD21 ' SG ' ' A' ' 110' ' ' CYS . 47.5 mt -96.04 159.46 14.95 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 113.372 -1.74 . . . . 0.0 109.935 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -71.7 37.53 0.06 Allowed 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 123.612 0.765 . . . . 0.0 112.709 -177.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 74.4 m -157.15 154.58 29.55 Favored 'General case' 0 C--N 1.28 -2.416 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -175.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 12.0 p -149.74 134.14 17.42 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 43.0 mm . . . . . 0 C--N 1.307 -1.241 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -178.872 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 63.7 m . . . . . 0 N--CA 1.431 -1.414 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 77.5 p -86.96 157.74 19.41 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.865 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -91.98 76.81 5.46 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.305 0.574 . . . . 0.0 109.594 176.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.9 t -152.01 172.0 16.96 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.6 mp -128.33 117.77 20.22 Favored Pre-proline 0 N--CA 1.435 -1.206 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.34 147.74 90.18 Favored 'Cis proline' 0 C--O 1.246 0.908 0 C-N-CA 123.596 -1.418 . . . . 0.0 111.801 -0.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -69.92 139.57 39.98 Favored 'Trans proline' 0 C--O 1.247 0.952 0 C-N-CA 122.164 1.909 . . . . 0.0 111.094 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.53 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 44.3 mm -97.44 111.44 27.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.955 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 73.6 m . . . . . 0 C--N 1.288 -2.082 0 CA-C-O 121.491 0.662 . . . . 0.0 110.235 -179.548 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 67.8 m . . . . . 0 N--CA 1.418 -2.05 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -107.11 108.54 20.05 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-O 121.869 0.843 . . . . 0.0 108.893 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.446 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.0 mp -102.49 141.3 18.84 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.691 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -175.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.5 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 20.6 ptt180 -67.11 114.14 5.63 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 121.672 0.749 . . . . 0.0 111.12 -177.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.23 -15.65 12.95 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -73.75 -23.19 59.7 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.835 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.5 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.3 pt20 -83.37 -33.31 25.83 Favored 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.721 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.472 HD11 ' HB1' ' A' ' 74' ' ' ALA . 2.0 mm? -82.15 -8.64 59.66 Favored 'General case' 0 CA--C 1.474 -1.971 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.021 -177.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -58.09 -30.27 66.11 Favored 'General case' 0 C--N 1.314 -0.937 0 O-C-N 124.17 0.919 . . . . 0.0 110.855 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -70.18 -54.66 11.9 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -54.08 -50.52 66.6 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.396 1.079 . . . . 0.0 108.524 -178.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -53.86 -61.15 2.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 125.504 1.522 . . . . 0.0 112.581 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -67.17 -34.87 78.46 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.831 0.348 . . . . 0.0 111.825 -172.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.433 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 8.9 t-80 -67.51 -33.13 74.46 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.804 -177.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 91.4 mt -84.64 -34.68 23.03 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.539 ' HB ' HD21 ' A' ' 86' ' ' LEU . 41.8 p -79.71 -21.01 45.14 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 118.83 -1.148 . . . . 0.0 113.165 -176.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 57.2 p -88.68 154.73 20.07 Favored 'General case' 0 N--CA 1.424 -1.727 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.829 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 . . . . . 0 C--N 1.297 -1.713 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 173.91 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.433 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER . . . . . 0 C--O 1.21 -0.998 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.3 tp -74.97 -52.27 11.57 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 175.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.7 m -55.31 -27.66 48.41 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.929 -178.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 50.1 mt -88.34 -51.37 5.78 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.958 178.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.44 -50.19 60.35 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.94 0.496 . . . . 0.0 112.129 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.542 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 10.1 t -59.37 -41.43 89.29 Favored 'General case' 0 CA--C 1.492 -1.274 0 C-N-CA 123.412 0.685 . . . . 0.0 109.664 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -72.08 -26.67 62.25 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.944 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.465 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 0.1 OUTLIER -78.27 -48.92 14.67 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.474 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.644 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -67.61 -31.64 71.82 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.651 -177.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.404 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 11.7 pt20 -74.23 -6.96 50.92 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.693 -178.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.7 -24.12 56.2 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 174.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.9 t -81.19 161.84 3.68 Favored 'Isoleucine or valine' 0 C--O 1.248 1.025 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.302 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.452 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 47.7 mt-10 -50.2 141.48 11.3 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.984 0.914 . . . . 0.0 112.263 176.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -62.57 -24.79 67.73 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -174.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.465 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 12.4 pt20 -82.55 -15.36 52.59 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.458 0.647 . . . . 0.0 110.533 178.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.465 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 64.2 m -107.81 -9.34 15.78 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.167 -174.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 76.9 mt-30 -59.33 -40.83 87.57 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.42 ' HA ' HG12 ' A' ' 75' ' ' ILE . 14.5 p -81.2 -24.54 37.4 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.488 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.415 ' O ' ' HG3' ' A' ' 77' ' ' GLN . 7.7 mm-40 -67.74 -32.97 73.95 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.145 179.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.513 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -61.57 -34.89 76.37 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.361 177.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.644 HD11 HD22 ' A' ' 63' ' ' LEU . 30.8 mm -65.12 -37.18 79.57 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.787 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.274 -178.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -66.0 -43.18 88.45 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 -175.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.491 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.4 mt-30 -62.7 -41.22 99.01 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 113.47 -1.696 . . . . 0.0 109.402 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 74' ' ' ALA . 27.8 t -55.17 -46.82 77.87 Favored 'Isoleucine or valine' 0 C--N 1.356 0.859 0 O-C-N 123.769 0.668 . . . . 0.0 109.845 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 75' ' ' ILE . 21.2 t -70.07 -46.7 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.101 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -173.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -64.85 -35.25 80.53 Favored 'General case' 0 N--CA 1.424 -1.734 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.183 -174.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 3.8 pt20 -85.61 -26.35 26.13 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.979 0.419 . . . . 0.0 111.607 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.476 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -72.27 -44.94 62.07 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.105 0.478 . . . . 0.0 110.22 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -69.21 -29.55 67.54 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.413 ' HB3' ' HA ' ' A' ' 81' ' ' GLN . 7.4 tttt -65.04 -46.26 81.98 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 124.477 1.111 . . . . 0.0 111.332 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 2.7 pt20 -69.07 -23.29 64.01 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-O 121.339 0.59 . . . . 0.0 110.791 -175.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.539 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.4 mm? -86.13 -36.0 19.83 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.918 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -65.13 -37.4 87.32 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 123.327 0.651 . . . . 0.0 110.981 177.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.416 HE21 ' HA ' ' A' ' 85' ' ' GLN . 29.8 pt20 -82.02 0.47 40.13 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.677 0.751 . . . . 0.0 111.069 -178.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -96.68 -120.15 3.83 Favored Glycine 0 N--CA 1.424 -2.119 0 N-CA-C 108.986 -1.646 . . . . 0.0 108.986 175.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -116.45 -56.56 2.28 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-O 121.114 0.483 . . . . 0.0 109.961 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -155.62 -141.07 3.13 Favored Glycine 0 CA--C 1.493 -1.29 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 -178.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.441 ' HA2' HE21 ' A' ' 95' ' ' GLN . . . 95.09 -30.3 8.27 Favored Glycine 0 C--O 1.202 -1.886 0 CA-C-O 119.128 -0.818 . . . . 0.0 113.227 177.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -49.44 -34.62 17.06 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 123.513 0.725 . . . . 0.0 112.812 -175.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -78.8 -33.24 46.38 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.441 HE21 ' HA2' ' A' ' 92' ' ' GLY . 29.9 pt20 -85.45 -39.24 17.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.854 0.835 . . . . 0.0 110.092 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.514 HG13 ' HA ' ' A' ' 37' ' ' THR . 84.5 t -63.72 -22.67 31.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.328 -1.305 . . . . 0.0 110.501 174.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -46.15 -47.34 17.55 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 123.429 0.455 . . . . 0.0 112.128 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -59.46 -21.55 60.24 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.159 0.504 . . . . 0.0 112.028 -178.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.9 tpt -104.07 -45.22 4.79 Favored 'General case' 0 N--CA 1.423 -1.79 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.747 -173.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.26 -24.01 31.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 CA-C-O 121.077 0.465 . . . . 0.0 110.765 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -22.66 66.48 Favored 'General case' 0 C--N 1.333 -0.118 0 O-C-N 121.91 -0.494 . . . . 0.0 111.017 176.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -66.2 -28.24 68.61 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.37 177.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.536 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -62.85 -35.34 79.65 Favored 'General case' 0 C--O 1.201 -1.476 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 176.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -68.01 -18.87 64.84 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.565 0.698 . . . . 0.0 110.026 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 36.1 mtp -92.67 -13.97 28.73 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.317 -178.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 1.7 mm? -51.15 -44.97 88.82 Favored Pre-proline 0 N--CA 1.476 0.839 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.616 ' HD3' HG21 ' A' ' 75' ' ' ILE . 18.5 Cg_endo -60.67 -31.04 91.61 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 121.387 1.391 . . . . 0.0 112.417 176.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -77.26 -36.02 54.76 Favored 'General case' 0 N--CA 1.427 -1.608 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -178.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -75.11 -49.57 19.19 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.454 0.645 . . . . 0.0 111.254 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 38.8 t -82.19 -2.24 51.65 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.456 -173.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 66.46 42.93 2.74 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 122.765 1.269 . . . . 0.0 110.19 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 68.4 mt -82.4 157.67 23.61 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.057 -178.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -74.74 31.44 0.09 Allowed 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.587 1.155 . . . . 0.0 112.895 -175.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 99.3 m -154.5 160.04 41.32 Favored 'General case' 0 C--N 1.28 -2.419 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -173.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 27.1 p -146.4 144.57 29.82 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 70.8 mt . . . . . 0 C--N 1.301 -1.528 0 CA-C-O 118.243 -0.884 . . . . 0.0 109.076 -178.159 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 50.5 m . . . . . 0 N--CA 1.444 -0.743 0 CA-C-O 120.828 0.347 . . . . 0.0 111.631 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.4 p -79.01 161.33 26.69 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.438 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -85.37 69.71 10.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.438 0.637 . . . . 0.0 109.765 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.8 t -143.01 169.66 17.15 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 34.7 mm -129.15 112.61 18.39 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 178.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 7' ' ' ILE . 3.9 Cg_exo -76.92 146.48 84.0 Favored 'Cis proline' 0 C--O 1.246 0.891 0 C-N-CA 123.969 -1.263 . . . . 0.0 109.919 -2.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.44 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 43.4 Cg_endo -64.46 142.51 78.69 Favored 'Trans proline' 0 C--N 1.328 -0.549 0 C-N-CA 122.56 2.173 . . . . 0.0 112.065 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.431 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 42.0 mm -92.35 116.15 32.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.6 m . . . . . 0 C--N 1.285 -2.198 0 CA-C-O 121.609 0.718 . . . . 0.0 110.736 -177.667 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 68.1 m . . . . . 0 N--CA 1.421 -1.903 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -100.61 112.83 25.27 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-O 121.714 0.769 . . . . 0.0 109.216 175.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.4 HG21 ' HB2' ' A' ' 74' ' ' ALA . 3.9 mp -114.33 139.03 42.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.969 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 -175.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.462 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 21.4 ptt-85 -67.12 121.77 16.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.487 0.66 . . . . 0.0 111.616 -175.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.38 -18.91 19.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 115.536 -0.757 . . . . 0.0 112.717 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -74.0 -17.23 61.02 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.192 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.518 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 1.2 pt20 -91.85 -19.05 22.93 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.157 -177.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.411 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.3 mm? -96.45 2.33 52.45 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.306 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.538 ' O ' ' HG2' ' A' ' 34' ' ' MET . 43.5 t30 -52.05 -39.72 60.06 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 124.754 1.283 . . . . 0.0 111.488 -178.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -70.61 -52.77 19.2 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -175.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.511 ' HB3' HG11 ' A' ' 78' ' ' VAL . 1.2 m -55.26 -50.2 70.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 123.866 0.729 . . . . 0.0 110.32 178.103 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -54.01 -59.84 4.12 Favored 'General case' 0 N--CA 1.433 -1.286 0 C-N-CA 123.707 0.803 . . . . 0.0 112.319 176.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.538 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.4 ptm -65.39 -41.05 94.12 Favored 'General case' 0 C--O 1.204 -1.322 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -66.8 -26.23 66.84 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 120.904 0.383 . . . . 0.0 110.302 -176.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 91.7 mt -88.32 -26.5 22.22 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.416 ' HA ' HG13 ' A' ' 96' ' ' VAL . 69.8 p -88.51 -19.25 26.66 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.587 -1.245 . . . . 0.0 111.578 176.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 74.3 p -90.01 139.4 30.64 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 . . . . . 0 C--N 1.293 -1.865 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 172.411 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.438 -1.065 0 CA-C-O 120.455 0.169 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -75.08 -43.69 51.69 Favored 'General case' 0 C--O 1.209 -1.071 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.6 m -57.87 -30.64 65.98 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.31 0.576 . . . . 0.0 110.79 178.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.5 mt -84.77 -56.16 3.73 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.506 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.3 t -62.1 -48.98 77.77 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.637 1.175 . . . . 0.0 111.397 -176.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.496 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 43.5 t -59.27 -36.53 75.7 Favored 'General case' 0 C--O 1.215 -0.755 0 C-N-CA 122.397 0.279 . . . . 0.0 110.456 178.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.532 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 8.6 t30 -71.71 -36.56 70.57 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-O 121.217 0.532 . . . . 0.0 110.466 -178.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.518 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 8.2 tp-100 -71.72 -44.24 64.49 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.914 -179.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.496 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.3 pp -72.8 -30.7 64.28 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 121.178 0.513 . . . . 0.0 110.961 -177.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.531 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 11.9 pt20 -72.36 -14.33 61.7 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -176.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.532 ' HG3' ' O ' ' A' ' 61' ' ' ASN . 44.3 mt-10 -80.22 -16.41 54.83 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-O 121.758 0.79 . . . . 0.0 109.363 177.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.423 HG12 ' HB2' ' A' ' 70' ' ' CYS . 18.8 t -79.61 163.13 3.65 Favored 'Isoleucine or valine' 0 C--O 1.25 1.128 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 175.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -51.03 145.09 7.89 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 123.856 0.862 . . . . 0.0 111.334 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.607 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 8.9 ptpp? -58.9 -32.53 69.6 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -176.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.429 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 13.1 pt20 -80.05 -21.61 43.26 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.637 0.732 . . . . 0.0 109.785 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.429 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.8 m -97.66 -13.07 21.72 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.653 -173.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.607 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 50.6 mt-30 -57.29 -46.62 82.97 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 121.175 0.512 . . . . 0.0 110.363 175.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.527 ' HA ' HG12 ' A' ' 75' ' ' ILE . 14.9 p -79.35 -23.63 43.27 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.924 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.551 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 10.2 mm-40 -66.62 -35.59 80.55 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 175.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.443 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.83 -25.25 66.49 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 123.551 0.74 . . . . 0.0 110.526 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.699 HG21 ' HD3' ' A' ' 107' ' ' PRO . 30.0 mm -73.8 -27.02 22.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.945 -178.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -75.89 -38.91 57.33 Favored 'General case' 0 CA--C 1.486 -1.494 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -175.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 73' ' ' GLU . 67.6 mm-40 -59.46 -44.15 93.05 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 111.56 -2.563 . . . . 0.0 109.711 -178.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.511 HG11 ' HB3' ' A' ' 32' ' ' CYS . 21.4 t -57.79 -45.72 87.13 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.708 0 O-C-N 123.627 0.579 . . . . 0.0 109.996 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 25.9 t -68.05 -47.04 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.317 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -174.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -55.28 -57.34 12.19 Favored 'General case' 0 N--CA 1.428 -1.571 0 O-C-N 124.836 1.335 . . . . 0.0 110.081 -178.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 9.7 pt20 -68.63 -30.02 68.65 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.02 -39.68 60.96 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 120.917 0.389 . . . . 0.0 111.093 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.448 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 13.7 pt20 -77.58 -37.02 51.42 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.649 -178.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.488 ' CG ' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -70.83 -30.45 66.88 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.34 0.126 . . . . 0.0 111.34 -177.794 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 2.8 pt20 -69.03 -28.68 66.78 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.229 0.537 . . . . 0.0 109.749 -178.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.433 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.3 mm? -87.8 -44.03 11.42 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.935 174.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -66.26 -22.48 66.32 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.47 1.108 . . . . 0.0 113.404 -176.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -66.5 -12.52 57.89 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -179.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 138.48 67.14 0.05 OUTLIER Glycine 0 CA--C 1.48 -2.138 0 C-N-CA 119.676 -1.25 . . . . 0.0 112.171 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -145.96 -58.11 0.31 Allowed 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 129.83 -134.91 8.09 Favored Glycine 0 N--CA 1.427 -1.963 0 N-CA-C 106.152 -2.779 . . . . 0.0 106.152 -174.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.63 -34.82 1.6 Allowed Glycine 0 C--O 1.196 -2.278 0 N-CA-C 115.352 0.901 . . . . 0.0 115.352 171.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -48.06 -29.52 3.62 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.651 1.18 . . . . 0.0 114.118 -176.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.479 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 3.3 pt20 -80.88 -43.72 19.45 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.287 0.565 . . . . 0.0 111.054 177.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.529 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 25.8 pt20 -84.08 -44.27 14.24 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 121.254 0.55 . . . . 0.0 111.649 -173.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.433 HG21 ' HG ' ' A' ' 86' ' ' LEU . 64.3 t -64.53 -23.48 33.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 C-N-CA 124.86 1.264 . . . . 0.0 110.418 178.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -51.11 -47.41 61.96 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 19.4 pt20 -67.82 -16.92 64.33 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.351 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 7.3 tpt -100.1 -49.07 4.41 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.5 p -59.95 -28.12 40.23 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.673 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.426 ' HE3' ' O ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -58.7 -25.05 62.49 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 175.468 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -65.13 -28.94 69.78 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 122.64 0.376 . . . . 0.0 110.529 177.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.423 ' HB2' ' CD1' ' A' ' 36' ' ' LEU . . . -60.78 -28.73 68.97 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.465 0.65 . . . . 0.0 110.987 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -73.16 -15.76 61.45 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.561 0.696 . . . . 0.0 110.988 -177.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 46.1 mtt -91.69 -13.97 30.83 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.878 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.474 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 98.3 mt -50.67 -48.09 83.54 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.452 -177.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.699 ' HD3' HG21 ' A' ' 75' ' ' ILE . 19.7 Cg_endo -59.19 -26.95 83.62 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 122.105 1.87 . . . . 0.0 113.113 177.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -83.59 -44.41 14.63 Favored 'General case' 0 N--CA 1.41 -2.438 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -74.93 -24.87 58.56 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.303 -175.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.416 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 25.6 t -98.8 -7.49 27.4 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.915 -178.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.3 t30 58.75 64.82 1.35 Allowed 'General case' 0 C--O 1.239 0.534 0 CA-C-O 122.819 1.295 . . . . 0.0 110.732 -176.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 107' ' ' PRO . 60.8 mt -99.67 158.95 15.41 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 113.272 -1.786 . . . . 0.0 110.07 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -72.7 35.26 0.07 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.806 1.242 . . . . 0.0 112.608 -177.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 40.3 m -157.3 159.71 37.82 Favored 'General case' 0 C--N 1.276 -2.598 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 30.6 m -148.47 143.79 26.96 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 39.7 mm . . . . . 0 C--N 1.311 -1.091 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.316 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 5.4 m . . . . . 0 N--CA 1.421 -1.893 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.8 p -73.68 156.26 38.13 Favored 'General case' 0 C--O 1.253 1.267 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -84.1 70.21 10.48 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.9 t -153.14 163.34 40.04 Favored 'General case' 0 N--CA 1.419 -1.996 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -178.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 78.2 mt -129.15 119.01 19.51 Favored Pre-proline 0 C--N 1.301 -1.539 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.26 144.18 72.34 Favored 'Cis proline' 0 C--O 1.246 0.878 0 C-N-CA 123.921 -1.283 . . . . 0.0 112.417 -1.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -71.45 133.74 23.11 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.1 1.866 . . . . 0.0 111.459 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.3 mm -92.01 113.58 27.58 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 178.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.2 t . . . . . 0 N--CA 1.41 -2.442 0 C-N-CA 118.771 -1.171 . . . . 0.0 111.872 -172.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.9 m . . . . . 0 N--CA 1.415 -2.186 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -106.75 120.37 41.81 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.42 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.3 mp -114.51 143.8 23.46 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.631 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 -178.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.504 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 39.1 ptt180 -66.79 116.54 7.79 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -67.51 -15.54 19.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.363 -173.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -84.5 -9.74 58.08 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.6 -177.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 7.7 pt20 -87.23 -20.68 26.58 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 118.963 -1.095 . . . . 0.0 108.157 176.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.404 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.7 mm? -89.25 -5.24 57.78 Favored 'General case' 0 CA--C 1.474 -1.959 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.203 179.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -53.31 -31.99 46.74 Favored 'General case' 0 C--O 1.209 -1.061 0 O-C-N 124.525 1.141 . . . . 0.0 111.101 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -67.23 -58.33 5.03 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.774 -0.371 . . . . 0.0 110.122 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -54.1 -49.98 67.9 Favored 'General case' 0 C--O 1.22 -0.451 0 O-C-N 123.752 0.657 . . . . 0.0 109.71 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -50.18 -58.66 5.09 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 124.579 1.151 . . . . 0.0 112.321 174.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -67.85 -43.46 79.42 Favored 'General case' 0 C--O 1.208 -1.118 0 O-C-N 121.992 -0.443 . . . . 0.0 112.136 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -66.21 -26.22 67.28 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.418 ' CD1' ' HB2' ' A' ' 103' ' ' ALA . 98.7 mt -88.58 -28.32 20.79 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 176.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.463 HG22 HG11 ' A' ' 96' ' ' VAL . 66.1 p -86.31 -11.69 51.49 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 119.305 -0.958 . . . . 0.0 111.341 178.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.5 p -89.08 121.88 31.85 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 . . . . . 0 N--CA 1.423 -1.796 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 168.898 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.435 -1.198 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -79.75 -43.6 22.27 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.2 m -57.64 -33.26 68.1 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 123.702 0.626 . . . . 0.0 110.562 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 51.0 mt -84.52 -50.77 7.43 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.734 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.4 t -62.56 -49.56 74.81 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 123.243 0.617 . . . . 0.0 111.574 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.472 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 33.0 t -58.3 -38.62 77.42 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 122.597 0.359 . . . . 0.0 110.115 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.56 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 7.5 t30 -73.35 -29.97 63.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.317 0.58 . . . . 0.0 110.686 -177.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -77.15 -43.61 33.33 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.277 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.491 HD22 HD11 ' A' ' 75' ' ' ILE . 3.5 pp -72.23 -34.18 68.12 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.514 -177.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -70.65 -12.97 61.89 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -176.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 61' ' ' ASN . 37.0 mt-10 -84.5 -8.95 58.76 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-O 121.643 0.735 . . . . 0.0 110.294 177.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.405 HG12 ' HB2' ' A' ' 70' ' ' CYS . 39.9 t -83.92 163.23 2.92 Favored 'Isoleucine or valine' 0 C--O 1.247 0.971 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 173.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.464 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.1 mt-10 -51.51 142.69 13.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.072 0.549 . . . . 0.0 111.36 177.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -56.91 -33.79 67.3 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -175.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.44 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 19.7 pt20 -78.96 -21.3 47.36 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 121.381 0.61 . . . . 0.0 110.42 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.44 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 49.7 m -100.4 -11.02 20.58 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.473 -174.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 74.2 mt-30 -59.21 -43.81 92.29 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 123.241 0.617 . . . . 0.0 110.881 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.474 ' HA ' HG12 ' A' ' 75' ' ' ILE . 10.9 p -78.32 -23.39 47.07 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 120.258 -0.577 . . . . 0.0 111.728 177.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -68.37 -34.08 75.41 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.472 0.653 . . . . 0.0 110.323 177.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.67 -27.83 66.74 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.367 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.55 HG21 ' HD3' ' A' ' 107' ' ' PRO . 28.9 mm -71.64 -34.96 54.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.973 -178.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -64.29 -44.73 90.76 Favored 'General case' 0 C--O 1.249 1.052 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.8 mt-30 -58.28 -45.52 87.75 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 112.682 -2.054 . . . . 0.0 110.914 -176.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.404 HG22 ' HB3' ' A' ' 29' ' ' LEU . 19.6 t -52.45 -44.87 45.08 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.954 0 O-C-N 124.103 0.877 . . . . 0.0 110.06 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.19 -48.88 71.84 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -174.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.97 -39.26 94.15 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.632 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 20.2 pt20 -78.66 -32.65 47.29 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 120.751 0.31 . . . . 0.0 111.698 -179.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.6 -35.06 60.63 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.105 0.479 . . . . 0.0 111.642 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -76.03 -36.0 59.27 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.373 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.7 -32.2 65.57 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.059 -176.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 17.7 pt20 -69.4 -38.15 77.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.038 0.447 . . . . 0.0 110.176 -178.502 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.512 ' HG ' HG21 ' A' ' 96' ' ' VAL . 3.7 mm? -74.91 -33.34 61.99 Favored 'General case' 0 C--O 1.246 0.903 0 CA-C-O 121.074 0.464 . . . . 0.0 110.713 178.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.47 ' HA ' ' NE2' ' A' ' 93' ' ' GLN . 50.0 tt0 -60.0 -43.59 95.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.948 -1.023 . . . . 0.0 110.511 178.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -88.92 -2.45 58.6 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.773 -176.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -98.57 -82.09 1.64 Allowed Glycine 0 N--CA 1.425 -2.053 0 CA-C-N 115.424 -0.807 . . . . 0.0 113.041 -177.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -134.95 -23.4 1.54 Allowed 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -172.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 132.98 -127.89 4.92 Favored Glycine 0 CA--C 1.473 -2.556 0 N-CA-C 105.966 -2.854 . . . . 0.0 105.966 -170.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.542 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 78.86 -20.66 4.36 Favored Glycine 0 C--O 1.192 -2.487 0 CA-C-N 118.605 1.202 . . . . 0.0 114.151 174.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.47 ' NE2' ' HA ' ' A' ' 87' ' ' GLN . 46.3 mt-30 -50.73 -37.95 44.63 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 125.551 1.541 . . . . 0.0 110.71 -175.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -78.57 -37.6 42.27 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.843 -178.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.542 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 10.5 pt20 -81.02 -42.55 20.93 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.345 0.593 . . . . 0.0 110.025 -178.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.512 HG21 ' HG ' ' A' ' 86' ' ' LEU . 90.3 t -63.96 -24.57 36.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 CA-C-N 114.823 -1.081 . . . . 0.0 110.205 177.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.429 ' HA ' HG12 ' A' ' 100' ' ' VAL . 28.3 tt0 -49.0 -44.5 41.28 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.05 0.54 . . . . 0.0 112.003 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 13.9 pt20 -69.4 -17.84 63.7 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -176.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 7.3 tpt -98.87 -47.18 5.38 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.429 HG12 ' HA ' ' A' ' 97' ' ' GLN . 14.6 p -62.76 -25.0 37.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.396 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -20.17 65.4 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.644 -0.66 . . . . 0.0 112.089 175.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -66.41 -28.59 68.74 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.483 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -64.25 -24.41 67.65 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-O 121.353 0.597 . . . . 0.0 110.562 178.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -75.17 -16.4 60.51 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.526 0.679 . . . . 0.0 110.38 -179.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . 0.459 ' O ' ' HG2' ' A' ' 109' ' ' GLN . 46.0 mtt -88.18 -14.91 37.42 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.423 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.483 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 93.4 mt -49.46 -49.96 68.35 Favored Pre-proline 0 C--N 1.322 -0.589 0 O-C-N 123.654 0.596 . . . . 0.0 112.537 -177.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.55 ' HD3' HG21 ' A' ' 75' ' ' ILE . 20.8 Cg_endo -62.22 -23.97 75.79 Favored 'Trans proline' 0 C--N 1.365 1.421 0 C-N-CA 121.734 1.623 . . . . 0.0 113.267 177.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -82.75 -45.67 14.09 Favored 'General case' 0 N--CA 1.417 -2.119 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.459 ' HG2' ' O ' ' A' ' 105' ' ' MET . 10.6 mm100 -74.15 -39.15 63.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.958 -175.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 10.2 t -86.16 -3.62 59.0 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -177.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 58.33 61.79 2.18 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 124.701 1.2 . . . . 0.0 109.884 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.445 ' C ' ' H ' ' A' ' 114' ' ' CYS . 52.7 mt -94.59 160.16 14.76 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.591 -178.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -67.2 30.66 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.494 0 C-N-CA 124.935 1.294 . . . . 0.0 113.218 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.445 ' H ' ' C ' ' A' ' 112' ' ' LEU . 67.7 m -155.25 143.77 20.44 Favored 'General case' 0 C--N 1.274 -2.69 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -176.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 38.0 m -133.08 116.9 16.9 Favored 'General case' 0 C--N 1.286 -2.16 0 CA-C-O 120.873 0.368 . . . . 0.0 110.152 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.9 mm . . . . . 0 C--N 1.31 -1.126 0 N-CA-C 107.035 -1.469 . . . . 0.0 107.035 178.368 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.795 ' SG ' ' HB2' ' A' ' 9' ' ' PRO . 4.0 t . . . . . 0 N--CA 1.434 -1.231 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.5 p -85.47 157.2 20.52 Favored 'General case' 0 C--N 1.283 -2.312 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.304 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -87.74 76.58 8.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 177.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.7 m -147.41 160.26 42.76 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.153 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 69.4 mt -129.54 111.6 17.75 Favored Pre-proline 0 C--N 1.309 -1.156 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -73.65 143.83 79.08 Favored 'Cis proline' 0 C--O 1.241 0.648 0 C-N-CA 124.362 -1.099 . . . . 0.0 111.78 -0.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.795 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 74.5 Cg_endo -72.75 155.9 53.55 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.586 2.191 . . . . 0.0 112.681 -178.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.8 mm -110.96 112.0 38.65 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.493 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 64.6 m . . . . . 0 C--N 1.298 -1.653 0 C-N-CA 119.124 -1.03 . . . . 0.0 110.285 -174.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 N--CA 1.415 -2.188 0 CA-C-O 121.139 0.495 . . . . 0.0 110.487 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 -106.92 103.28 12.66 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.415 177.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.408 HG21 ' HB2' ' A' ' 74' ' ' ALA . 2.9 mp -108.54 132.34 56.7 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.557 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 -179.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.47 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 18.9 ptt-85 -67.42 121.42 15.73 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 123.799 0.687 . . . . 0.0 110.607 -177.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -64.58 -15.81 18.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.403 ' HG2' ' HB2' ' A' ' 25' ' ' ARG . 20.9 pt20 -75.56 -8.89 57.91 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.523 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.596 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 1.4 pt20 -98.49 -18.2 18.33 Favored 'General case' 0 N--CA 1.42 -1.959 0 C-N-CA 118.861 -1.136 . . . . 0.0 109.989 178.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -99.33 -3.84 33.07 Favored 'General case' 0 CA--C 1.476 -1.874 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.68 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.51 ' HA ' HE21 ' A' ' 33' ' ' GLN . 26.7 p30 -54.24 -32.24 55.5 Favored 'General case' 0 C--N 1.311 -1.1 0 O-C-N 124.022 0.826 . . . . 0.0 112.938 -178.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -68.8 -56.82 6.8 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.455 ' HB3' HG11 ' A' ' 78' ' ' VAL . 1.2 m -55.35 -49.82 71.25 Favored 'General case' 0 C--O 1.213 -0.827 0 O-C-N 123.869 0.731 . . . . 0.0 110.172 178.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.51 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.0 tt0 -51.93 -57.2 10.13 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 123.489 0.716 . . . . 0.0 112.425 176.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 26.3 ptt? -68.31 -41.44 80.85 Favored 'General case' 0 CA--C 1.507 -0.709 0 C-N-CA 120.242 -0.583 . . . . 0.0 112.418 -174.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 59.2 m-70 -72.05 -24.41 61.52 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.436 ' O ' ' HB3' ' A' ' 99' ' ' MET . 99.3 mt -88.65 -21.76 23.79 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 119.916 -0.713 . . . . 0.0 111.988 177.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.465 ' HA ' HG13 ' A' ' 96' ' ' VAL . 32.1 p -85.73 -21.15 28.4 Favored 'General case' 0 C--N 1.298 -1.651 0 C-N-CA 118.177 -1.409 . . . . 0.0 111.548 176.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.8 m -89.8 122.97 33.38 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.648 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 . . . . . 0 N--CA 1.437 -1.108 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 171.349 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 . . . . . 0 N--CA 1.441 -0.922 0 CA-C-O 121.102 0.477 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.83 -44.12 56.63 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 176.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.0 m -56.43 -34.72 67.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.069 0.461 . . . . 0.0 110.317 177.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 45.9 mt -78.49 -51.55 9.83 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.233 0.54 . . . . 0.0 110.838 178.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.9 t -63.57 -49.75 72.19 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.417 1.087 . . . . 0.0 111.076 -176.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.483 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 12.8 t -58.02 -37.99 75.35 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.613 0.765 . . . . 0.0 110.479 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -75.31 -25.05 57.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.514 0.673 . . . . 0.0 110.789 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.596 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 8.2 tp-100 -83.22 -42.91 16.7 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.321 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.483 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 4.0 pp -68.92 -28.29 66.53 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.609 0.718 . . . . 0.0 110.572 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.444 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 12.0 pt20 -75.77 -6.83 52.51 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.265 -177.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -84.03 -11.75 56.26 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-O 121.721 0.772 . . . . 0.0 109.12 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 12.4 t -89.25 164.5 2.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 CA-C-N 114.902 -1.045 . . . . 0.0 108.767 177.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -46.79 144.49 2.35 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.628 0.771 . . . . 0.0 111.031 173.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.539 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -61.3 -33.47 73.64 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.017 1.118 . . . . 0.0 114.017 -176.348 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.458 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 28.4 pt20 -75.53 -25.12 56.92 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.764 0.792 . . . . 0.0 110.004 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.458 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 60.1 m -94.27 -13.63 26.32 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.099 -174.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.539 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 54.3 mt-30 -56.87 -43.86 81.63 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 121.211 0.529 . . . . 0.0 110.202 175.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.476 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.8 p -79.9 -23.81 41.57 Favored 'General case' 0 N--CA 1.435 -1.213 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.414 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -68.88 -32.0 71.34 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.251 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 77' ' ' GLN . . . -62.28 -26.17 68.25 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 123.59 0.756 . . . . 0.0 110.183 177.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.527 HG21 ' HD3' ' A' ' 107' ' ' PRO . 31.0 mm -72.63 -31.2 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.356 -178.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -72.66 -40.81 66.05 Favored 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -175.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 53.2 mm-40 -57.6 -42.33 83.02 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 112.256 -2.247 . . . . 0.0 110.927 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.455 HG11 ' HB3' ' A' ' 32' ' ' CYS . 23.4 t -58.94 -46.49 91.39 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.79 0 O-C-N 123.833 0.708 . . . . 0.0 109.255 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.424 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 19.7 t -69.17 -42.24 81.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -58.88 -48.4 81.53 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.677 -178.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 9.1 pt20 -76.26 -35.55 58.89 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 123.122 0.264 . . . . 0.0 111.386 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.412 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -69.97 -35.92 74.81 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.901 0.381 . . . . 0.0 111.681 -178.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 28.9 pt20 -79.06 -35.46 42.48 Favored 'General case' 0 C--N 1.308 -1.215 0 C-N-CA 118.798 -1.161 . . . . 0.0 110.537 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.46 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -69.39 -30.16 68.08 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.097 -177.314 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -71.35 -37.99 71.66 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 121.216 0.531 . . . . 0.0 109.621 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.496 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 2.6 mm? -78.44 -35.45 46.82 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.471 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -58.16 -43.39 87.38 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.222 0.609 . . . . 0.0 111.547 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.1 pt20 -81.85 -14.42 56.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.311 0.577 . . . . 0.0 110.141 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -84.87 -88.82 0.87 Allowed Glycine 0 N--CA 1.428 -1.848 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.262 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -125.79 -18.34 5.18 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.28 0.562 . . . . 0.0 111.873 -175.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.496 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 127.45 -104.2 0.68 Allowed Glycine 0 CA--C 1.476 -2.355 0 N-CA-C 106.713 -2.555 . . . . 0.0 106.713 -171.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.408 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 75.33 -32.21 1.15 Allowed Glycine 0 C--O 1.196 -2.247 0 N-CA-C 115.634 1.013 . . . . 0.0 115.634 170.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -47.36 -34.27 6.77 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.504 1.122 . . . . 0.0 112.291 -178.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -68.91 -45.08 71.8 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.528 178.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 4.1 pt20 -82.93 -47.18 12.07 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 121.074 0.464 . . . . 0.0 110.171 -176.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.465 HG13 ' HA ' ' A' ' 37' ' ' THR . 91.5 t -59.41 -22.69 23.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 125.66 1.584 . . . . 0.0 110.224 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -43.02 -45.12 5.02 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.165 0.986 . . . . 0.0 112.67 178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 3.7 pt20 -68.63 -17.77 64.17 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 7.7 tpt -101.96 -47.34 4.6 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.8 p -65.05 -24.13 34.79 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 120.831 0.348 . . . . 0.0 111.354 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.506 ' HA ' HE21 ' A' ' 104' ' ' GLN . 15.2 ptpt -62.3 -24.82 67.52 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.748 -0.595 . . . . 0.0 110.956 174.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.413 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 26.3 mtpp -63.55 -30.9 71.95 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.49 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -59.9 -38.72 83.06 Favored 'General case' 0 C--O 1.204 -1.34 0 O-C-N 123.722 0.638 . . . . 0.0 109.861 176.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.506 HE21 ' HA ' ' A' ' 101' ' ' LYS . 38.6 mt-30 -72.79 -16.9 61.62 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.632 -177.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 43.4 mtt -82.23 -21.2 36.47 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.879 -0.513 . . . . 0.0 110.517 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 7.5 mp -47.43 -46.59 58.59 Favored Pre-proline 0 N--CA 1.481 1.076 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.527 ' HD3' HG21 ' A' ' 75' ' ' ILE . 18.8 Cg_endo -62.3 -22.38 74.03 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 120.897 1.356 . . . . 0.0 112.871 178.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 61.7 m-80 -89.35 -42.79 11.35 Favored 'General case' 0 N--CA 1.403 -2.799 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -73.56 -36.74 65.64 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.831 -177.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.404 ' SG ' HD21 ' A' ' 112' ' ' LEU . 16.1 t -89.94 -3.8 57.84 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 60.3 t30 55.43 63.4 2.1 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 124.779 1.232 . . . . 0.0 110.276 -177.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.419 HD21 HD11 ' A' ' 63' ' ' LEU . 52.4 mt -93.28 159.75 15.13 Favored 'General case' 0 C--N 1.284 -2.276 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.305 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -70.43 35.03 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.392 1.077 . . . . 0.0 113.405 -175.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 72' ' ' CYS . 57.4 m -158.02 156.4 31.05 Favored 'General case' 0 C--N 1.284 -2.249 0 C-N-CA 125.171 1.388 . . . . 0.0 107.284 -175.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 42.1 m -142.46 120.95 12.45 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.45 HG21 ' HB3' ' A' ' 104' ' ' GLN . 67.7 mt . . . . . 0 C--N 1.299 -1.619 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 N--CA 1.443 -0.82 0 CA-C-O 120.58 0.229 . . . . 0.0 110.46 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 43.2 p -90.29 158.06 17.36 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 175.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -87.26 72.0 9.93 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.0 p -145.73 159.42 43.19 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 75.3 mt -128.83 117.24 19.38 Favored Pre-proline 0 C--N 1.299 -1.598 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -71.49 146.35 85.12 Favored 'Cis proline' 0 C--O 1.242 0.694 0 C-N-CA 124.109 -1.205 . . . . 0.0 112.3 0.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -71.97 145.83 45.94 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.619 2.213 . . . . 0.0 113.083 -177.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.6 mm -96.2 108.78 21.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.7 m . . . . . 0 C--N 1.295 -1.79 0 CA-C-O 121.473 0.654 . . . . 0.0 112.271 -175.999 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.466 ' SG ' ' HG3' ' A' ' 73' ' ' GLU . 95.2 m . . . . . 0 N--CA 1.405 -2.694 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -106.2 113.06 26.36 Favored 'General case' 0 C--N 1.288 -2.099 0 CA-C-O 122.036 0.922 . . . . 0.0 108.82 173.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.442 HD11 ' HB2' ' A' ' 73' ' ' GLU . 3.3 mp -106.94 146.08 13.72 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.504 0 CA-C-N 114.116 -1.402 . . . . 0.0 107.785 -174.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.469 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 34.2 ptt180 -65.64 120.16 12.44 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-O 121.551 0.691 . . . . 0.0 109.171 -178.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 pp -69.88 -15.98 19.84 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.466 -175.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -71.67 -23.21 61.62 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.488 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.497 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 6.9 pt20 -83.83 -18.8 36.37 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.587 -178.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -94.31 -4.06 49.36 Favored 'General case' 0 CA--C 1.48 -1.719 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.236 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.529 ' O ' ' HG2' ' A' ' 34' ' ' MET . 3.4 t-20 -57.15 -32.02 65.96 Favored 'General case' 0 C--N 1.317 -0.816 0 O-C-N 123.89 0.744 . . . . 0.0 110.646 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -69.53 -53.74 17.54 Favored 'General case' 0 C--O 1.221 -0.406 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.418 ' HB3' HG11 ' A' ' 78' ' ' VAL . 0.4 OUTLIER -55.61 -51.69 66.3 Favored 'General case' 0 C--O 1.222 -0.393 0 O-C-N 123.605 0.566 . . . . 0.0 109.832 178.778 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.466 HE21 ' HG3' ' A' ' 81' ' ' GLN . 17.0 tt0 -51.77 -56.58 13.02 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 123.899 0.88 . . . . 0.0 112.468 176.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.529 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 26.6 ptm -69.92 -42.87 72.75 Favored 'General case' 0 CA--C 1.504 -0.81 0 C-N-CA 119.967 -0.693 . . . . 0.0 112.263 -174.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -67.35 -27.12 66.86 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.916 -175.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 94.8 mt -88.63 -28.48 20.62 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 112.17 0.434 . . . . 0.0 112.17 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.518 ' HA ' HG13 ' A' ' 96' ' ' VAL . 35.2 p -84.64 -21.67 30.18 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 118.233 -1.387 . . . . 0.0 111.451 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.8 p -91.36 121.65 33.28 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 . . . . . 0 C--N 1.3 -1.584 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 166.889 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 . . . . . 0 N--CA 1.434 -1.228 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -70.3 -44.89 67.41 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 175.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 51.0 m -57.37 -36.3 71.06 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 123.563 0.54 . . . . 0.0 110.574 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 35.9 mt -80.85 -53.19 6.69 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.627 -178.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 19.6 t -66.2 -48.34 70.95 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.198 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.502 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 32.8 t -58.46 -34.23 70.63 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 117.868 0.304 . . . . 0.0 110.653 176.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -76.41 -24.68 54.02 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.626 0.727 . . . . 0.0 110.6 -178.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.497 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 6.1 tp-100 -85.58 -46.88 10.39 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.639 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.541 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -64.27 -31.61 72.88 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.673 -177.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.417 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 7.3 pt20 -70.87 -10.28 59.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.641 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -75.87 -21.07 57.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 122.062 0.934 . . . . 0.0 108.841 176.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.468 HG12 ' HB2' ' A' ' 70' ' ' CYS . 8.9 t -82.26 163.61 3.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 176.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.59 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 31.9 mt-10 -54.84 144.07 23.8 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-O 119.268 -0.396 . . . . 0.0 110.695 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.437 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 18.1 ptpt -57.8 -31.78 66.9 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -77.18 -20.17 55.79 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.075 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.468 ' HB2' HG12 ' A' ' 66' ' ' VAL . 63.0 m -103.97 -10.67 17.94 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.866 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.59 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 29.2 mt-30 -62.82 -37.76 88.03 Favored 'General case' 0 C--O 1.217 -0.637 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.498 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.8 p -80.96 -24.51 38.03 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.549 176.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.466 ' HG3' ' SG ' ' A' ' 22' ' ' CYS . 8.4 mm-40 -67.22 -36.1 80.97 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 177.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.412 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -61.1 -28.5 69.13 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 123.577 0.751 . . . . 0.0 110.645 178.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.541 HD11 HD22 ' A' ' 63' ' ' LEU . 31.5 mm -69.68 -37.51 74.16 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.598 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -65.55 -41.11 93.36 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -177.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.465 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.8 mt-30 -61.03 -38.63 86.82 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 113.505 -1.68 . . . . 0.0 110.621 -178.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.418 HG11 ' HB3' ' A' ' 32' ' ' CYS . 20.8 t -61.11 -44.58 98.58 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.906 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 29.0 t -65.63 -47.77 84.99 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.894 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -174.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -58.68 -50.63 73.15 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.68 -178.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.466 ' HG3' HE21 ' A' ' 33' ' ' GLN . 11.0 pt20 -71.82 -31.72 66.83 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.835 0.35 . . . . 0.0 111.886 -177.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.72 -38.23 54.67 Favored 'General case' 0 C--N 1.315 -0.908 0 O-C-N 122.131 -0.356 . . . . 0.0 111.307 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -72.95 -34.08 66.3 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.357 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.551 ' O ' ' HG2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -70.67 -38.12 73.74 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.46 -178.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -68.07 -37.97 81.87 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.136 -175.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.479 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.6 mm? -76.64 -33.73 58.33 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.872 178.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.417 ' HB2' ' NE2' ' A' ' 93' ' ' GLN . 10.0 tt0 -64.85 -37.3 87.16 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.252 0.549 . . . . 0.0 110.509 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 84' ' ' LYS . 4.6 pt20 -90.49 0.33 57.36 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.667 0.746 . . . . 0.0 110.422 178.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -99.29 -100.6 2.26 Favored Glycine 0 N--CA 1.421 -2.337 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.896 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -118.18 -5.88 10.89 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.008 0.432 . . . . 0.0 112.025 -174.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.479 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 116.57 -101.37 0.97 Allowed Glycine 0 CA--C 1.468 -2.867 0 N-CA-C 106.825 -2.51 . . . . 0.0 106.825 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.466 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 72.4 -34.81 0.67 Allowed Glycine 0 C--O 1.196 -2.229 0 N-CA-C 116.082 1.193 . . . . 0.0 116.082 170.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.417 ' NE2' ' HB2' ' A' ' 87' ' ' GLN . 90.8 mt-30 -46.53 -34.25 4.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 118.322 1.061 . . . . 0.0 112.866 -176.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -71.41 -42.19 68.63 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 120.982 0.42 . . . . 0.0 111.449 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 92' ' ' GLY . 20.5 pt20 -82.83 -47.88 11.39 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 -176.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.518 HG13 ' HA ' ' A' ' 37' ' ' THR . 80.7 t -59.04 -22.83 22.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 125.461 1.504 . . . . 0.0 110.725 178.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -44.48 -46.15 9.56 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 123.562 0.745 . . . . 0.0 112.502 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -67.57 -18.02 64.85 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -176.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.8 tpt -102.29 -48.24 4.25 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.0 p -63.72 -24.09 34.96 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 CA-C-O 121.06 0.457 . . . . 0.0 111.183 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.565 ' HA ' HE21 ' A' ' 104' ' ' GLN . 0.0 OUTLIER -65.49 -21.02 66.59 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.703 -0.623 . . . . 0.0 111.539 176.228 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -67.33 -27.89 67.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 176.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.454 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -62.99 -32.11 73.38 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 121.599 0.714 . . . . 0.0 109.807 175.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.565 HE21 ' HA ' ' A' ' 101' ' ' LYS . 43.8 mt-30 -74.4 -15.46 60.92 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.645 -178.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 61.2 mtp -90.33 -18.29 25.81 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.793 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.454 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 96.4 mt -50.25 -51.23 65.0 Favored Pre-proline 0 C--N 1.323 -0.544 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -176.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.511 ' HD3' HG21 ' A' ' 75' ' ' ILE . 18.0 Cg_endo -60.79 -24.92 80.13 Favored 'Trans proline' 0 C--N 1.362 1.282 0 C-N-CA 121.73 1.62 . . . . 0.0 113.169 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -84.47 -41.0 17.03 Favored 'General case' 0 N--CA 1.414 -2.251 0 CA-C-O 121.157 0.503 . . . . 0.0 109.822 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -80.37 -37.32 32.58 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.123 -176.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.415 ' SG ' HD21 ' A' ' 112' ' ' LEU . 24.2 t -84.38 -6.04 59.34 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.199 0.524 . . . . 0.0 109.693 -178.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 57.45 65.03 1.43 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 122.989 1.376 . . . . 0.0 110.784 -177.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.446 HD22 HE21 ' A' ' 71' ' ' GLN . 41.9 mt -93.67 159.41 15.23 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 113.272 -1.785 . . . . 0.0 109.363 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -75.88 35.79 0.13 Allowed 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 121.658 0.742 . . . . 0.0 112.094 -174.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.401 ' H ' ' C ' ' A' ' 112' ' ' LEU . 78.7 m -154.0 149.06 26.82 Favored 'General case' 0 C--N 1.285 -2.23 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 -176.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 25.7 p -136.1 132.38 36.04 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 118.114 0.416 . . . . 0.0 110.189 -176.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 26.6 mm . . . . . 0 C--N 1.308 -1.205 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 178.738 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 58.3 m . . . . . 0 N--CA 1.42 -1.972 0 CA-C-O 121.002 0.43 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.9 p -71.27 151.11 44.55 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.773 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -79.12 72.0 5.65 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.359 0.6 . . . . 0.0 110.355 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.9 t -149.08 163.92 36.17 Favored 'General case' 0 N--CA 1.419 -2.02 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.3 mt -129.75 118.82 18.87 Favored Pre-proline 0 C--N 1.304 -1.391 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -75.32 140.93 69.67 Favored 'Cis proline' 0 C--O 1.243 0.727 0 C-N-CA 123.809 -1.329 . . . . 0.0 110.876 -1.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.416 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 43.7 Cg_endo -67.08 152.01 80.76 Favored 'Trans proline' 0 C--O 1.244 0.79 0 C-N-CA 122.954 2.436 . . . . 0.0 113.21 -175.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.7 mm -102.81 118.26 49.45 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 75.8 m . . . . . 0 C--N 1.29 -1.983 0 CA-C-O 121.62 0.724 . . . . 0.0 111.625 -176.807 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.7 m . . . . . 0 N--CA 1.416 -2.153 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -99.95 91.74 4.95 Favored 'General case' 0 N--CA 1.422 -1.831 0 CA-C-O 122.439 1.114 . . . . 0.0 110.978 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.409 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 3.5 mp -94.14 138.39 20.67 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.818 0 N-CA-C 105.328 -2.101 . . . . 0.0 105.328 177.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.463 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.5 ptt-85 -71.66 120.54 17.39 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.057 0.456 . . . . 0.0 110.0 -176.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -63.53 -16.31 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-O 121.288 0.566 . . . . 0.0 112.236 -176.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -77.14 -17.74 58.4 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.62 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.463 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.6 pt20 -86.62 -29.2 22.74 Favored 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 119.401 -0.919 . . . . 0.0 108.544 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -85.11 -7.79 58.93 Favored 'General case' 0 CA--C 1.473 -2.004 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.491 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 34' ' ' MET . 8.6 t30 -54.12 -34.84 61.32 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 124.335 1.022 . . . . 0.0 110.889 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.411 ' CE1' HD13 ' A' ' 58' ' ' LEU . 3.1 t-160 -69.06 -55.12 11.74 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -52.29 -53.74 40.27 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 125.114 1.366 . . . . 0.0 108.347 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -49.55 -61.34 2.16 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 126.101 1.76 . . . . 0.0 112.45 175.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.3 ptm -69.82 -28.69 65.91 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -173.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.624 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 3.0 t-80 -72.48 -25.72 61.53 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-O 121.139 0.495 . . . . 0.0 109.834 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.5 mt -88.52 -32.17 18.33 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.41 177.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.492 ' HA ' HG13 ' A' ' 96' ' ' VAL . 58.9 p -82.75 -22.14 34.45 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 118.622 -1.231 . . . . 0.0 111.785 -178.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.8 t -90.94 127.73 36.51 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.256 0.551 . . . . 0.0 111.934 -178.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 . . . . . 0 N--CA 1.423 -1.791 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 171.16 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.624 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--O 1.212 -0.906 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.3 tp -72.22 -52.03 18.33 Favored 'General case' 0 CA--C 1.489 -1.403 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.0 m -59.23 -21.76 60.05 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.614 -176.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.411 HD13 ' CE1' ' A' ' 31' ' ' HIS . 41.1 mt -89.76 -57.66 2.79 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.014 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 52.2 t -64.39 -50.51 67.39 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.155 0.982 . . . . 0.0 112.372 -175.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.547 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 12.1 t -59.23 -39.68 83.52 Favored 'General case' 0 CA--C 1.495 -1.145 0 CA-C-O 121.613 0.721 . . . . 0.0 109.281 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.425 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 27.9 t-20 -70.77 -28.03 64.36 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.956 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -81.13 -42.56 20.73 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.325 0.583 . . . . 0.0 110.446 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.547 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.7 pp -72.25 -31.65 65.99 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.908 -176.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.425 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 17.6 pt20 -68.9 -15.16 63.42 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.711 -176.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -81.7 -22.67 37.28 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.7 t -70.75 161.65 4.54 Favored 'Isoleucine or valine' 0 C--O 1.249 1.026 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.438 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.3 mt-10 -50.09 140.63 12.29 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 123.417 0.687 . . . . 0.0 112.298 178.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -55.17 -33.31 62.86 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.111 0.564 . . . . 0.0 112.471 -177.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.417 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 13.9 pt20 -81.9 -7.35 59.6 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.068 0.461 . . . . 0.0 110.576 -178.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.417 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 61.3 m -117.5 -11.28 10.51 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -174.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.536 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 75.9 mt-30 -57.96 -48.54 79.64 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.258 0.623 . . . . 0.0 112.03 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.408 ' HA ' HG12 ' A' ' 75' ' ' ILE . 14.7 p -74.82 -23.12 58.42 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.804 -0.759 . . . . 0.0 112.145 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -68.3 -32.54 72.75 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.613 0.721 . . . . 0.0 109.614 178.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.43 -28.75 67.24 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.704 177.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.561 HG21 ' HD3' ' A' ' 107' ' ' PRO . 27.8 mm -70.98 -32.95 50.03 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -176.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -66.46 -44.14 83.58 Favored 'General case' 0 CA--C 1.491 -1.32 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 -177.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.515 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.3 mt-30 -59.16 -46.22 88.95 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 113.103 -1.862 . . . . 0.0 110.349 -177.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 74' ' ' ALA . 19.6 t -53.42 -44.7 56.08 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 O-C-N 124.211 0.944 . . . . 0.0 110.138 -179.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 75' ' ' ILE . 26.1 t -70.12 -45.04 77.5 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -175.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -60.04 -52.58 64.75 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.678 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 20.7 pt20 -70.61 -31.76 68.86 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.855 -176.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.465 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -72.11 -41.46 67.21 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.76 0.314 . . . . 0.0 111.193 178.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.5 pt20 -72.1 -37.84 69.47 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 119.99 -0.684 . . . . 0.0 110.089 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.451 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -68.77 -32.34 72.01 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -178.097 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 1.7 pt20 -71.19 -28.84 64.51 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 121.683 0.754 . . . . 0.0 109.755 -177.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.604 HD12 ' HA3' ' A' ' 92' ' ' GLY . 3.7 mm? -86.29 -37.28 18.7 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.965 176.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -58.18 -36.45 73.07 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.925 1.29 . . . . 0.0 111.333 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -80.19 -9.89 59.74 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-O 121.018 0.437 . . . . 0.0 111.302 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -113.82 -115.57 3.21 Favored Glycine 0 N--CA 1.43 -1.732 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.017 -177.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -71.24 -43.26 67.62 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 124.198 0.999 . . . . 0.0 111.371 -174.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.536 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 142.68 -85.95 0.19 Allowed Glycine 0 CA--C 1.478 -2.224 0 N-CA-C 107.007 -2.437 . . . . 0.0 107.007 -171.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.604 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 74.18 -44.55 1.36 Allowed Glycine 0 C--O 1.199 -2.08 0 N-CA-C 115.531 0.972 . . . . 0.0 115.531 171.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.466 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 56.2 mt-30 -44.37 -30.94 0.92 Allowed 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 125.292 1.437 . . . . 0.0 113.677 -176.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -75.88 -41.3 52.54 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 120.819 0.342 . . . . 0.0 111.321 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -85.51 -43.88 13.17 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.62 0.724 . . . . 0.0 110.227 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.492 HG13 ' HA ' ' A' ' 37' ' ' THR . 75.9 t -63.81 -22.72 31.62 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 C-N-CA 125.781 1.632 . . . . 0.0 110.547 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 64.5 tt0 -45.48 -45.65 13.22 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.478 0.711 . . . . 0.0 112.844 -178.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -67.25 -21.97 65.71 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -177.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.9 tpt -94.94 -49.55 5.51 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -176.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.9 p -61.51 -28.31 43.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.813 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -24.45 65.21 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 177.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -62.46 -38.03 88.22 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.507 ' HA ' HD13 ' A' ' 106' ' ' LEU . . . -52.07 -35.55 47.91 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.581 178.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -68.14 -17.25 64.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.134 0.492 . . . . 0.0 111.239 -178.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 40.8 mtt -91.81 -14.57 29.57 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -178.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.507 HD13 ' HA ' ' A' ' 103' ' ' ALA . 6.9 mp -53.16 -45.49 98.25 Favored Pre-proline 0 C--O 1.207 -1.182 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.561 ' HD3' HG21 ' A' ' 75' ' ' ILE . 19.6 Cg_endo -61.52 -26.49 80.88 Favored 'Trans proline' 0 C--N 1.358 1.07 0 CA-C-N 121.067 1.417 . . . . 0.0 112.125 176.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -83.51 -42.87 16.38 Favored 'General case' 0 N--CA 1.417 -2.124 0 CA-C-O 121.277 0.56 . . . . 0.0 110.277 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -79.92 -38.89 31.48 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -176.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 19.6 t -80.77 -5.73 57.55 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 45.4 t30 64.32 58.82 1.07 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 122.952 1.358 . . . . 0.0 109.873 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 49.5 mt -100.23 158.43 15.87 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-N 113.536 -1.666 . . . . 0.0 108.228 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -82.83 45.53 1.01 Allowed 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.62 0.724 . . . . 0.0 111.194 -174.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 48.7 m -157.35 160.55 38.59 Favored 'General case' 0 C--N 1.292 -1.893 0 C-N-CA 124.994 1.318 . . . . 0.0 107.889 -176.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.8 m -149.36 135.77 19.25 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 176.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 81.0 mt . . . . . 0 C--N 1.304 -1.402 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -178.673 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 62.7 m . . . . . 0 N--CA 1.432 -1.345 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.3 p -84.6 156.56 21.53 Favored 'General case' 0 C--N 1.296 -1.727 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -79.81 74.57 6.53 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 122.082 0.944 . . . . 0.0 109.595 174.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 47.5 t -136.92 157.72 46.1 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.101 -1.409 . . . . 0.0 107.286 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.6 mm -128.51 109.65 19.15 Favored Pre-proline 0 C--N 1.294 -1.819 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 176.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -73.97 150.81 96.17 Favored 'Cis proline' 0 C--O 1.253 1.271 0 C-N-CA 124.177 -1.176 . . . . 0.0 111.322 -3.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.417 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 57.9 Cg_endo -70.18 150.84 66.2 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.722 2.281 . . . . 0.0 113.178 -175.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.416 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 46.9 mm -97.31 114.19 33.73 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 82.3 m . . . . . 0 C--N 1.288 -2.107 0 CA-C-O 121.277 0.56 . . . . 0.0 111.522 -176.967 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 29.9 m . . . . . 0 N--CA 1.421 -1.922 0 CA-C-O 121.036 0.446 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -106.54 109.83 21.87 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-O 121.819 0.819 . . . . 0.0 108.882 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.744 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 2.7 mp -115.02 143.72 24.14 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.107 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.571 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 18.6 ptt180 -71.61 122.12 19.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.81 -13.34 16.69 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.045 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -75.72 -18.88 59.43 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.9 -178.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.571 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.4 pt20 -81.13 -16.97 51.51 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.525 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.458 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.2 mm? -96.59 2.59 52.42 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.138 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.459 ' HA ' HE21 ' A' ' 33' ' ' GLN . 28.6 t-20 -52.52 -39.27 61.17 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 124.343 1.027 . . . . 0.0 112.223 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -69.2 -54.78 13.07 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.413 ' HB3' HG11 ' A' ' 78' ' ' VAL . 1.2 m -55.13 -47.25 75.32 Favored 'General case' 0 C--O 1.221 -0.418 0 O-C-N 123.467 0.48 . . . . 0.0 110.652 178.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.459 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.7 tt0 -54.55 -55.39 29.79 Favored 'General case' 0 N--CA 1.437 -1.095 0 C-N-CA 123.457 0.703 . . . . 0.0 112.335 176.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 14.2 ptp -68.43 -41.74 79.88 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -176.26 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -70.25 -25.41 63.36 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.057 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.451 ' O ' ' HB3' ' A' ' 99' ' ' MET . 86.9 mt -88.33 -25.13 22.92 Favored 'General case' 0 C--O 1.214 -0.816 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 177.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.507 ' HA ' HG13 ' A' ' 96' ' ' VAL . 29.9 p -87.78 -21.57 25.04 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 117.919 -1.512 . . . . 0.0 111.333 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.2 m -90.63 143.47 26.71 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.558 174.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.464 ' CZ ' ' HA ' ' A' ' 96' ' ' VAL . 48.8 m-85 . . . . . 0 C--N 1.299 -1.619 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 . . . . . 0 C--O 1.206 -1.19 0 CA-C-O 120.485 0.184 . . . . 0.0 111.267 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.411 HD23 HD22 ' A' ' 106' ' ' LEU . 3.2 tm? -78.5 -46.15 20.29 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -178.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.9 m -55.06 -33.37 62.68 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.471 0.653 . . . . 0.0 110.519 178.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.3 mt -82.95 -56.13 3.99 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.858 178.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.8 t -58.68 -49.42 77.61 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.196 0.999 . . . . 0.0 111.348 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.486 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 38.5 t -57.82 -37.08 73.18 Favored 'General case' 0 C--O 1.212 -0.903 0 C-N-CA 123.028 0.531 . . . . 0.0 110.839 178.162 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.516 ' HA ' HE21 ' A' ' 64' ' ' GLN . 12.5 t30 -76.42 -25.32 54.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.872 0.844 . . . . 0.0 110.816 -177.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.543 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 6.3 tp-100 -79.61 -48.61 13.49 Favored 'General case' 0 C--N 1.283 -2.311 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.369 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.581 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -69.05 -31.7 70.66 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.866 -177.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.516 HE21 ' HA ' ' A' ' 61' ' ' ASN . 25.6 pt20 -71.92 -11.18 60.66 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -176.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.35 -10.23 57.77 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.929 0.871 . . . . 0.0 109.785 175.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -82.73 163.68 2.98 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 172.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.573 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 27.7 mm-40 -50.55 149.4 3.21 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-N 118.101 0.409 . . . . 0.0 112.023 174.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -62.51 -38.4 89.8 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.779 -171.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -76.3 -19.59 58.12 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-O 121.534 0.683 . . . . 0.0 110.158 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 57.2 m -98.83 -11.5 21.72 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.541 -176.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 29.2 mt-30 -62.19 -38.84 90.65 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-O 121.414 0.626 . . . . 0.0 109.365 176.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.6 p -80.31 -24.84 39.68 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.125 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -71.32 -29.89 65.56 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.597 178.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.449 ' HB2' HG21 ' A' ' 24' ' ' ILE . . . -63.71 -30.44 71.54 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.42 176.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.581 HD11 HD22 ' A' ' 63' ' ' LEU . 31.4 mm -69.45 -33.94 59.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.539 -179.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -65.78 -41.11 92.41 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 -177.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.744 ' NE2' ' HB ' ' A' ' 24' ' ' ILE . 9.0 mt-30 -65.49 -33.13 75.2 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.743 -177.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.458 HG22 ' HB3' ' A' ' 29' ' ' LEU . 22.0 t -58.66 -46.7 90.26 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.03 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.477 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 42.7 t -64.46 -50.61 75.34 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.167 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 -176.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -50.5 -47.51 57.27 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.996 -1.457 . . . . 0.0 112.276 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.649 ' HA ' ' CD ' ' A' ' 84' ' ' LYS . 29.6 pt20 -83.1 -32.91 26.5 Favored 'General case' 0 N--CA 1.432 -1.342 0 C-N-CA 119.531 -0.868 . . . . 0.0 113.272 -176.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.463 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -71.27 -32.8 69.13 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-O 121.057 0.456 . . . . 0.0 110.493 -178.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 4.4 pt20 -74.1 -43.24 58.37 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.167 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.649 ' CD ' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -72.78 -25.08 61.04 Favored 'General case' 0 CA--C 1.498 -1.047 0 C-N-CA 118.197 -1.401 . . . . 0.0 111.824 -175.333 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -71.03 -34.12 70.99 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 119.777 -0.769 . . . . 0.0 109.863 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.444 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.2 mm? -84.16 -31.47 25.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.802 177.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -63.18 -38.32 90.71 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 122.871 0.469 . . . . 0.0 111.903 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -87.94 4.08 46.18 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.433 0.635 . . . . 0.0 112.156 -174.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -101.72 -130.65 7.1 Favored Glycine 0 C--N 1.286 -2.249 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.433 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -93.81 -8.1 41.45 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.647 0.737 . . . . 0.0 110.435 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.62 -150.65 17.32 Favored Glycine 0 N--CA 1.422 -2.28 0 N-CA-C 108.716 -1.754 . . . . 0.0 108.716 -176.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.409 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 112.91 -19.91 20.4 Favored Glycine 0 C--O 1.189 -2.671 0 C-N-CA 119.723 -1.227 . . . . 0.0 111.079 -177.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -51.38 -37.66 49.31 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 124.088 0.955 . . . . 0.0 111.252 -177.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -76.92 -33.25 57.76 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.014 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.418 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 29.8 pt20 -83.17 -44.51 14.97 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.349 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.507 HG13 ' HA ' ' A' ' 37' ' ' THR . 93.2 t -64.2 -22.54 31.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 C-N-CA 125.537 1.535 . . . . 0.0 110.687 177.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -45.95 -45.39 15.56 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.471 1.108 . . . . 0.0 112.285 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.8 pt20 -65.25 -18.75 65.56 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -178.214 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.451 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 3.6 tpt -98.87 -45.92 5.82 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.86 -25.02 36.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 120.891 0.376 . . . . 0.0 111.253 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -63.21 -22.66 67.01 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.374 -0.829 . . . . 0.0 111.831 174.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -66.45 -25.99 66.99 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 122.393 0.277 . . . . 0.0 110.444 175.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.49 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -60.97 -30.25 70.15 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 121.564 0.697 . . . . 0.0 110.487 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -70.51 -19.82 62.89 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.188 -178.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 56.0 mtp -92.4 -15.07 27.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.67 -178.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.5 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 97.5 mt -55.78 -45.93 99.81 Favored Pre-proline 0 C--N 1.317 -0.819 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.226 -178.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 14.5 Cg_endo -58.25 -25.01 70.28 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 122.222 1.948 . . . . 0.0 113.195 174.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.05 -47.71 13.19 Favored 'General case' 0 N--CA 1.419 -1.991 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -67.29 -38.45 85.04 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.595 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.454 ' SG ' HD21 ' A' ' 112' ' ' LEU . 15.9 t -90.33 -4.11 57.32 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-O 120.832 0.349 . . . . 0.0 110.336 -177.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 60.31 60.67 1.97 Allowed 'General case' 0 N--CA 1.477 0.916 0 CA-C-O 122.783 1.278 . . . . 0.0 109.67 -178.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.455 ' C ' ' H ' ' A' ' 114' ' ' CYS . 38.5 mt -91.65 160.06 15.56 Favored 'General case' 0 C--N 1.286 -2.192 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.133 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -70.0 26.96 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.477 1.111 . . . . 0.0 112.753 -177.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.455 ' H ' ' C ' ' A' ' 112' ' ' LEU . 85.2 m -157.66 158.81 36.15 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 -173.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.7 p -150.99 130.41 12.9 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 48.5 mt . . . . . 0 C--N 1.309 -1.153 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -178.119 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 63.1 m . . . . . 0 N--CA 1.435 -1.205 0 CA-C-O 120.88 0.372 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.3 p -79.43 161.29 26.22 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.825 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.423 ' HD3' ' N ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -88.11 66.44 8.54 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.725 0.774 . . . . 0.0 109.312 177.285 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 64.8 p -138.57 160.16 40.29 Favored 'General case' 0 N--CA 1.42 -1.967 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.0 mm -128.77 112.85 18.98 Favored Pre-proline 0 C--N 1.302 -1.488 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 176.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -72.62 154.2 98.89 Favored 'Cis proline' 0 CA--C 1.547 1.139 0 C-N-CA 123.716 -1.368 . . . . 0.0 112.228 -0.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.88 150.85 30.76 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 122.264 1.976 . . . . 0.0 113.022 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -98.6 113.07 32.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 105.674 -1.972 . . . . 0.0 105.674 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 80.9 m . . . . . 0 C--N 1.3 -1.578 0 CA-C-O 121.592 0.711 . . . . 0.0 111.963 -177.042 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 32.8 m . . . . . 0 N--CA 1.423 -1.776 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -100.51 110.17 22.33 Favored 'General case' 0 N--CA 1.414 -2.271 0 C-N-CA 118.165 -1.414 . . . . 0.0 108.817 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 mp -111.92 137.58 44.06 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.899 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 178.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.488 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 13.9 ptp180 -67.25 116.55 8.15 Favored 'General case' 0 N--CA 1.417 -2.111 0 CA-C-O 121.783 0.802 . . . . 0.0 109.335 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.65 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -67.69 -13.75 17.28 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.958 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.257 -174.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -77.43 -16.55 58.74 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.637 -178.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.1 pt20 -85.92 -20.31 29.19 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 119.116 -1.034 . . . . 0.0 109.29 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.475 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.5 mm? -91.54 -2.9 57.01 Favored 'General case' 0 CA--C 1.483 -1.607 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.52 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.547 ' HA ' HE21 ' A' ' 33' ' ' GLN . 36.2 t-20 -51.38 -35.4 38.6 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.58 -1.191 . . . . 0.0 110.959 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 t-160 -69.76 -54.42 13.77 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.43 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.7 OUTLIER -54.08 -52.21 61.67 Favored 'General case' 0 C--O 1.22 -0.487 0 O-C-N 123.737 0.648 . . . . 0.0 109.92 178.112 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.547 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.2 tt0 -50.31 -60.06 3.35 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.053 0.941 . . . . 0.0 112.44 177.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.9 ptt? -68.13 -39.54 82.68 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.682 -172.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -70.9 -26.26 63.14 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.282 -175.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 90.6 mt -87.62 -27.73 22.32 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.543 ' HA ' HG13 ' A' ' 96' ' ' VAL . 39.9 p -86.01 -22.02 27.5 Favored 'General case' 0 N--CA 1.422 -1.836 0 C-N-CA 118.032 -1.467 . . . . 0.0 111.787 179.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.9 p -90.89 148.07 22.72 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.414 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 . . . . . 0 N--CA 1.417 -2.119 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.927 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 . . . . . 0 C--O 1.209 -1.047 0 CA-C-O 120.651 0.262 . . . . 0.0 111.423 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -77.91 -43.07 31.13 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.4 m -56.84 -34.6 67.92 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 123.655 0.597 . . . . 0.0 110.123 177.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 50.5 mt -79.75 -56.14 4.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.191 177.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 22.7 t -58.97 -49.27 78.49 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 124.186 0.994 . . . . 0.0 111.846 -175.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.498 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.7 t -58.99 -34.39 71.78 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 122.838 0.455 . . . . 0.0 110.651 177.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -77.53 -23.49 50.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.603 0.716 . . . . 0.0 110.852 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -83.17 -47.88 11.12 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.514 178.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.501 HD22 HD11 ' A' ' 75' ' ' ILE . 3.7 pp -66.48 -31.57 72.4 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.425 0.631 . . . . 0.0 111.014 -177.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.53 -14.6 63.12 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.134 -177.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -77.25 -22.91 51.45 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.453 0.644 . . . . 0.0 109.312 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.2 t -74.78 161.73 4.72 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.088 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.586 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 38.3 mt-10 -53.46 144.01 17.98 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -55.54 -31.24 61.95 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.99 0.916 . . . . 0.0 112.087 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.576 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.9 pt20 -84.94 -5.08 59.35 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.744 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.576 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 61.5 m -125.61 -6.27 6.93 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.991 -175.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.586 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 99.0 mt-30 -61.97 -41.88 98.51 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.433 0.635 . . . . 0.0 109.93 177.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.456 ' HA ' HG12 ' A' ' 75' ' ' ILE . 6.0 p -78.28 -23.55 47.17 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.329 177.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.432 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 14.7 mm-40 -72.0 -30.96 65.76 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.269 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.478 ' HA ' ' HG3' ' A' ' 77' ' ' GLN . . . -60.77 -24.27 65.64 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.267 176.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.609 HG21 ' HD3' ' A' ' 107' ' ' PRO . 32.6 mm -74.31 -29.97 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.683 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -71.54 -39.19 70.85 Favored 'General case' 0 CA--C 1.489 -1.383 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 -176.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.514 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 44.0 mm-40 -56.16 -46.75 79.19 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 112.286 -2.234 . . . . 0.0 109.075 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.475 HG22 ' HB3' ' A' ' 29' ' ' LEU . 12.2 t -57.89 -46.25 87.47 Favored 'Isoleucine or valine' 0 C--N 1.354 0.786 0 O-C-N 124.297 0.998 . . . . 0.0 109.667 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 75' ' ' ILE . 23.6 t -67.49 -41.3 85.84 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.813 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.898 -173.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -60.83 -52.83 63.42 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.107 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.65 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.1 pt20 -68.89 -37.27 78.9 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -176.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.62 -37.14 73.77 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 120.903 0.382 . . . . 0.0 111.508 -177.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -75.72 -38.43 58.55 Favored 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.233 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.499 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -67.34 -33.17 74.69 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 120.593 0.235 . . . . 0.0 111.07 -177.197 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.443 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 2.2 pt20 -72.2 -29.82 64.35 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.073 0.463 . . . . 0.0 110.769 -176.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.525 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.2 mm? -87.14 -33.11 19.53 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.534 0.683 . . . . 0.0 111.454 175.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -63.15 -36.5 83.82 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.256 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -81.99 -6.98 59.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.006 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -92.06 -133.08 5.97 Favored Glycine 0 N--CA 1.429 -1.827 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.161 -177.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -104.83 -18.95 14.05 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 120.891 0.377 . . . . 0.0 111.098 -176.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 154.61 -141.57 8.3 Favored Glycine 0 CA--C 1.477 -2.343 0 N-CA-C 109.159 -1.576 . . . . 0.0 109.159 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.404 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 96.06 -24.44 29.98 Favored Glycine 0 N--CA 1.424 -2.112 0 C-N-CA 120.358 -0.925 . . . . 0.0 113.267 176.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -54.05 -31.52 51.76 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -77.11 -35.17 56.57 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.327 179.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.404 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 3.7 pt20 -83.99 -43.54 15.07 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.61 0.719 . . . . 0.0 109.68 -177.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.543 HG13 ' HA ' ' A' ' 37' ' ' THR . 95.4 t -63.04 -23.15 32.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.507 177.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -46.48 -43.73 16.94 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.675 0.79 . . . . 0.0 112.936 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -69.4 -17.94 63.71 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.098 0.475 . . . . 0.0 111.865 -177.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.419 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 5.9 tpt -102.06 -47.38 4.57 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.143 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.5 p -64.73 -24.03 34.7 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.692 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.468 ' HG3' ' N ' ' A' ' 102' ' ' LYS . 34.9 pttt -59.23 -26.96 65.32 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.778 -0.576 . . . . 0.0 110.711 173.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.468 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 26.0 mtpp -65.02 -28.71 69.68 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.411 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -61.43 -43.49 98.78 Favored 'General case' 0 C--O 1.197 -1.659 0 O-C-N 123.931 0.769 . . . . 0.0 108.959 174.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -70.67 -16.89 62.84 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.197 -178.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 27.3 mtm -91.39 -13.38 32.52 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.095 -0.378 . . . . 0.0 111.29 177.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.51 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 95.7 mt -50.64 -45.35 85.62 Favored Pre-proline 0 CA--C 1.543 0.698 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.609 ' HD3' HG21 ' A' ' 75' ' ' ILE . 16.0 Cg_endo -58.25 -24.54 67.96 Favored 'Trans proline' 0 C--N 1.367 1.53 0 C-N-CA 122.172 1.915 . . . . 0.0 112.86 176.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -85.62 -44.06 12.94 Favored 'General case' 0 N--CA 1.413 -2.307 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -73.21 -35.86 66.39 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.315 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 25.0 t -90.05 -3.83 57.73 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-O 121.331 0.586 . . . . 0.0 109.797 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 61.7 t30 62.37 50.86 3.57 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 122.736 1.255 . . . . 0.0 110.853 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.435 HD21 HD11 ' A' ' 63' ' ' LEU . 66.3 mt -89.54 158.61 17.59 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.712 -178.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -80.3 43.79 0.65 Allowed 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 124.067 0.947 . . . . 0.0 112.06 -174.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 59.5 m -159.16 162.63 36.4 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.4 p -146.32 140.71 26.64 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 73.0 mt . . . . . 0 C--N 1.307 -1.262 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.48 -178.51 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 21.5 m . . . . . 0 N--CA 1.425 -1.677 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.4 p -78.58 146.16 34.36 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 175.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -87.82 69.82 9.54 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.676 0.75 . . . . 0.0 109.358 177.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.8 t -146.85 171.47 15.15 Favored 'General case' 0 N--CA 1.418 -2.074 0 N-CA-C 106.7 -1.592 . . . . 0.0 106.7 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 37.9 mm -128.84 119.83 20.21 Favored Pre-proline 0 C--N 1.305 -1.362 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -71.72 146.91 86.89 Favored 'Cis proline' 0 C--O 1.249 1.049 0 C-N-CA 123.751 -1.354 . . . . 0.0 111.645 -1.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -73.97 139.66 27.48 Favored 'Trans proline' 0 N--CA 1.445 -1.353 0 C-N-CA 122.252 1.968 . . . . 0.0 111.347 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.3 mm -106.18 115.54 48.05 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.8 t . . . . . 0 C--N 1.298 -1.644 0 C-N-CA 119.431 -0.908 . . . . 0.0 111.028 -176.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 64.0 m . . . . . 0 N--CA 1.417 -2.117 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -101.7 121.96 43.02 Favored 'General case' 0 N--CA 1.417 -2.124 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 173.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mp -122.26 134.41 65.58 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.395 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 -178.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.539 ' HG2' HE21 ' A' ' 28' ' ' GLN . 14.1 ptp180 -66.75 121.98 16.64 Favored 'General case' 0 N--CA 1.426 -1.655 0 O-C-N 123.913 0.758 . . . . 0.0 110.203 -173.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -64.13 -17.13 20.2 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.267 -175.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -75.94 -13.62 60.25 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.219 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.539 HE21 ' HG2' ' A' ' 25' ' ' ARG . 5.0 pt20 -96.46 -10.53 27.25 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.124 178.07 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.436 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.9 mm? -98.7 4.95 47.93 Favored 'General case' 0 CA--C 1.488 -1.42 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.18 176.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.502 ' O ' ' HG2' ' A' ' 34' ' ' MET . 7.8 t30 -50.57 -36.6 35.39 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.27 -1.332 . . . . 0.0 113.099 -179.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -72.23 -53.61 12.06 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -178.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -54.72 -51.36 65.84 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 124.493 1.121 . . . . 0.0 108.809 -178.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -52.25 -56.03 17.39 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 124.201 1.001 . . . . 0.0 112.792 176.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.502 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 15.6 ptp -67.88 -43.63 78.91 Favored 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 119.849 -0.74 . . . . 0.0 112.788 -175.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -65.29 -25.34 67.59 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 99' ' ' MET . 93.1 mt -85.53 -32.54 22.13 Favored 'General case' 0 C--O 1.209 -1.076 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.809 175.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.548 ' HA ' HG13 ' A' ' 96' ' ' VAL . 40.7 p -86.43 -21.13 27.26 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 118.645 -1.222 . . . . 0.0 112.621 -177.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.5 m -89.6 121.11 31.48 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 113.037 0.755 . . . . 0.0 113.037 -177.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 . . . . . 0 C--N 1.29 -2.019 0 N-CA-C 103.436 -2.801 . . . . 0.0 103.436 165.907 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.204 -1.309 0 N-CA-C 111.433 0.16 . . . . 0.0 111.433 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -81.1 -44.94 17.21 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.1 m -56.99 -32.09 65.76 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 124.052 0.845 . . . . 0.0 109.671 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 54.7 mt -87.83 -49.52 7.05 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.213 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 52.5 t -61.09 -49.77 75.96 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.294 0.237 . . . . 0.0 111.383 -179.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.525 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 53.1 t -58.78 -32.27 69.16 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.581 0.352 . . . . 0.0 110.586 178.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.404 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 47.8 t30 -80.4 -26.04 38.74 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.489 0.661 . . . . 0.0 110.687 -177.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -82.85 -46.13 13.41 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.281 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.651 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -67.36 -32.45 73.38 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.554 -177.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.401 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 11.2 pt20 -70.85 -9.82 58.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.781 -178.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 12.9 mm-40 -78.67 -17.69 55.56 Favored 'General case' 0 C--O 1.247 0.935 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 176.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 8.4 t -85.23 162.48 2.9 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 175.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 2.5 mm-40 -49.89 144.62 6.33 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 124.155 0.982 . . . . 0.0 112.405 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -58.63 -33.51 70.14 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.316 0.579 . . . . 0.0 111.599 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -79.61 -11.49 59.87 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.073 -178.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 62.6 m -116.47 -9.49 11.43 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.929 -175.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 71.7 mt-30 -57.45 -49.37 76.47 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.387 0.675 . . . . 0.0 112.229 178.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.44 ' HA ' HG12 ' A' ' 75' ' ' ILE . 25.4 p -76.57 -23.7 53.52 Favored 'General case' 0 CA--C 1.499 -1.012 0 C-N-CA 119.494 -0.882 . . . . 0.0 111.841 177.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 15.0 mm-40 -66.56 -35.2 79.64 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 178.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.489 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.49 -26.66 66.98 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.372 0.669 . . . . 0.0 111.185 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.651 HD11 HD22 ' A' ' 63' ' ' LEU . 19.8 mm -72.94 -26.45 23.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.341 0.591 . . . . 0.0 109.537 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -75.88 -38.87 57.42 Favored 'General case' 0 CA--C 1.495 -1.152 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 -174.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 73' ' ' GLU . 9.4 mm100 -58.09 -44.61 87.72 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 112.335 -2.212 . . . . 0.0 108.996 178.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.4 t -56.63 -46.38 82.76 Favored 'Isoleucine or valine' 0 C--N 1.359 0.987 0 O-C-N 124.428 1.08 . . . . 0.0 109.601 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 75' ' ' ILE . 41.7 t -65.9 -47.32 85.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -175.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.14 -40.62 86.07 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.297 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -82.02 -31.45 30.98 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.266 0.555 . . . . 0.0 111.275 -178.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.472 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -77.83 -31.23 51.51 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.021 0.439 . . . . 0.0 111.877 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -80.33 -33.75 37.19 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -33.5 63.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.382 -176.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.44 ' HG3' HD22 ' A' ' 86' ' ' LEU . 15.7 pt20 -67.4 -32.52 73.47 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.125 0.488 . . . . 0.0 110.416 -178.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.5 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.0 mm? -84.29 -29.21 26.58 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.993 177.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -66.91 -38.35 86.05 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.423 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -79.41 -4.64 52.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.447 0.641 . . . . 0.0 111.084 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -95.5 -133.96 7.59 Favored Glycine 0 N--CA 1.426 -2.021 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -92.13 -49.64 6.09 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.633 0.73 . . . . 0.0 109.726 -178.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.417 ' O ' HD12 ' A' ' 86' ' ' LEU . . . 178.11 -152.7 11.92 Favored Glycine 0 CA--C 1.484 -1.861 0 N-CA-C 107.348 -2.301 . . . . 0.0 107.348 -176.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.4 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 111.53 -23.69 17.25 Favored Glycine 0 C--O 1.201 -1.925 0 C-N-CA 119.975 -1.107 . . . . 0.0 111.872 178.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 48.1 mt-30 -49.96 -34.65 21.5 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 124.297 1.039 . . . . 0.0 112.376 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -75.46 -40.83 56.95 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.554 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 20.8 pt20 -80.08 -45.13 18.81 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-O 121.231 0.539 . . . . 0.0 109.67 -175.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.548 HG13 ' HA ' ' A' ' 37' ' ' THR . 88.1 t -63.04 -22.76 31.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 C-N-CA 124.893 1.277 . . . . 0.0 110.759 177.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.422 ' HA ' HG12 ' A' ' 100' ' ' VAL . 28.6 tt0 -54.25 -35.18 62.22 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.23 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.554 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 10.2 pt20 -69.41 -17.45 63.66 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.033 0.444 . . . . 0.0 111.199 -178.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.421 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 2.9 tpt -103.2 -44.03 5.3 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -177.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.422 HG12 ' HA ' ' A' ' 97' ' ' GLN . 9.2 p -66.82 -23.71 31.48 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 CA-C-O 121.079 0.466 . . . . 0.0 110.972 177.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -21.57 66.6 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 121.867 -0.52 . . . . 0.0 111.278 175.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -67.12 -28.07 67.85 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -68.93 -25.42 64.57 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-O 121.457 0.646 . . . . 0.0 110.131 176.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -70.71 -25.17 62.83 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 122.014 0.912 . . . . 0.0 108.883 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 38.8 mtp -92.3 -14.67 28.47 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.491 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.451 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.2 OUTLIER -52.07 -48.46 88.5 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 124.491 1.116 . . . . 0.0 111.305 -177.553 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 18.6 Cg_endo -59.28 -23.18 68.65 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 121.581 1.521 . . . . 0.0 113.494 177.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -89.19 -40.31 12.96 Favored 'General case' 0 N--CA 1.416 -2.139 0 C-N-CA 119.861 -0.735 . . . . 0.0 110.489 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -66.56 -41.73 88.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.276 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.409 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 30.3 t -88.49 -6.02 57.87 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.283 -176.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 60.56 61.45 1.73 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 123.116 1.436 . . . . 0.0 110.616 -178.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.451 HD21 HD11 ' A' ' 63' ' ' LEU . 54.8 mt -102.34 158.46 16.18 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 113.472 -1.695 . . . . 0.0 109.536 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -78.87 49.79 0.95 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.002 0.921 . . . . 0.0 111.391 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.441 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 18.2 m -158.19 159.08 35.73 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 123.939 0.896 . . . . 0.0 109.99 -176.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.5 p -147.78 116.83 6.82 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 176.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 72.0 mt . . . . . 0 C--N 1.305 -1.33 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 -176.387 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 81.0 m . . . . . 0 N--CA 1.433 -1.307 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.4 p -74.37 160.85 30.48 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -94.3 71.91 3.85 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 120.112 -0.635 . . . . 0.0 110.707 -178.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.4 t -152.06 167.39 28.61 Favored 'General case' 0 N--CA 1.428 -1.53 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.5 mt -129.05 118.89 19.56 Favored Pre-proline 0 C--N 1.311 -1.104 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.95 148.41 90.73 Favored 'Cis proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.711 -1.37 . . . . 0.0 112.591 0.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -74.2 143.98 32.73 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.36 2.04 . . . . 0.0 112.555 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.6 mm -96.24 115.27 35.1 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 176.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 76.8 m . . . . . 0 C--N 1.291 -1.965 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -174.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.0 m . . . . . 0 N--CA 1.428 -1.562 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -106.75 114.38 28.44 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-O 122.196 0.998 . . . . 0.0 109.252 175.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 mp -113.45 128.87 70.07 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.551 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 -177.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.561 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.6 ptp180 -67.29 124.2 22.46 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-O 121.467 0.651 . . . . 0.0 111.609 -174.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.73 -19.74 21.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.539 -176.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -76.33 -11.71 59.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.314 -178.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 3.4 pt20 -98.63 -10.47 23.28 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 119.616 -0.834 . . . . 0.0 110.575 178.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -105.94 3.83 28.87 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.556 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 34' ' ' MET . 3.7 t-20 -57.4 -34.81 69.26 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.492 0.495 . . . . 0.0 111.528 -176.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -69.13 -53.83 18.12 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.17 -52.57 62.89 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.578 -1.192 . . . . 0.0 108.46 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -51.16 -60.77 2.75 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 125.022 1.329 . . . . 0.0 112.415 176.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.498 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.6 ptm -66.21 -39.61 89.74 Favored 'General case' 0 C--O 1.208 -1.108 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -173.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.415 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 2.5 t-80 -68.47 -27.08 65.84 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.543 -175.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.8 mt -82.97 -34.74 26.35 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.578 176.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.465 ' HA ' HG13 ' A' ' 96' ' ' VAL . 41.4 p -82.52 -21.68 35.32 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 118.447 -1.301 . . . . 0.0 112.007 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -90.15 121.73 32.46 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.682 -178.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 . . . . . 0 C--N 1.289 -2.061 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 168.414 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.415 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER . . . . . 0 C--O 1.216 -0.663 0 CA-C-O 120.988 0.423 . . . . 0.0 110.972 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -80.5 -41.86 23.53 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 179.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.4 m -57.83 -28.99 64.58 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.374 0.606 . . . . 0.0 110.312 176.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 60.1 mt -86.82 -55.73 3.72 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.801 178.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 51.9 t -59.57 -48.16 82.74 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.291 0.636 . . . . 0.0 111.827 -177.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.56 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 24.9 t -60.49 -33.64 72.89 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 122.835 0.454 . . . . 0.0 110.583 178.351 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.425 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 3.2 t-20 -78.31 -23.85 46.93 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.803 0.811 . . . . 0.0 110.035 -177.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -82.1 -47.93 11.97 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.774 178.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.56 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.8 pp -68.04 -30.71 69.99 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.508 -176.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.425 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 16.9 pt20 -69.05 -15.28 63.42 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.19 -176.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -82.42 -18.36 42.14 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.393 0.616 . . . . 0.0 110.306 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.418 HG12 ' HB2' ' A' ' 70' ' ' CYS . 12.0 t -76.76 163.27 3.97 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.513 ' HB2' ' SG ' ' A' ' 70' ' ' CYS . 46.0 mt-10 -47.73 147.48 1.88 Allowed 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 123.545 0.738 . . . . 0.0 112.295 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.534 ' HB2' HE22 ' A' ' 113' ' ' GLN . 22.0 ptmt -50.83 -38.62 50.02 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.068 0.947 . . . . 0.0 112.874 -176.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.517 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 4.1 pt20 -87.6 -19.55 27.64 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.504 0.669 . . . . 0.0 110.666 -177.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.517 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 44.6 m -96.97 -9.1 28.95 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.152 -171.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.444 ' HB3' HD22 ' A' ' 112' ' ' LEU . 47.3 mt-30 -57.11 -46.91 82.23 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-O 121.339 0.59 . . . . 0.0 109.844 175.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.425 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.5 p -76.87 -23.6 52.62 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.541 0.686 . . . . 0.0 111.546 179.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -72.87 -30.52 64.03 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.425 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.553 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -62.44 -27.42 69.1 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.398 176.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.526 HD11 HD22 ' A' ' 63' ' ' LEU . 32.4 mm -70.21 -27.69 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.528 -179.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -74.78 -41.78 59.38 Favored 'General case' 0 CA--C 1.5 -0.963 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 -176.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.436 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 50.2 mm-40 -59.05 -42.33 90.04 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 112.227 -2.26 . . . . 0.0 110.374 -179.198 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 74' ' ' ALA . 30.5 t -60.39 -43.95 95.02 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 75' ' ' ILE . 48.0 t -64.4 -47.29 90.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.836 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -177.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.63 -59.46 4.81 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.505 -179.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 9.5 pt20 -66.41 -30.24 70.56 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 120.931 0.396 . . . . 0.0 112.024 -175.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.3 -40.45 62.25 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 121.019 -0.273 . . . . 0.0 110.905 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -76.67 -36.94 57.0 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 119.794 -0.762 . . . . 0.0 110.646 -177.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.25 -26.46 62.91 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.618 -0.265 . . . . 0.0 110.869 -177.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -77.63 -30.28 52.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.493 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.573 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.0 mm? -86.18 -40.81 15.24 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.809 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.44 -31.76 70.73 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.629 0.772 . . . . 0.0 112.12 -177.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -77.55 -12.9 60.01 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.782 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -129.09 -100.83 0.97 Allowed Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 119.766 -1.207 . . . . 0.0 113.894 -175.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -71.2 -22.46 62.02 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -173.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.573 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 106.45 -88.54 0.56 Allowed Glycine 0 CA--C 1.472 -2.62 0 N-CA-C 107.917 -2.073 . . . . 0.0 107.917 -174.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.535 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 79.03 -46.56 2.97 Favored Glycine 0 C--O 1.189 -2.712 0 CA-C-O 118.98 -0.9 . . . . 0.0 114.559 171.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.468 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 52.3 mt-30 -46.45 -27.62 1.14 Allowed 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 125.001 1.321 . . . . 0.0 114.399 -175.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.438 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 7.8 pt20 -71.98 -46.56 56.87 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.783 0.325 . . . . 0.0 111.019 176.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.438 ' N ' ' HG3' ' A' ' 94' ' ' GLN . 28.9 pt20 -85.63 -47.17 10.09 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.632 0.73 . . . . 0.0 110.265 -176.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.465 HG13 ' HA ' ' A' ' 37' ' ' THR . 69.6 t -59.82 -22.56 24.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 C-N-CA 126.331 1.852 . . . . 0.0 110.679 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 8.6 tt0 -46.2 -44.73 16.34 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.085 0.554 . . . . 0.0 112.469 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -68.17 -18.74 64.69 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 3.9 tpt -100.33 -46.69 5.18 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -175.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.6 p -65.74 -25.85 37.44 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.194 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -24.54 67.93 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 121.93 -0.481 . . . . 0.0 111.335 176.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -65.46 -29.29 69.94 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 122.963 0.505 . . . . 0.0 110.447 178.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.548 ' HA ' HD13 ' A' ' 106' ' ' LEU . . . -58.26 -32.08 68.03 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-O 121.383 0.611 . . . . 0.0 110.556 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.56 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 37.1 mt-30 -68.78 -18.19 64.16 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.864 -178.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 42.9 mtp -91.56 -15.09 29.19 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 103' ' ' ALA . 6.4 mp -53.44 -49.07 90.42 Favored Pre-proline 0 C--N 1.319 -0.728 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 25.5 Cg_endo -61.64 -22.31 74.14 Favored 'Trans proline' 0 C--N 1.364 1.39 0 C-N-CA 121.567 1.511 . . . . 0.0 113.077 177.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -85.09 -41.59 15.59 Favored 'General case' 0 N--CA 1.411 -2.385 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -75.88 -42.45 49.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.858 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.449 ' SG ' HD11 ' A' ' 63' ' ' LEU . 8.9 t -84.09 -2.08 56.08 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.649 -174.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 60.69 61.47 1.69 Allowed 'General case' 0 CA--C 1.508 -0.67 0 CA-C-O 122.991 1.377 . . . . 0.0 109.84 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.444 HD22 ' HB3' ' A' ' 71' ' ' GLN . 39.4 mt -96.86 158.03 15.62 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 114.106 -1.406 . . . . 0.0 109.53 178.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.534 HE22 ' HB2' ' A' ' 68' ' ' LYS . 70.7 mt-30 -81.37 43.74 0.75 Allowed 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 122.071 0.938 . . . . 0.0 111.57 -174.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 98.3 m -163.39 149.98 12.18 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 104.637 -2.357 . . . . 0.0 104.637 -177.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.7 m -142.38 139.48 31.73 Favored 'General case' 0 C--N 1.288 -2.072 0 CA-C-N 118.632 0.651 . . . . 0.0 109.602 178.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.56 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 55.1 mt . . . . . 0 C--N 1.3 -1.55 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -178.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.475 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 72.2 m . . . . . 0 N--CA 1.442 -0.872 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.9 p -81.79 172.37 13.43 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 120.96 0.409 . . . . 0.0 110.151 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -97.6 81.99 3.01 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.614 0.721 . . . . 0.0 109.87 176.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.1 t -156.27 164.56 38.18 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.4 mm -129.18 116.62 18.83 Favored Pre-proline 0 C--N 1.305 -1.358 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 177.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -72.65 146.53 86.9 Favored 'Cis proline' 0 C--O 1.244 0.778 0 C-N-CA 124.024 -1.24 . . . . 0.0 111.33 -1.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.475 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 61.2 Cg_endo -70.57 153.25 65.31 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.498 2.132 . . . . 0.0 112.263 -177.241 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.1 mm -95.66 107.92 20.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 N-CA-C 106.46 -1.682 . . . . 0.0 106.46 176.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 80.9 m . . . . . 0 C--N 1.292 -1.899 0 CA-C-O 121.687 0.756 . . . . 0.0 112.144 -176.042 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 88.4 m . . . . . 0 N--CA 1.405 -2.678 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -106.43 94.07 4.94 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 122.11 0.957 . . . . 0.0 108.923 177.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.426 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.1 mp -98.05 130.62 46.55 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.606 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 -176.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.504 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 35.7 ptt180 -67.37 116.26 7.92 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-O 121.15 0.5 . . . . 0.0 111.402 -176.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.512 ' HB ' ' OE1' ' A' ' 81' ' ' GLN . 2.6 pp -60.82 -18.5 17.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.918 -176.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -73.67 -16.57 61.21 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.879 -178.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.9 pt20 -89.56 -15.86 31.95 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.482 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.7 mm? -97.67 6.37 48.07 Favored 'General case' 0 CA--C 1.485 -1.555 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.417 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -56.59 -34.15 66.89 Favored 'General case' 0 C--N 1.31 -1.136 0 O-C-N 124.068 0.855 . . . . 0.0 111.655 -178.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -70.58 -52.88 18.56 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.5 t -54.51 -50.57 67.52 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.759 -1.109 . . . . 0.0 108.166 -178.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -52.94 -58.49 6.77 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 124.401 1.08 . . . . 0.0 112.161 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -66.14 -39.04 89.55 Favored 'General case' 0 C--O 1.214 -0.788 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.607 -173.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.411 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 1.9 t-80 -73.05 -24.87 60.75 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.183 -175.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.429 ' O ' ' HB3' ' A' ' 99' ' ' MET . 95.7 mt -88.68 -23.44 23.0 Favored 'General case' 0 C--O 1.21 -0.979 0 C-N-CA 120.866 -0.333 . . . . 0.0 111.781 177.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.54 ' HA ' HG13 ' A' ' 96' ' ' VAL . 40.8 p -89.52 -21.61 22.83 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 118.382 -1.327 . . . . 0.0 111.338 178.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.5 m -90.29 152.96 20.81 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.846 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.413 ' CE2' ' HA ' ' A' ' 96' ' ' VAL . 52.4 m-85 . . . . . 0 C--N 1.302 -1.463 0 CA-C-O 121.806 0.812 . . . . 0.0 111.658 179.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.411 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 1.0 OUTLIER . . . . . 0 C--O 1.214 -0.778 0 CA-C-O 120.575 0.226 . . . . 0.0 111.433 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.0 tp -72.71 -54.27 9.42 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 174.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.5 m -57.94 -21.03 41.99 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.057 -179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.4 mt -90.19 -57.79 2.72 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.507 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 50.7 t -67.3 -50.4 60.42 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.119 0.568 . . . . 0.0 111.849 -176.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.594 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 43.4 t -61.71 -34.94 76.68 Favored 'General case' 0 CA--C 1.495 -1.14 0 CA-C-O 121.645 0.736 . . . . 0.0 109.262 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.488 ' O ' ' HG2' ' A' ' 64' ' ' GLN . 8.9 t30 -72.49 -35.93 68.28 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.631 178.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -76.06 -38.99 56.44 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-O 120.875 0.369 . . . . 0.0 111.376 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.667 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -71.83 -30.96 66.03 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 121.05 0.452 . . . . 0.0 110.617 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 24.2 pt20 -73.36 -4.27 32.36 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.189 0.518 . . . . 0.0 110.883 -177.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 7.9 mm-40 -84.94 -17.92 36.21 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 122.017 0.913 . . . . 0.0 108.578 176.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 10.2 t -85.07 164.19 2.56 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.471 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 4.9 mp0 -54.21 141.83 28.05 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 124.362 1.065 . . . . 0.0 110.616 177.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -57.6 -33.02 67.76 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -174.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.49 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 16.7 pt20 -80.22 -9.6 59.73 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.597 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.49 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.3 m -112.29 -9.57 13.87 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.215 -174.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 29.1 mt-30 -61.52 -40.24 93.92 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 121.123 0.487 . . . . 0.0 110.774 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 1.9 p -79.47 -27.24 41.58 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.317 0.579 . . . . 0.0 111.295 177.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 8.3 mm-40 -69.35 -33.46 73.13 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.483 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.06 -30.75 68.28 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.003 177.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.667 HD11 HD22 ' A' ' 63' ' ' LEU . 31.6 mm -66.94 -34.81 72.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.045 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -71.84 -40.07 69.3 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 -172.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 73' ' ' GLU . 7.2 mm100 -62.31 -37.12 84.35 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 112.579 -2.101 . . . . 0.0 109.439 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 74' ' ' ALA . 33.3 t -60.86 -48.48 88.71 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 75' ' ' ILE . 40.6 t -64.71 -46.82 91.09 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.724 -173.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -57.11 -49.67 75.19 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.614 -1.175 . . . . 0.0 112.129 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.512 ' OE1' ' HB ' ' A' ' 26' ' ' ILE . 28.8 pt20 -74.29 -30.33 62.04 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.359 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.402 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -75.18 -40.0 59.78 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 120.95 0.405 . . . . 0.0 111.095 -178.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.494 ' HB2' HE22 ' A' ' 93' ' ' GLN . 13.8 pt20 -72.92 -30.3 63.79 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.244 -177.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -75.91 -31.07 59.0 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.484 -179.147 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -75.66 -28.37 58.7 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.202 0.525 . . . . 0.0 111.62 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.492 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.4 mm? -84.6 -35.04 23.0 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.802 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -67.09 -32.22 73.23 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.13 0.491 . . . . 0.0 110.526 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -77.81 -11.04 59.85 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.875 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -89.24 -134.27 5.15 Favored Glycine 0 N--CA 1.424 -2.112 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -103.92 -49.78 3.55 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 120.756 0.312 . . . . 0.0 110.67 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -157.02 -148.18 5.01 Favored Glycine 0 N--CA 1.446 -0.637 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 100.53 -31.95 7.94 Favored Glycine 0 C--O 1.205 -1.663 0 CA-C-O 118.918 -0.934 . . . . 0.0 114.185 176.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.494 HE22 ' HB2' ' A' ' 83' ' ' GLN . 14.8 mm100 -48.95 -33.88 11.81 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -177.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -77.26 -37.17 53.6 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.039 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.564 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 29.2 pt20 -82.58 -44.46 15.81 Favored 'General case' 0 CA--C 1.497 -1.072 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.243 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.54 HG13 ' HA ' ' A' ' 37' ' ' THR . 95.8 t -58.55 -23.84 23.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.805 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -49.84 -44.11 49.3 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.912 178.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.564 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 3.7 pt20 -66.4 -18.24 65.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.854 0.359 . . . . 0.0 111.777 -177.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.429 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 6.4 tpt -101.37 -48.69 4.28 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -176.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.6 p -64.97 -24.21 35.05 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 CA-C-O 120.969 0.414 . . . . 0.0 111.499 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.432 ' HG3' ' N ' ' A' ' 102' ' ' LYS . 27.8 pttt -64.27 -23.77 67.42 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.918 -0.489 . . . . 0.0 110.578 176.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.432 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 24.6 mtpp -64.52 -32.71 74.46 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.566 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -64.0 -37.27 86.79 Favored 'General case' 0 C--O 1.196 -1.758 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.148 176.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -68.18 -18.62 64.65 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.226 0.536 . . . . 0.0 110.704 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 29.8 mtm -91.79 -14.8 29.24 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.566 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.6 OUTLIER -52.68 -44.32 95.09 Favored Pre-proline 0 N--CA 1.475 0.794 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -177.368 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.446 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 18.2 Cg_endo -60.34 -24.0 76.22 Favored 'Trans proline' 0 C--N 1.368 1.594 0 CA-C-N 120.935 1.37 . . . . 0.0 112.862 176.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -89.24 -37.67 14.8 Favored 'General case' 0 N--CA 1.408 -2.564 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.138 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -76.88 -34.09 57.79 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 12.4 t -91.97 -2.81 56.56 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 66.3 56.09 0.82 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 122.42 1.105 . . . . 0.0 109.696 178.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 107' ' ' PRO . 36.8 mt -101.48 157.1 17.06 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.102 -179.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -78.47 39.83 0.35 Allowed 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.876 0.87 . . . . 0.0 112.979 -173.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 86.3 m -154.8 158.48 39.51 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 -174.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 24.0 p -147.01 141.23 26.2 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 43.1 mm . . . . . 0 C--N 1.313 -1.012 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -179.898 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 60.6 m . . . . . 0 N--CA 1.408 -2.528 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.6 p -69.0 140.38 55.0 Favored 'General case' 0 N--CA 1.415 -2.214 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -84.86 69.13 10.71 Favored 'General case' 0 N--CA 1.421 -1.907 0 CA-C-O 121.602 0.715 . . . . 0.0 109.912 -175.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 t -148.5 171.79 15.53 Favored 'General case' 0 N--CA 1.417 -2.094 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 39.7 mm -128.45 118.21 20.17 Favored Pre-proline 0 C--N 1.303 -1.451 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -72.93 145.75 84.95 Favored 'Cis proline' 0 C--O 1.245 0.835 0 C-N-CA 123.877 -1.301 . . . . 0.0 112.668 1.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.446 ' HB3' HE22 ' A' ' 23' ' ' GLN . 71.2 Cg_endo -77.66 136.86 15.72 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 122.401 2.067 . . . . 0.0 112.154 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 42.9 mm -95.88 110.03 23.69 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.126 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 79.0 m . . . . . 0 C--N 1.308 -1.237 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -176.249 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 m . . . . . 0 N--CA 1.407 -2.615 0 CA-C-O 121.343 0.592 . . . . 0.0 109.907 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.446 HE22 ' HB3' ' A' ' 9' ' ' PRO . 3.9 pt20 -107.39 98.91 8.48 Favored 'General case' 0 C--N 1.276 -2.599 0 CA-C-O 122.144 0.973 . . . . 0.0 110.05 178.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.49 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 3.3 mp -105.29 138.99 27.73 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.813 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.623 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 16.8 ptt180 -68.51 117.41 10.24 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-O 121.171 0.51 . . . . 0.0 110.734 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.473 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -64.06 -13.53 13.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -176.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -77.36 -20.12 55.26 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.953 -178.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.623 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 14.9 pt20 -86.68 -15.91 38.16 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 119.884 -0.726 . . . . 0.0 109.382 -178.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.422 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.6 mm? -98.69 1.77 46.49 Favored 'General case' 0 CA--C 1.483 -1.623 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.79 177.217 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.513 ' HA ' HE21 ' A' ' 33' ' ' GLN . 27.7 t-20 -56.18 -32.96 64.82 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.898 -178.248 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -71.98 -52.9 14.87 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -177.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.416 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -54.72 -53.73 51.12 Favored 'General case' 0 CA--C 1.516 -0.353 0 O-C-N 123.682 0.613 . . . . 0.0 109.863 177.717 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.513 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.5 tt0 -49.42 -58.45 5.12 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 123.88 0.872 . . . . 0.0 112.63 176.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 11.8 ptp -65.96 -43.02 89.15 Favored 'General case' 0 CA--C 1.498 -1.055 0 C-N-CA 119.95 -0.7 . . . . 0.0 111.72 -175.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -67.7 -32.79 73.67 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 123.835 0.71 . . . . 0.0 110.825 -174.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.433 ' O ' ' HB3' ' A' ' 99' ' ' MET . 94.7 mt -78.46 -25.69 45.91 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-O 121.135 0.493 . . . . 0.0 111.171 178.046 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.561 HG21 HE21 ' A' ' 85' ' ' GLN . 68.0 p -91.69 -0.27 57.55 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.709 174.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.8 t -88.29 121.79 31.08 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.747 -175.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 . . . . . 0 N--CA 1.419 -2.017 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 169.099 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.441 -0.878 0 N-CA-C 111.838 0.311 . . . . 0.0 111.838 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -74.3 -43.82 55.21 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 177.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.2 m -61.66 -26.7 68.18 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.172 0.511 . . . . 0.0 110.783 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.3 mt -84.45 -53.37 5.48 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.397 177.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.5 t -65.4 -48.03 74.25 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.11 0.964 . . . . 0.0 111.16 -175.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.526 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.7 t -59.4 -33.3 71.04 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 122.97 0.508 . . . . 0.0 110.53 177.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -81.45 -23.43 37.48 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.712 0.767 . . . . 0.0 110.373 -178.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -83.13 -40.02 20.32 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.326 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.526 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.9 pp -67.5 -32.57 73.47 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 121.229 0.538 . . . . 0.0 110.522 -178.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.402 ' N ' HD12 ' A' ' 63' ' ' LEU . 16.4 pt20 -71.73 -7.25 46.94 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.656 -179.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -78.44 -22.31 47.83 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.747 0.784 . . . . 0.0 109.15 175.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.412 HG12 ' HB2' ' A' ' 70' ' ' CYS . 7.3 t -82.15 163.95 2.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.224 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -50.79 144.02 8.97 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.06 0.544 . . . . 0.0 110.579 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -62.19 -31.02 71.49 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -174.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -79.27 -10.57 59.85 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.545 0.688 . . . . 0.0 109.94 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.412 ' HB2' HG12 ' A' ' 66' ' ' VAL . 59.8 m -108.44 -10.48 15.28 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.943 -176.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -59.3 -40.61 86.74 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 178.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.515 ' HA ' HG12 ' A' ' 75' ' ' ILE . 8.7 p -83.93 -23.76 31.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 120.024 -0.67 . . . . 0.0 112.625 177.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.03 -36.03 82.15 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.697 0.76 . . . . 0.0 109.534 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.412 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -58.05 -29.54 65.45 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.265 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.576 HG21 ' HD3' ' A' ' 107' ' ' PRO . 28.5 mm -67.39 -35.79 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.09 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.377 -177.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.491 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 14.3 mmmm -69.05 -41.78 77.16 Favored 'General case' 0 CA--C 1.489 -1.385 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 -176.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.52 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 6.7 mt-30 -59.58 -39.35 83.81 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 113.689 -1.596 . . . . 0.0 111.425 -177.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.422 HG22 ' HB3' ' A' ' 29' ' ' LEU . 21.9 t -56.99 -44.6 82.96 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 O-C-N 123.743 0.652 . . . . 0.0 109.52 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 23.7 t -65.55 -48.55 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 CA-C-N 115.507 -0.769 . . . . 0.0 108.966 -176.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 43.1 mt-10 -55.71 -52.68 63.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.558 -1.201 . . . . 0.0 111.054 -177.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.52 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -71.29 -34.82 71.0 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -177.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.433 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -71.8 -37.64 70.36 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -177.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -76.95 -37.01 56.1 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.753 -179.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.432 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -69.38 -30.62 68.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.693 0.282 . . . . 0.0 111.309 -177.75 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.561 HE21 HG21 ' A' ' 37' ' ' THR . 24.4 pt20 -73.23 -31.47 64.16 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.141 0.496 . . . . 0.0 110.058 -177.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.1 mm? -82.7 -30.48 29.14 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.929 175.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -59.95 -40.1 87.86 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 123.36 0.664 . . . . 0.0 110.045 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -83.34 -5.75 59.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.701 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -94.58 -136.71 8.46 Favored Glycine 0 N--CA 1.418 -2.515 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.839 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -93.35 -19.02 21.74 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -175.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 148.17 -118.48 0.99 Allowed Glycine 0 CA--C 1.483 -1.924 0 N-CA-C 108.444 -1.863 . . . . 0.0 108.444 -175.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.56 -33.29 2.32 Favored Glycine 0 C--O 1.201 -1.93 0 CA-C-O 118.683 -1.065 . . . . 0.0 114.903 173.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -47.2 -33.08 4.97 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 -177.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -77.15 -37.0 54.83 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 120.797 0.332 . . . . 0.0 111.361 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.559 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 14.0 pt20 -85.59 -41.29 15.38 Favored 'General case' 0 C--O 1.212 -0.905 0 CA-C-O 121.452 0.644 . . . . 0.0 110.038 -177.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.467 HG11 HG22 ' A' ' 37' ' ' THR . 73.2 t -62.32 -23.48 32.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 C-N-CA 124.9 1.28 . . . . 0.0 111.045 176.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.448 ' HA ' HG12 ' A' ' 100' ' ' VAL . 35.5 tt0 -53.22 -37.32 61.94 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -177.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.6 pt20 -68.96 -18.6 64.1 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.89 0.376 . . . . 0.0 111.629 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.433 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 6.3 tpt -106.04 -45.13 4.42 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -174.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.448 HG12 ' HA ' ' A' ' 97' ' ' GLN . 14.8 p -62.72 -24.9 36.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.987 178.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -61.31 -22.97 65.37 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.862 -0.524 . . . . 0.0 111.173 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -67.58 -23.59 65.41 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 122.055 -0.403 . . . . 0.0 110.484 177.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.453 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -63.92 -34.92 79.05 Favored 'General case' 0 C--O 1.202 -1.429 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 174.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.481 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 44.7 mt-30 -75.39 -19.41 59.55 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.547 -179.095 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 48.2 mtt -86.92 -15.65 38.29 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.796 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.453 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 95.8 mt -52.37 -50.7 78.26 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -178.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.576 ' HD3' HG21 ' A' ' 75' ' ' ILE . 29.9 Cg_endo -62.96 -22.63 73.92 Favored 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 121.981 1.788 . . . . 0.0 112.524 178.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -83.72 -41.79 17.3 Favored 'General case' 0 N--CA 1.408 -2.546 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -176.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -81.41 -33.84 31.97 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.303 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.403 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 23.2 t -87.52 -1.51 57.98 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 53.34 60.22 3.87 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.146 1.378 . . . . 0.0 110.33 -179.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.462 HD21 HD11 ' A' ' 63' ' ' LEU . 79.5 mt -91.19 159.73 15.91 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-N 113.984 -1.462 . . . . 0.0 110.087 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -74.37 35.83 0.1 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.088 0.955 . . . . 0.0 112.221 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.426 ' H ' ' C ' ' A' ' 112' ' ' LEU . 57.3 m -157.62 149.27 21.95 Favored 'General case' 0 N--CA 1.417 -2.097 0 C-N-CA 125.702 1.601 . . . . 0.0 107.645 -175.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 4.5 p -134.59 131.96 38.48 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-O 120.99 0.424 . . . . 0.0 110.45 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.481 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 62.0 mt . . . . . 0 C--N 1.303 -1.451 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 178.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.467 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 61.8 m . . . . . 0 N--CA 1.432 -1.338 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.7 p -68.29 154.99 40.65 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 176.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -92.04 71.41 5.49 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.713 0.768 . . . . 0.0 109.246 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.0 t -147.12 169.71 18.71 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.4 mp -128.82 114.72 19.09 Favored Pre-proline 0 C--N 1.31 -1.138 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -75.53 147.09 87.63 Favored 'Cis proline' 0 C--O 1.237 0.426 0 C-N-CA 124.075 -1.219 . . . . 0.0 111.816 0.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.467 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 59.1 Cg_endo -72.74 141.46 33.98 Favored 'Trans proline' 0 N--CA 1.446 -1.293 0 C-N-CA 122.118 1.878 . . . . 0.0 111.941 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.7 mm -92.03 113.1 26.77 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 177.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 84.4 m . . . . . 0 C--N 1.284 -2.241 0 CA-C-O 121.373 0.606 . . . . 0.0 111.798 -174.271 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 56.0 m . . . . . 0 N--CA 1.406 -2.63 0 CA-C-O 121.316 0.579 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -96.68 102.43 14.21 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.967 0.889 . . . . 0.0 109.827 177.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.2 mp -109.91 138.53 37.13 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.262 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 178.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.486 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 39.8 ptt180 -79.03 122.19 25.88 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.536 -177.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.494 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.5 pp -62.7 -15.82 15.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -176.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -79.3 -15.89 57.24 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.927 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.1 pt20 -84.88 -27.93 26.35 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 119.265 -0.974 . . . . 0.0 108.531 178.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.462 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.6 mm? -87.31 1.74 52.32 Favored 'General case' 0 CA--C 1.481 -1.707 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.41 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.551 ' HA ' HE21 ' A' ' 33' ' ' GLN . 26.1 t-20 -53.26 -34.72 58.39 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.171 0.919 . . . . 0.0 110.591 -179.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -69.47 -53.41 19.34 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.856 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.8 OUTLIER -55.96 -51.69 66.8 Favored 'General case' 0 CA--C 1.503 -0.843 0 O-C-N 123.164 0.29 . . . . 0.0 110.309 178.442 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.551 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.7 tt0 -49.51 -55.74 12.27 Favored 'General case' 0 N--CA 1.426 -1.658 0 C-N-CA 123.667 0.787 . . . . 0.0 111.713 176.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.7 ptm -68.69 -38.09 80.05 Favored 'General case' 0 C--O 1.209 -1.028 0 C-N-CA 121.088 -0.245 . . . . 0.0 111.497 -176.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.856 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -70.89 -19.45 62.61 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.009 0.433 . . . . 0.0 111.158 -177.444 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 84.6 mt -88.5 -34.09 17.55 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.902 175.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.499 ' HB ' HD21 ' A' ' 86' ' ' LEU . 82.8 p -85.94 -21.04 28.11 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 119.344 -0.942 . . . . 0.0 111.211 -178.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -89.26 127.07 35.74 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.31 -178.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 . . . . . 0 C--N 1.299 -1.6 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 171.474 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.432 -1.329 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -75.31 -43.34 51.45 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.1 m -62.93 -25.71 68.46 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 123.658 0.599 . . . . 0.0 110.539 179.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 63.9 mt -84.83 -46.99 10.81 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.538 177.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -68.83 -50.63 48.41 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -176.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.506 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.2 t -58.27 -34.29 70.34 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 120.921 0.391 . . . . 0.0 110.169 178.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.421 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 9.7 t30 -76.22 -27.21 56.73 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.294 0.568 . . . . 0.0 111.506 -178.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -82.78 -41.81 18.71 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.796 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.571 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -70.64 -33.59 71.15 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.026 -178.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.421 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 3.4 pt20 -70.23 -14.97 62.85 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -176.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -79.74 -13.12 59.68 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.514 177.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 18.5 t -77.45 163.68 3.75 Favored 'Isoleucine or valine' 0 C--O 1.254 1.338 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 174.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -48.38 142.44 5.66 Favored 'General case' 0 CA--C 1.508 -0.654 0 C-N-CA 123.566 0.746 . . . . 0.0 110.782 176.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -61.17 -29.13 69.61 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -173.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.493 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 12.1 pt20 -80.31 -22.15 41.85 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-O 121.487 0.66 . . . . 0.0 109.96 178.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.493 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.4 m -99.77 -8.32 24.38 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.051 -172.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.5 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 76.1 mt-30 -60.93 -41.62 96.56 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.197 0.522 . . . . 0.0 110.869 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.42 ' HA ' HG12 ' A' ' 75' ' ' ILE . 5.3 p -78.31 -23.79 46.93 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.637 176.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.431 ' HA ' ' HG2' ' A' ' 76' ' ' LYS . 33.5 mm-40 -69.85 -30.79 68.36 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.935 177.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.446 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -62.7 -27.33 69.18 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.83 176.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.571 HD11 HD22 ' A' ' 63' ' ' LEU . 28.3 mm -73.36 -24.61 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.052 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.431 ' HG2' ' HA ' ' A' ' 73' ' ' GLU . 32.1 mmtp -74.49 -41.94 59.83 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 -176.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.467 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 64.7 mm-40 -56.12 -46.4 79.19 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 111.818 -2.446 . . . . 0.0 110.052 -179.38 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.462 HG22 ' HB3' ' A' ' 29' ' ' LEU . 22.9 t -54.94 -46.05 76.32 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 O-C-N 124.204 0.94 . . . . 0.0 110.152 -179.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 75' ' ' ILE . 26.0 t -67.78 -47.87 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.748 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -175.157 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.76 -45.85 85.33 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.104 -1.407 . . . . 0.0 111.945 -176.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.494 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.7 pt20 -77.29 -35.24 55.25 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 111.448 0.166 . . . . 0.0 111.448 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.409 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . . . -71.07 -38.87 72.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.884 0.373 . . . . 0.0 111.483 -177.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -72.35 -36.74 68.86 Favored 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.059 -178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.452 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -73.19 -32.47 64.84 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.761 -0.375 . . . . 0.0 111.231 -176.971 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.409 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 2.2 pt20 -71.9 -28.96 63.85 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.745 -176.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.502 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.2 mm? -85.27 -33.79 22.08 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.208 174.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -59.69 -35.73 75.08 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.552 0.741 . . . . 0.0 111.251 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 85' ' ' GLN . 29.6 pt20 -73.14 -11.72 60.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.137 -178.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -92.79 -126.69 4.15 Favored Glycine 0 N--CA 1.427 -1.96 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.016 -177.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -107.56 -22.4 12.54 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 120.929 0.395 . . . . 0.0 110.588 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 165.91 -128.78 1.82 Allowed Glycine 0 N--CA 1.434 -1.446 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -178.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.41 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 91.12 -28.86 7.52 Favored Glycine 0 C--O 1.202 -1.848 0 CA-C-O 119.549 -0.584 . . . . 0.0 112.479 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -52.76 -34.38 52.83 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 123.97 0.908 . . . . 0.0 111.714 -176.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.417 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 8.7 pt20 -75.57 -37.2 60.09 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.579 -179.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.569 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 13.1 pt20 -82.59 -45.71 14.24 Favored 'General case' 0 CA--C 1.498 -1.047 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.033 -177.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.502 HG21 ' HG ' ' A' ' 86' ' ' LEU . 96.0 t -57.66 -23.2 19.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 124.376 1.07 . . . . 0.0 110.725 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.482 ' HA ' HG12 ' A' ' 100' ' ' VAL . 53.0 tt0 -50.73 -40.36 54.18 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.803 0.441 . . . . 0.0 111.78 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.2 pt20 -68.76 -18.36 64.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.633 -176.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.453 ' O ' HD22 ' A' ' 36' ' ' LEU . 8.1 tpt -102.44 -48.55 4.12 Favored 'General case' 0 CA--C 1.485 -1.546 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -177.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.482 HG12 ' HA ' ' A' ' 97' ' ' GLN . 14.3 p -60.37 -24.27 30.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.747 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.81 -24.86 64.5 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.851 -0.531 . . . . 0.0 111.688 174.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -64.46 -30.39 71.43 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 120.773 0.321 . . . . 0.0 110.188 177.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.506 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -62.8 -28.79 70.24 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-O 121.418 0.628 . . . . 0.0 109.989 177.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -73.58 -18.6 61.04 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.163 -178.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 42.3 mtt -92.11 -18.28 23.78 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.808 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.9 OUTLIER -48.18 -48.28 64.74 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 123.884 0.873 . . . . 0.0 113.121 -178.326 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.491 ' HG2' HG12 ' A' ' 116' ' ' ILE . 22.5 Cg_exo -61.35 -26.09 81.08 Favored 'Trans proline' 0 C--N 1.359 1.104 0 C-N-CA 121.533 1.488 . . . . 0.0 113.355 178.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -89.17 -37.44 15.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.812 177.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -74.68 -34.17 62.61 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 12.8 t -93.75 -2.7 53.38 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 64.1 t30 57.27 63.64 1.83 Allowed 'General case' 0 C--O 1.244 0.785 0 CA-C-O 123.01 1.386 . . . . 0.0 110.885 -179.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.7 mt -100.36 157.88 16.3 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 113.039 -1.891 . . . . 0.0 109.401 178.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -78.22 31.25 0.18 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.747 1.219 . . . . 0.0 112.944 -173.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 91.8 m -150.3 167.84 25.81 Favored 'General case' 0 C--N 1.269 -2.923 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -174.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 69.6 m -150.79 133.72 15.93 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 175.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.491 HG12 ' HG2' ' A' ' 107' ' ' PRO . 46.1 mm . . . . . 0 C--O 1.263 1.764 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -177.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.9 m . . . . . 0 N--CA 1.425 -1.723 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.6 p -69.27 155.4 40.48 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.291 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -87.75 73.61 9.27 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 175.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.2 t -150.04 167.23 27.36 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.9 mm -128.49 118.79 20.25 Favored Pre-proline 0 C--N 1.306 -1.311 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.76 147.63 89.91 Favored 'Cis proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.763 -1.349 . . . . 0.0 111.876 -1.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.28 136.08 25.94 Favored 'Trans proline' 0 C--O 1.247 0.94 0 C-N-CA 122.184 1.923 . . . . 0.0 112.063 -178.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.8 mm -96.15 124.01 48.65 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 178.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.1 m . . . . . 0 C--N 1.29 -2.019 0 CA-C-O 121.579 0.704 . . . . 0.0 112.06 -175.555 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.6 m . . . . . 0 N--CA 1.405 -2.68 0 N-CA-C 110.116 -0.328 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -99.84 124.48 45.18 Favored 'General case' 0 N--CA 1.415 -2.193 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 173.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.429 HD11 ' HB2' ' A' ' 73' ' ' GLU . 4.1 mp -119.93 145.47 26.15 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -176.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.496 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 35.1 ptt180 -66.14 120.68 13.63 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-O 121.599 0.714 . . . . 0.0 110.06 -178.231 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.47 -14.99 19.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.261 0.553 . . . . 0.0 111.97 -175.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -75.53 -20.84 58.43 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.54 -177.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 6.8 pt20 -85.41 -34.95 21.59 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 119.334 -0.946 . . . . 0.0 109.828 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.423 HD11 ' HB1' ' A' ' 74' ' ' ALA . 2.0 mm? -79.54 -7.81 58.74 Favored 'General case' 0 CA--C 1.475 -1.921 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.21 -177.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.578 ' HA ' HE21 ' A' ' 33' ' ' GLN . 55.6 t30 -54.08 -33.82 58.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 124.246 0.966 . . . . 0.0 110.192 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -69.52 -57.63 4.98 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.449 ' HB3' HG11 ' A' ' 78' ' ' VAL . 0.7 OUTLIER -56.1 -47.5 77.95 Favored 'General case' 0 C--O 1.215 -0.718 0 O-C-N 123.909 0.756 . . . . 0.0 110.392 179.738 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.578 HE21 ' HA ' ' A' ' 30' ' ' ASN . 6.8 tt0 -52.76 -57.95 8.45 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 124.316 1.046 . . . . 0.0 111.842 176.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -67.41 -38.24 84.33 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.818 -175.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 -74.0 -28.74 61.6 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.3 mt -78.53 -24.33 45.76 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 120.176 -0.609 . . . . 0.0 110.757 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.509 ' HB ' HD21 ' A' ' 86' ' ' LEU . 73.6 p -89.87 -12.77 38.04 Favored 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 118.734 -1.186 . . . . 0.0 111.25 176.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.6 t -88.71 144.9 25.96 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.403 178.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 . . . . . 0 N--CA 1.438 -1.041 0 CA-C-O 121.247 0.546 . . . . 0.0 111.206 174.506 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.211 -0.971 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -82.5 -42.36 18.54 Favored 'General case' 0 CA--C 1.49 -1.357 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.3 m -60.42 -31.09 70.07 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.399 0.619 . . . . 0.0 109.93 178.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 44.9 mt -81.8 -53.13 6.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.116 177.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 25.3 t -59.13 -49.72 76.78 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 123.443 0.697 . . . . 0.0 111.731 -177.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.529 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.0 t -58.55 -35.56 72.52 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.45 0.643 . . . . 0.0 110.419 179.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -82.05 -23.69 35.71 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.874 0.845 . . . . 0.0 110.762 -176.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.401 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 64.6 tt0 -86.84 -38.63 16.62 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.7 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.562 HD22 HD11 ' A' ' 75' ' ' ILE . 4.1 pp -68.76 -32.33 72.01 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.11 0.481 . . . . 0.0 109.865 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.464 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 14.6 pt20 -68.61 -10.32 55.28 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.903 -178.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.42 -15.49 59.31 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.516 0.674 . . . . 0.0 109.223 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.6 t -86.49 163.37 2.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 174.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.512 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.6 mt-10 -49.38 143.05 6.88 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 122.938 0.495 . . . . 0.0 110.675 175.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -59.8 -32.46 70.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -175.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.514 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 27.8 pt20 -72.89 -24.01 60.79 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.612 0.72 . . . . 0.0 109.972 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.514 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.0 m -100.22 -9.14 22.75 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.047 -174.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.512 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 28.0 mt-30 -61.5 -39.17 90.0 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.894 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.415 ' HA ' HG12 ' A' ' 75' ' ' ILE . 11.0 p -83.55 -23.99 31.79 Favored 'General case' 0 CA--C 1.502 -0.874 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.692 177.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.429 ' HB2' HD11 ' A' ' 24' ' ' ILE . 7.0 mm-40 -66.03 -34.36 77.91 Favored 'General case' 0 C--O 1.248 1.024 0 CA-C-O 122.073 0.939 . . . . 0.0 108.763 178.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.423 ' HB1' HD11 ' A' ' 29' ' ' LEU . . . -61.21 -31.52 71.29 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.7 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.562 HD11 HD22 ' A' ' 63' ' ' LEU . 31.0 mm -69.62 -33.62 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.638 -176.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.541 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 30.7 mmtp -67.88 -41.15 83.22 Favored 'General case' 0 CA--C 1.487 -1.445 0 CA-C-N 115.234 -0.894 . . . . 0.0 108.871 -178.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 6.6 mt-30 -61.05 -36.37 79.41 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.161 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.449 HG11 ' HB3' ' A' ' 32' ' ' CYS . 23.6 t -57.8 -46.57 87.08 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.702 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 178.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 45.1 t -62.51 -45.49 98.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.359 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.541 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 35.6 mt-10 -57.87 -52.23 66.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.236 -177.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 3.5 pt20 -75.06 -31.95 61.4 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.102 -175.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.16 -37.34 58.07 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -177.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.43 HE21 ' HA ' ' A' ' 80' ' ' GLU . 29.0 pt20 -73.85 -32.86 63.86 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.575 -177.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.95 -32.28 59.45 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.578 -175.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -71.83 -27.49 62.94 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.246 0.546 . . . . 0.0 110.261 -178.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.509 HD21 ' HB ' ' A' ' 37' ' ' THR . 3.8 mm? -83.94 -35.11 24.26 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.988 174.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.536 ' HA ' HE21 ' A' ' 93' ' ' GLN . 29.6 tt0 -60.59 -33.5 72.83 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.515 0.726 . . . . 0.0 111.647 178.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -86.8 -1.55 57.86 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.258 0.551 . . . . 0.0 111.329 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -95.86 -144.83 17.72 Favored Glycine 0 N--CA 1.419 -2.434 0 CA-C-O 121.753 0.641 . . . . 0.0 113.023 -177.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -100.23 -41.28 7.16 Favored 'General case' 0 C--N 1.279 -2.458 0 CA-C-N 114.84 -0.68 . . . . 0.0 111.045 -174.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 179.69 -176.84 47.86 Favored Glycine 0 N--CA 1.418 -2.547 0 N-CA-C 108.919 -1.672 . . . . 0.0 108.919 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.481 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 119.66 -25.14 7.75 Favored Glycine 0 N--CA 1.408 -3.205 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.27 -177.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.536 HE21 ' HA ' ' A' ' 87' ' ' GLN . 19.4 mp0 -47.35 -40.3 17.02 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.931 0.892 . . . . 0.0 112.092 -178.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -77.11 -37.31 54.48 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.583 -176.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.663 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 4.1 pt20 -80.66 -43.52 20.29 Favored 'General case' 0 C--O 1.209 -1.065 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.147 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.428 HG21 ' HG ' ' A' ' 86' ' ' LEU . 69.0 t -61.06 -23.51 30.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 C-N-CA 124.594 1.158 . . . . 0.0 110.541 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -54.57 -37.62 65.69 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.873 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.663 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 30.0 pt20 -71.8 -18.35 62.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.866 0.365 . . . . 0.0 111.143 -178.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.2 tpt -96.78 -47.26 5.94 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 -176.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -62.45 -27.75 43.37 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.319 178.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.1 pptp? -63.85 -21.2 66.33 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.912 -0.492 . . . . 0.0 111.286 176.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -65.36 -28.82 69.55 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.383 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.43 -30.92 69.94 Favored 'General case' 0 C--O 1.207 -1.135 0 CA-C-O 121.186 0.517 . . . . 0.0 110.313 178.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.445 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 38.6 mt-30 -68.83 -19.31 64.26 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.253 0.549 . . . . 0.0 109.887 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 49.4 mtp -91.97 -19.94 21.89 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 7.0 mp -53.55 -47.5 96.2 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.59 -22.32 73.86 Favored 'Trans proline' 0 C--N 1.362 1.243 0 CA-C-N 120.74 1.3 . . . . 0.0 112.658 176.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -85.09 -49.5 8.21 Favored 'General case' 0 N--CA 1.411 -2.399 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -73.46 -38.92 65.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.062 -175.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.451 ' SG ' HD21 ' A' ' 112' ' ' LEU . 34.0 t -82.82 -0.83 49.78 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 63.12 40.71 8.75 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.886 1.274 . . . . 0.0 110.477 173.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.451 HD21 ' SG ' ' A' ' 110' ' ' CYS . 48.8 mt -80.97 159.55 24.87 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.314 -177.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -69.36 41.55 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 C-N-CA 125.062 1.345 . . . . 0.0 112.657 -176.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 56.7 m -158.06 146.13 18.67 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -176.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 40.1 m -134.03 119.25 18.74 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-O 121.062 0.458 . . . . 0.0 110.063 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.445 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 67.1 mt . . . . . 0 C--N 1.304 -1.404 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 74.3 m . . . . . 0 N--CA 1.433 -1.275 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.6 p -75.87 160.85 29.51 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 121.087 0.47 . . . . 0.0 110.357 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -91.29 66.33 5.56 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.8 t -152.44 172.35 16.65 Favored 'General case' 0 N--CA 1.421 -1.901 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -177.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.8 mm -128.35 118.29 20.31 Favored Pre-proline 0 C--N 1.313 -1.009 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 177.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.62 146.41 86.51 Favored 'Cis proline' 0 C--O 1.244 0.796 0 C-N-CA 123.817 -1.326 . . . . 0.0 111.608 0.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -68.45 126.82 14.71 Favored 'Trans proline' 0 N--CA 1.446 -1.304 0 C-N-CA 121.799 1.666 . . . . 0.0 110.126 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.4 mm -89.58 112.37 24.35 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.187 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -178.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 63.2 m . . . . . 0 C--N 1.287 -2.147 0 CA-C-O 121.581 0.705 . . . . 0.0 110.82 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.437 -1.083 0 CA-C-O 120.417 0.151 . . . . 0.0 111.273 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -106.73 116.82 32.58 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.867 0.842 . . . . 0.0 109.727 177.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.428 HG21 ' HB2' ' A' ' 74' ' ' ALA . 3.4 mp -120.49 132.58 69.71 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 -177.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.541 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 21.7 ptt180 -67.49 117.06 8.94 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 121.148 0.499 . . . . 0.0 111.484 -177.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.566 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.7 pp -61.98 -14.37 11.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -177.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -79.24 -17.33 54.97 Favored 'General case' 0 N--CA 1.423 -1.8 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.257 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.0 pt20 -79.98 -23.57 41.5 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.507 ' HB2' ' OE1' ' A' ' 81' ' ' GLN . 2.5 mm? -93.73 4.46 53.9 Favored 'General case' 0 CA--C 1.489 -1.381 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.048 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -55.02 -31.95 61.45 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 123.624 0.577 . . . . 0.0 111.595 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.424 ' O ' ' HB3' ' A' ' 35' ' ' HIS . 5.1 t60 -71.67 -53.11 14.63 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 107.84 -1.171 . . . . 0.0 107.84 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.51 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -55.86 -50.29 71.02 Favored 'General case' 0 C--N 1.314 -0.97 0 O-C-N 124.357 1.036 . . . . 0.0 109.188 -177.988 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -49.92 -58.26 5.79 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 125.148 1.379 . . . . 0.0 111.83 174.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.2 ptm -66.8 -37.88 85.41 Favored 'General case' 0 C--O 1.192 -1.972 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.03 -177.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.424 ' HB3' ' O ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -58.66 -33.87 70.58 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 123.555 0.742 . . . . 0.0 111.246 179.0 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 89.4 mt -81.48 -41.27 22.0 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.147 178.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.445 ' HA ' HG13 ' A' ' 96' ' ' VAL . 45.8 p -85.24 -21.33 29.13 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.108 -175.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.6 t -90.76 121.23 32.47 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.214 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 . . . . . 0 C--N 1.282 -2.355 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 170.801 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.535 0.372 0 CA-C-O 121.405 0.621 . . . . 0.0 112.431 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -86.21 -40.11 15.92 Favored 'General case' 0 CA--C 1.496 -1.111 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 -179.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 t -59.27 -24.0 62.86 Favored 'General case' 0 C--O 1.209 -1.054 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.693 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.6 mt -87.63 -56.04 3.52 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.769 177.521 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 27.4 t -57.88 -51.75 68.32 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.471 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 11.0 t -59.31 -33.42 71.08 Favored 'General case' 0 N--CA 1.428 -1.542 0 C-N-CA 124.197 0.999 . . . . 0.0 110.748 178.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 2.8 t-20 -81.25 -23.19 38.18 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.129 -176.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 21.2 tp60 -80.06 -46.38 16.65 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.28 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.56 ' O ' ' HG2' ' A' ' 71' ' ' GLN . 3.6 pp -69.14 -35.44 76.37 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.291 -175.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.478 ' NE2' HD22 ' A' ' 61' ' ' ASN . 11.1 pt20 -68.88 -17.38 63.97 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 122.991 0.516 . . . . 0.0 111.735 -175.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 63.6 mm-40 -83.61 -13.31 54.61 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 121.377 0.608 . . . . 0.0 109.713 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.3 t -79.63 162.68 3.77 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -50.52 141.59 12.06 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 123.492 0.717 . . . . 0.0 110.98 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.418 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 18.8 ptpt -57.83 -31.77 66.96 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -174.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.447 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 4.1 pt20 -82.11 -12.71 58.05 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.26 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.447 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 42.7 m -110.75 -12.6 14.28 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.584 -174.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.56 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 67.4 mt-30 -56.28 -46.47 79.73 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.434 0.694 . . . . 0.0 110.796 176.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.412 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.0 p -75.09 -23.86 58.05 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.324 0.583 . . . . 0.0 111.468 178.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 64.7 mm-40 -73.98 -29.52 62.02 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.402 0.62 . . . . 0.0 110.287 177.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.432 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -64.24 -23.13 67.2 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.586 176.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.533 HD11 HD22 ' A' ' 63' ' ' LEU . 35.2 mm -72.87 -27.75 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.362 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -73.03 -41.0 64.67 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 -175.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.47 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 12.1 mm100 -56.6 -47.95 78.49 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 111.676 -2.511 . . . . 0.0 110.133 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.462 HG22 ' HB3' ' A' ' 29' ' ' LEU . 20.0 t -56.23 -44.59 79.8 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 O-C-N 124.03 0.832 . . . . 0.0 109.771 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 75' ' ' ILE . 31.0 t -68.09 -42.34 85.01 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.686 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -174.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -61.95 -53.0 61.7 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.597 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.566 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.7 pt20 -71.55 -31.05 66.58 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.791 0.329 . . . . 0.0 111.852 -176.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.2 -40.97 64.32 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.881 -0.327 . . . . 0.0 110.954 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -70.55 -41.38 72.56 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.154 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.486 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -65.33 -35.99 82.67 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.299 -176.168 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.486 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 17.4 pt20 -71.94 -33.6 68.35 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.604 -174.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.505 HD12 ' HA3' ' A' ' 92' ' ' GLY . 2.7 mm? -84.46 -39.29 19.1 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.391 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -57.48 -41.28 80.37 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 123.804 0.842 . . . . 0.0 111.06 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 84' ' ' LYS . 4.2 pt20 -90.98 -8.67 48.55 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.322 0.582 . . . . 0.0 110.737 -178.081 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -89.9 -78.88 1.34 Allowed Glycine 0 N--CA 1.426 -1.996 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.846 -176.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -132.76 -12.54 2.96 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.74 -106.79 1.42 Allowed Glycine 0 C--N 1.285 -2.254 0 N-CA-C 106.865 -2.494 . . . . 0.0 106.865 -173.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.505 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 77.26 -37.29 1.55 Allowed Glycine 0 C--O 1.185 -2.908 0 CA-C-O 119.039 -0.867 . . . . 0.0 115.04 172.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.427 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 14.0 mm100 -52.29 -21.06 3.12 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -175.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -79.2 -39.72 32.56 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.084 0.469 . . . . 0.0 110.877 174.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -86.0 -38.95 17.37 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 121.625 0.726 . . . . 0.0 110.217 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.445 HG13 ' HA ' ' A' ' 37' ' ' THR . 72.2 t -69.71 -22.52 25.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.207 0 C-N-CA 125.631 1.572 . . . . 0.0 110.633 176.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.427 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 53.6 tt0 -45.91 -44.75 14.89 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -59.87 -28.13 67.27 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 123.069 0.548 . . . . 0.0 112.04 178.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.415 ' O ' HD22 ' A' ' 36' ' ' LEU . 5.2 tpt -96.59 -48.08 5.67 Favored 'General case' 0 CA--C 1.494 -1.206 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -174.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.2 p -60.38 -27.98 41.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.603 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -25.16 68.18 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.958 -0.464 . . . . 0.0 111.265 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -64.54 -25.58 68.04 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 122.661 0.384 . . . . 0.0 110.855 177.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.443 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -60.36 -36.26 77.59 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-O 121.495 0.664 . . . . 0.0 110.032 176.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -73.24 -16.51 61.4 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.74 0.781 . . . . 0.0 110.297 -177.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 54.3 mtp -92.67 -15.85 26.27 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.978 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.45 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 92.6 mt -55.1 -47.07 99.4 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.927 -177.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.471 ' HD3' HG21 ' A' ' 75' ' ' ILE . 12.3 Cg_endo -58.78 -22.28 60.95 Favored 'Trans proline' 0 C--N 1.366 1.497 0 C-N-CA 121.759 1.639 . . . . 0.0 113.127 175.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -84.82 -47.83 9.98 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -68.49 -47.41 67.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.1 -176.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 97.8 m -81.3 2.05 29.83 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 47.9 t30 53.58 64.48 1.83 Allowed 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 122.97 1.367 . . . . 0.0 110.697 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.422 HD21 HD11 ' A' ' 63' ' ' LEU . 62.9 mt -98.59 158.19 15.76 Favored 'General case' 0 C--N 1.275 -2.673 0 CA-C-N 113.396 -1.729 . . . . 0.0 108.659 -178.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -81.08 45.1 0.81 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.814 0.816 . . . . 0.0 111.068 -175.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 57.2 m -160.88 155.3 23.3 Favored 'General case' 0 C--N 1.285 -2.226 0 C-N-CA 125.722 1.609 . . . . 0.0 106.712 -176.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 41.5 m -150.32 136.76 18.88 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 38.0 mm . . . . . 0 C--N 1.309 -1.158 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.001 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 58.1 m . . . . . 0 N--CA 1.428 -1.55 0 CA-C-O 120.952 0.406 . . . . 0.0 110.607 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.6 p -82.53 166.1 19.57 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.781 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -90.55 76.98 6.51 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 175.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t -152.67 163.95 38.67 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.1 mm -128.79 115.91 19.26 Favored Pre-proline 0 C--N 1.305 -1.334 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 176.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.59 147.18 88.98 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.869 -1.305 . . . . 0.0 111.692 -1.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.85 140.16 45.46 Favored 'Trans proline' 0 C--O 1.247 0.959 0 C-N-CA 122.661 2.241 . . . . 0.0 111.789 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 40.3 mm -95.32 116.99 38.22 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 65.8 m . . . . . 0 C--N 1.284 -2.281 0 CA-C-O 121.462 0.649 . . . . 0.0 110.893 -177.948 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 86.3 m . . . . . 0 N--CA 1.415 -2.195 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -101.83 102.95 13.62 Favored 'General case' 0 N--CA 1.423 -1.81 0 CA-C-O 122.269 1.033 . . . . 0.0 109.2 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.516 HD11 ' HB2' ' A' ' 73' ' ' GLU . 3.1 mp -102.08 144.16 13.75 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.568 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -178.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.443 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.8 ptt180 -70.58 115.28 9.57 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.161 0.505 . . . . 0.0 110.736 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.415 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -65.64 -10.9 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.417 ' HG2' ' HB2' ' A' ' 25' ' ' ARG . 4.1 pt20 -78.08 -21.02 51.16 Favored 'General case' 0 N--CA 1.427 -1.609 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.098 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.447 ' HG3' HD22 ' A' ' 29' ' ' LEU . 1.0 OUTLIER -82.06 -26.54 33.63 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 119.492 -0.883 . . . . 0.0 108.813 -179.98 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.491 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.4 mm? -86.58 -1.7 57.87 Favored 'General case' 0 CA--C 1.487 -1.474 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.152 -178.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.573 ' O ' ' HG2' ' A' ' 34' ' ' MET . 8.2 t30 -51.65 -32.65 30.19 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 124.265 0.978 . . . . 0.0 111.692 179.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -70.31 -56.42 6.78 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.452 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -53.84 -53.28 54.67 Favored 'General case' 0 CA--C 1.507 -0.709 0 O-C-N 123.918 0.761 . . . . 0.0 110.052 178.717 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -47.88 -56.14 8.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.201 1.001 . . . . 0.0 112.283 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.573 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 14.3 ptp -70.66 -44.11 67.78 Favored 'General case' 0 C--O 1.202 -1.402 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.261 -176.11 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -68.28 -22.88 64.71 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -178.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 89.0 mt -81.7 -34.24 30.74 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.663 174.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.473 ' HA ' HG13 ' A' ' 96' ' ' VAL . 62.0 p -84.2 -22.16 31.0 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 117.84 -1.544 . . . . 0.0 112.212 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.6 p -90.69 145.95 24.41 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-O 121.735 0.779 . . . . 0.0 112.559 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 . . . . . 0 C--N 1.281 -2.392 0 N-CA-C 104.645 -2.354 . . . . 0.0 104.645 169.795 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 . . . . . 0 N--CA 1.426 -1.627 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -80.22 -42.69 22.79 Favored 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.3 m -59.82 -27.23 66.43 Favored 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.732 0.645 . . . . 0.0 110.718 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.0 mt -88.15 -51.17 5.93 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.775 176.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.7 t -59.72 -48.14 82.85 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.429 0.692 . . . . 0.0 111.895 -177.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.512 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 42.1 t -57.86 -35.94 71.65 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.269 0.557 . . . . 0.0 110.091 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.552 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 4.1 t-20 -76.56 -25.67 54.29 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.16 -176.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -85.57 -44.9 12.26 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.954 178.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.566 HD22 HD11 ' A' ' 75' ' ' ILE . 3.7 pp -66.26 -31.9 73.0 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.365 0.603 . . . . 0.0 110.24 -177.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.552 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 3.3 pt20 -71.97 -9.24 58.08 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.684 -178.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -78.29 -15.91 58.28 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.416 0.627 . . . . 0.0 109.819 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.0 t -84.05 161.61 3.22 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 174.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 33.7 mt-10 -49.31 142.2 7.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.287 0.635 . . . . 0.0 111.306 177.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.459 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 15.5 ptpt -56.38 -33.42 65.72 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -174.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.502 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.8 pt20 -77.57 -22.81 50.38 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 121.758 0.79 . . . . 0.0 110.176 -179.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.502 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 66.3 m -98.57 -13.15 20.56 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.672 -173.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 76.8 mt-30 -57.04 -40.69 77.25 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 123.234 0.614 . . . . 0.0 111.802 178.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.456 ' HA ' HG12 ' A' ' 75' ' ' ILE . 20.4 p -83.47 -24.06 31.95 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 119.409 -0.917 . . . . 0.0 111.981 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.516 ' HB2' HD11 ' A' ' 24' ' ' ILE . 9.4 mm-40 -64.92 -36.8 85.55 Favored 'General case' 0 CA--C 1.553 1.091 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 177.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.466 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -58.12 -31.79 67.52 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.093 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.566 HD11 HD22 ' A' ' 63' ' ' LEU . 28.2 mm -69.91 -32.6 52.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.322 -176.337 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.477 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 14.6 mmmm -68.92 -41.07 78.66 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 -178.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.489 ' NE2' ' HB ' ' A' ' 24' ' ' ILE . 5.9 mt-30 -61.01 -37.87 84.07 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 113.598 -1.637 . . . . 0.0 110.639 -179.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.491 HG22 ' HB3' ' A' ' 29' ' ' LEU . 40.3 t -55.91 -46.85 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 123.94 0.775 . . . . 0.0 109.233 178.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 38.4 t -62.95 -46.08 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.357 -175.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 38.6 mt-10 -56.88 -52.3 65.7 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.307 -178.093 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -73.33 -32.12 64.38 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.816 -176.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.414 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -71.35 -39.69 71.14 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.045 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -72.56 -41.08 66.15 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.545 -179.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.427 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -66.67 -27.92 68.04 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 120.841 0.353 . . . . 0.0 111.62 -176.822 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.428 ' HA ' ' NE2' ' A' ' 88' ' ' GLN . 17.1 pt20 -77.67 -30.33 51.95 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.824 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.495 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.2 mm? -87.04 -41.64 13.7 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.165 0.507 . . . . 0.0 111.982 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -58.66 -32.13 68.81 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.727 1.211 . . . . 0.0 112.412 -177.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.428 ' NE2' ' HA ' ' A' ' 85' ' ' GLN . 11.4 pt20 -73.72 -9.48 58.7 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -174.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -154.86 -73.6 0.01 OUTLIER Glycine 0 C--N 1.304 -1.206 0 C-N-CA 118.649 -1.738 . . . . 0.0 113.975 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -61.18 -43.03 99.52 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -175.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.495 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 101.49 -106.1 2.98 Favored Glycine 0 CA--C 1.473 -2.54 0 N-CA-C 105.728 -2.949 . . . . 0.0 105.728 -170.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.403 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 75.61 -24.94 1.44 Allowed Glycine 0 C--O 1.186 -2.892 0 N-CA-C 115.555 0.982 . . . . 0.0 115.555 169.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -58.61 -21.6 53.97 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 118.887 1.344 . . . . 0.0 113.719 -174.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -77.65 -38.11 48.49 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.503 174.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.402 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 4.1 pt20 -85.19 -43.0 14.2 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 122.025 0.917 . . . . 0.0 109.38 -178.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.473 HG13 ' HA ' ' A' ' 37' ' ' THR . 72.1 t -63.2 -22.71 31.42 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 C-N-CA 125.821 1.648 . . . . 0.0 110.146 177.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -45.14 -47.45 12.26 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.436 0.694 . . . . 0.0 112.527 -179.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 29.7 pt20 -69.32 -17.6 63.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.041 -177.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 4.9 tpt -100.14 -45.45 5.64 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -178.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.7 p -66.55 -25.85 36.07 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.186 179.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.438 ' HA ' HE21 ' A' ' 104' ' ' GLN . 0.0 OUTLIER -60.88 -26.26 67.28 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 122.025 -0.422 . . . . 0.0 111.395 175.219 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -63.0 -31.9 73.14 Favored 'General case' 0 C--O 1.208 -1.08 0 C-N-CA 122.802 0.441 . . . . 0.0 110.015 178.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -61.58 -31.81 71.88 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-O 121.147 0.499 . . . . 0.0 110.486 178.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.438 HE21 ' HA ' ' A' ' 101' ' ' LYS . 35.1 mt-30 -72.62 -20.91 61.2 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.728 0.775 . . . . 0.0 109.629 -179.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . 0.433 ' O ' ' HB2' ' A' ' 108' ' ' ASN . 48.2 mtp -92.4 -17.3 24.8 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.563 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.434 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 3.6 mp -53.17 -46.52 97.75 Favored Pre-proline 0 N--CA 1.471 0.603 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 16.3 Cg_endo -60.94 -22.31 74.01 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 121.216 1.278 . . . . 0.0 112.577 176.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 105' ' ' MET . 16.0 m120 -84.71 -49.42 8.51 Favored 'General case' 0 N--CA 1.415 -2.196 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -74.2 -33.3 63.36 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.757 -174.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.472 ' SG ' HD21 ' A' ' 112' ' ' LEU . 34.8 t -89.32 -6.98 56.25 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 60.0 64.33 1.29 Allowed 'General case' 0 C--O 1.241 0.633 0 CA-C-O 123.499 1.619 . . . . 0.0 110.653 -178.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.472 HD21 ' SG ' ' A' ' 110' ' ' CYS . 40.4 mt -101.83 159.24 15.51 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 112.412 -2.176 . . . . 0.0 109.555 178.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -74.32 45.28 0.22 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.092 0.957 . . . . 0.0 111.952 -175.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 56.0 m -162.12 164.49 27.97 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 124.046 0.938 . . . . 0.0 109.297 -175.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 55.0 m -150.64 123.74 8.8 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 66.4 mt . . . . . 0 C--N 1.311 -1.085 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -178.329 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 64.5 m . . . . . 0 N--CA 1.428 -1.529 0 CA-C-O 120.897 0.379 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.1 p -73.48 148.25 43.34 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -87.75 79.47 8.18 Favored 'General case' 0 N--CA 1.42 -1.93 0 CA-C-O 121.799 0.809 . . . . 0.0 108.876 177.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.4 p -140.98 164.91 28.99 Favored 'General case' 0 N--CA 1.417 -2.108 0 CA-C-N 113.984 -1.462 . . . . 0.0 107.99 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 34.1 mm -128.72 110.93 18.89 Favored Pre-proline 0 C--N 1.3 -1.578 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -73.06 151.49 97.14 Favored 'Cis proline' 0 C--O 1.248 1.004 0 C-N-CA 124.341 -1.108 . . . . 0.0 112.192 -0.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -74.02 156.98 47.3 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.258 1.972 . . . . 0.0 111.998 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.7 mm -114.65 117.2 54.87 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 N-CA-C 107.03 -1.471 . . . . 0.0 107.03 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 85.8 m . . . . . 0 C--N 1.291 -1.972 0 CA-C-O 121.826 0.822 . . . . 0.0 111.879 -177.654 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.404 -2.736 0 CA-C-O 121.383 0.611 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.454 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 3.3 pt20 -101.12 101.05 11.7 Favored 'General case' 0 N--CA 1.416 -2.143 0 CA-C-O 122.443 1.116 . . . . 0.0 110.276 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.446 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 2.4 mp -115.08 132.37 64.54 Favored 'Isoleucine or valine' 0 C--N 1.261 -3.241 0 N-CA-C 105.628 -1.99 . . . . 0.0 105.628 176.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.527 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.6 ptt180 -68.55 118.13 11.18 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -65.67 -16.42 20.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.226 0.536 . . . . 0.0 111.926 -176.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -74.87 -16.52 60.67 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.254 -178.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 7.0 pt20 -89.18 -19.63 25.22 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.277 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.424 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.7 mm? -89.88 -0.23 57.44 Favored 'General case' 0 CA--C 1.477 -1.859 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.743 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -50.38 -37.66 38.49 Favored 'General case' 0 C--O 1.218 -0.598 0 O-C-N 124.413 1.071 . . . . 0.0 111.146 178.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -66.81 -52.98 37.43 Favored 'General case' 0 C--O 1.215 -0.747 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.839 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.7 OUTLIER -58.28 -51.94 67.68 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 123.274 0.359 . . . . 0.0 110.639 179.523 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -50.05 -52.34 35.2 Favored 'General case' 0 N--CA 1.434 -1.233 0 C-N-CA 124.162 0.985 . . . . 0.0 111.608 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptm -71.71 -41.05 69.06 Favored 'General case' 0 C--O 1.211 -0.946 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.521 -177.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.839 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 1.4 p80 -68.16 -24.68 65.0 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.995 0.426 . . . . 0.0 111.954 -176.228 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.416 HD22 ' O ' ' A' ' 99' ' ' MET . 95.2 mt -83.39 -40.61 19.15 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.81 176.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.471 ' HA ' HG13 ' A' ' 96' ' ' VAL . 58.5 p -83.7 -21.0 32.49 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 118.947 -1.101 . . . . 0.0 112.929 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.6 m -90.66 121.54 32.66 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 C--N 1.297 -1.691 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 169.032 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.435 -1.186 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -72.88 -45.45 58.2 Favored 'General case' 0 C--O 1.214 -0.796 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 174.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.2 m -58.05 -26.89 63.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 122.876 0.471 . . . . 0.0 111.282 177.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.3 mt -81.71 -56.39 4.03 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.319 175.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.9 t -62.37 -48.52 79.4 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.2 0.6 . . . . 0.0 112.408 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.539 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.0 t -59.03 -32.27 69.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.444 0.698 . . . . 0.0 110.117 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.471 ' O ' ' HG2' ' A' ' 64' ' ' GLN . 8.1 t30 -76.88 -41.32 44.31 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.89 0.852 . . . . 0.0 110.322 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.405 HE21 ' HB2' ' A' ' 28' ' ' GLN . 5.9 tp60 -65.13 -36.44 84.26 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.12 -179.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.567 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -80.21 -33.24 38.29 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.161 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 4.0 pt20 -68.68 -23.11 64.35 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -174.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.93 -22.85 63.15 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.227 0.537 . . . . 0.0 110.053 176.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.8 t -74.66 158.16 5.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 177.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.413 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 1.3 mp0 -42.69 140.67 1.23 Allowed 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 125.03 1.332 . . . . 0.0 111.818 177.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -58.82 -32.97 69.87 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -173.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.587 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.5 pt20 -81.62 -11.8 58.97 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.587 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.3 m -112.5 -8.23 13.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.891 -172.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 99.1 mt-30 -60.64 -43.37 97.63 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.776 0.798 . . . . 0.0 109.819 177.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 2.9 p -77.71 -25.24 49.2 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.144 179.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 77' ' ' GLN . 4.1 mm-40 -73.62 -29.27 62.26 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.08 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.515 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.03 -32.92 70.17 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.497 176.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.567 HD11 HD22 ' A' ' 63' ' ' LEU . 22.5 mm -70.22 -32.15 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.926 -176.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.416 ' HE2' HD11 ' A' ' 116' ' ' ILE . 31.8 mmtp -70.16 -40.52 74.67 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 -175.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 7.2 mt-30 -64.04 -36.86 85.37 Favored 'General case' 0 CA--C 1.497 -1.071 0 CA-C-N 113.681 -1.599 . . . . 0.0 109.968 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 74' ' ' ALA . 43.7 t -56.73 -46.86 83.24 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.812 0 O-C-N 124.649 1.218 . . . . 0.0 108.569 178.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 41.2 t -64.29 -46.77 92.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.275 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 44.3 mt-10 -57.91 -50.33 73.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.942 -178.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -73.89 -28.3 61.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.94 0.4 . . . . 0.0 111.635 -178.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.48 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.67 -38.54 58.67 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 120.962 0.41 . . . . 0.0 111.135 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 80' ' ' GLU . 13.9 pt20 -71.11 -38.17 72.35 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -30.72 65.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.685 -176.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 3.3 pt20 -74.68 -31.19 61.83 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.24 0.543 . . . . 0.0 110.499 -178.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.583 HD12 ' HA3' ' A' ' 92' ' ' GLY . 2.7 mm? -86.4 -37.31 18.51 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.172 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.18 -35.78 76.14 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.395 -178.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -83.35 -3.24 57.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.26 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -91.51 -70.99 1.19 Allowed Glycine 0 N--CA 1.437 -1.266 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.631 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.42 -37.56 0.14 Allowed 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.483 0.658 . . . . 0.0 110.29 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.2 -93.86 0.11 Allowed Glycine 0 N--CA 1.419 -2.448 0 N-CA-C 107.101 -2.4 . . . . 0.0 107.101 -178.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.583 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 75.42 -31.35 1.18 Allowed Glycine 0 C--O 1.2 -1.999 0 CA-C-O 119.413 -0.66 . . . . 0.0 114.721 173.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -47.83 -35.38 10.12 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 124.681 1.192 . . . . 0.0 112.201 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -74.17 -42.16 60.35 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.467 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 19.4 pt20 -77.45 -44.71 28.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.48 0.657 . . . . 0.0 110.133 -178.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.471 HG13 ' HA ' ' A' ' 37' ' ' THR . 94.1 t -64.5 -22.85 32.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 C-N-CA 124.789 1.236 . . . . 0.0 110.355 177.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -45.83 -46.0 15.29 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.004 0.522 . . . . 0.0 112.407 -178.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -65.08 -18.22 65.11 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.914 0.388 . . . . 0.0 111.957 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.416 ' O ' HD22 ' A' ' 36' ' ' LEU . 7.6 tpt -101.65 -49.25 4.06 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.3 p -63.02 -23.95 34.67 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.824 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -23.07 66.93 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 121.827 -0.546 . . . . 0.0 110.565 175.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 99' ' ' MET . 22.7 mtpp -67.56 -26.43 66.29 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.301 176.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.95 -32.26 73.65 Favored 'General case' 0 C--O 1.211 -0.949 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.47 ' HB3' HG21 ' A' ' 116' ' ' ILE . 14.1 mm100 -69.69 -19.98 63.56 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 122.079 0.943 . . . . 0.0 109.243 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . 0.475 ' HA ' HD22 ' A' ' 108' ' ' ASN . 52.9 mtp -92.15 -19.12 22.6 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.03 179.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.409 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 3.3 mp -54.1 -45.52 99.05 Favored Pre-proline 0 N--CA 1.47 0.543 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -176.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 17.7 Cg_endo -61.19 -22.23 74.02 Favored 'Trans proline' 0 C--N 1.366 1.471 0 CA-C-N 120.791 1.318 . . . . 0.0 112.552 176.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . 0.475 HD22 ' HA ' ' A' ' 105' ' ' MET . 32.0 m-80 -86.84 -45.19 11.1 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -69.53 -43.39 73.1 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.303 -177.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.413 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 13.9 t -86.36 -0.82 56.75 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -176.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 56.88 59.5 3.46 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 122.957 1.361 . . . . 0.0 109.973 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.439 HD21 HD11 ' A' ' 63' ' ' LEU . 57.5 mt -96.87 157.42 15.91 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 113.638 -1.619 . . . . 0.0 110.344 -178.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -78.77 43.87 0.51 Allowed 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 124.825 1.25 . . . . 0.0 112.492 -173.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 54.2 m -156.96 157.1 34.14 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 -176.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.0 m -136.83 140.88 42.75 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.47 HG21 ' HB3' ' A' ' 104' ' ' GLN . 38.4 mm . . . . . 0 N--CA 1.434 -1.253 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 175.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.823 ' SG ' ' HB2' ' A' ' 9' ' ' PRO . 4.1 t . . . . . 0 N--CA 1.427 -1.602 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 74.9 p -77.37 149.57 35.2 Favored 'General case' 0 C--N 1.271 -2.816 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.94 71.12 5.57 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 119.372 -0.931 . . . . 0.0 109.655 178.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 t -143.65 168.37 20.06 Favored 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 74.3 mt -129.7 115.35 18.07 Favored Pre-proline 0 C--N 1.308 -1.222 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.71 146.38 86.56 Favored 'Cis proline' 0 C--O 1.246 0.887 0 C-N-CA 123.863 -1.307 . . . . 0.0 111.981 0.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.823 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 91.1 Cg_endo -77.22 152.66 31.12 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.371 2.047 . . . . 0.0 112.802 -178.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 mm -109.36 111.64 37.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.0 m . . . . . 0 C--N 1.292 -1.915 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.229 -173.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 67.4 m . . . . . 0 N--CA 1.419 -1.977 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -106.95 101.83 11.23 Favored 'General case' 0 N--CA 1.42 -1.975 0 CA-C-O 122.176 0.989 . . . . 0.0 109.186 176.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -108.39 132.56 55.91 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.452 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.528 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.7 ptt-85 -67.58 114.19 6.02 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 121.832 0.825 . . . . 0.0 109.432 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.55 ' HB ' HE22 ' A' ' 81' ' ' GLN . 2.5 pp -68.0 -9.65 11.25 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 CA-C-N 115.254 -0.885 . . . . 0.0 113.203 -174.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -77.42 -20.52 54.46 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.519 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.3 pt20 -81.52 -20.98 38.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -89.27 -4.86 58.0 Favored 'General case' 0 CA--C 1.477 -1.84 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.623 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.485 ' HA ' HE21 ' A' ' 33' ' ' GLN . 7.5 t30 -55.92 -32.71 64.03 Favored 'General case' 0 C--O 1.218 -0.597 0 O-C-N 124.03 0.831 . . . . 0.0 110.808 -178.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -66.28 -56.66 10.14 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.406 ' HB3' HG11 ' A' ' 78' ' ' VAL . 0.1 OUTLIER -54.22 -51.21 65.17 Favored 'General case' 0 C--O 1.218 -0.59 0 O-C-N 123.827 0.704 . . . . 0.0 109.715 178.98 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.485 HE21 ' HA ' ' A' ' 30' ' ' ASN . 4.8 tt0 -50.68 -60.52 2.95 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 124.062 0.945 . . . . 0.0 112.422 177.152 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -67.84 -35.33 78.4 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.736 -173.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -73.99 -30.27 62.39 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.681 -177.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 99' ' ' MET . 95.9 mt -84.54 -24.64 29.21 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 179.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.463 ' HA ' HG13 ' A' ' 96' ' ' VAL . 71.3 p -84.76 -12.93 52.69 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.196 -1.402 . . . . 0.0 110.129 175.092 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.0 t -88.49 149.97 23.37 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.645 177.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.442 ' CZ ' ' HA ' ' A' ' 96' ' ' VAL . 50.7 m-85 . . . . . 0 N--CA 1.434 -1.264 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.452 -0.364 0 CA-C-O 120.583 0.23 . . . . 0.0 111.422 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -73.76 -45.05 54.22 Favored 'General case' 0 CA--C 1.491 -1.294 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.2 m -56.63 -36.38 69.41 Favored 'General case' 0 C--O 1.213 -0.837 0 O-C-N 123.907 0.754 . . . . 0.0 110.333 179.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 40.2 mt -79.3 -47.35 16.0 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.955 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.6 t -69.28 -50.39 47.35 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.765 -175.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.423 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 7.5 t -52.36 -43.43 64.67 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 124.178 0.991 . . . . 0.0 110.048 175.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.451 ' HA ' ' CD ' ' A' ' 64' ' ' GLN . 8.1 t30 -72.06 -23.76 61.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.373 -176.275 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -83.83 -48.18 10.33 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.255 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.541 ' O ' ' HG2' ' A' ' 71' ' ' GLN . 3.7 pp -65.21 -34.0 77.34 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-O 121.214 0.531 . . . . 0.0 111.037 -177.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.451 ' CD ' ' HA ' ' A' ' 61' ' ' ASN . 13.4 pt20 -69.31 -15.57 63.37 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.178 0.591 . . . . 0.0 111.865 -176.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -84.58 -11.44 56.01 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.479 0.657 . . . . 0.0 110.301 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 11.6 t -82.74 163.45 3.03 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 174.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 46.0 mt-10 -47.47 144.06 3.25 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.408 0.683 . . . . 0.0 111.657 176.213 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -63.19 -28.93 70.39 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -175.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.52 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 4.0 pt20 -80.0 -14.86 58.25 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.507 0.67 . . . . 0.0 110.399 177.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.52 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.7 m -110.94 -7.09 14.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.156 -173.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 72.0 mt-30 -62.95 -40.33 97.36 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.092 0.472 . . . . 0.0 110.347 177.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 114' ' ' CYS . 32.1 p -77.34 -23.83 50.86 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.419 176.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 14.1 mm-40 -71.0 -32.03 68.73 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.328 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.08 -27.01 68.81 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.815 177.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.491 HD11 HD22 ' A' ' 63' ' ' LEU . 31.0 mm -69.55 -32.5 53.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.734 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -70.8 -41.64 71.37 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 106.465 -1.679 . . . . 0.0 106.465 -174.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.426 HE21 ' HA ' ' A' ' 77' ' ' GLN . 0.1 OUTLIER -56.99 -44.07 82.34 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 112.492 -2.14 . . . . 0.0 110.584 -179.025 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.406 HG11 ' HB3' ' A' ' 32' ' ' CYS . 15.8 t -59.41 -45.96 93.09 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.584 0 O-C-N 124.079 0.862 . . . . 0.0 109.59 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 75' ' ' ILE . 40.1 t -65.53 -46.25 90.27 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.89 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -175.343 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -54.64 -51.85 64.12 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.196 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.55 HE22 ' HB ' ' A' ' 26' ' ' ILE . 3.6 pt20 -76.43 -34.46 58.77 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -175.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.54 -33.89 67.15 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.834 0.349 . . . . 0.0 111.098 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -76.37 -35.69 58.55 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.892 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.484 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -71.1 -35.87 71.97 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.088 -176.984 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.414 ' HG3' HD22 ' A' ' 86' ' ' LEU . 2.4 pt20 -68.63 -30.04 68.67 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 121.221 0.534 . . . . 0.0 110.7 -176.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.61 HD12 ' HA3' ' A' ' 92' ' ' GLY . 4.1 mm? -86.28 -37.48 18.51 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.982 175.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -60.91 -34.81 75.24 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.983 0.913 . . . . 0.0 111.868 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -75.62 -4.83 42.32 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.507 0.67 . . . . 0.0 111.738 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -105.24 -132.52 7.38 Favored Glycine 0 N--CA 1.428 -1.837 0 N-CA-C 110.984 -0.847 . . . . 0.0 110.984 178.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -88.62 -23.78 22.98 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 120.781 0.325 . . . . 0.0 111.686 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 157.98 -94.44 0.14 Allowed Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . 0.61 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 73.05 -36.91 0.76 Allowed Glycine 0 C--O 1.202 -1.847 0 N-CA-C 115.421 0.929 . . . . 0.0 115.421 176.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -49.32 -29.23 5.74 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 124.118 0.967 . . . . 0.0 113.462 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -77.03 -40.1 47.71 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 122.227 0.211 . . . . 0.0 111.204 178.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.403 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 4.1 pt20 -79.63 -45.88 18.25 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.518 HG21 ' HG ' ' A' ' 86' ' ' LEU . 84.4 t -62.22 -23.03 30.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 C-N-CA 125.29 1.436 . . . . 0.0 111.07 177.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -42.58 -52.34 4.82 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.427 1.091 . . . . 0.0 112.732 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 20.6 pt20 -60.12 -18.21 45.65 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.752 0.821 . . . . 0.0 112.778 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 5.6 tpt -106.01 -47.09 3.93 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -177.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.1 p -64.78 -23.78 34.15 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-O 120.899 0.381 . . . . 0.0 111.527 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.516 ' O ' ' HG3' ' A' ' 105' ' ' MET . 0.0 OUTLIER -61.69 -25.31 67.33 Favored 'General case' 0 C--O 1.218 -0.599 0 O-C-N 121.791 -0.568 . . . . 0.0 110.966 173.567 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -65.47 -27.93 68.85 Favored 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 122.499 0.32 . . . . 0.0 110.207 177.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.462 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -63.36 -36.18 82.87 Favored 'General case' 0 C--O 1.202 -1.401 0 CA-C-O 121.948 0.88 . . . . 0.0 109.001 175.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -76.82 -16.06 59.55 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.3 -178.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . 0.516 ' HG3' ' O ' ' A' ' 101' ' ' LYS . 68.4 mtp -91.57 -14.7 29.83 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.057 178.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.462 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 96.9 mt -51.46 -50.09 78.61 Favored Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 123.559 0.537 . . . . 0.0 112.351 -178.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' PRO . . . . . 0.489 ' HD3' HG21 ' A' ' 75' ' ' ILE . 19.5 Cg_endo -61.38 -26.3 81.28 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.817 1.678 . . . . 0.0 112.663 177.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -83.1 -28.3 29.58 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-O 121.358 0.599 . . . . 0.0 109.616 -177.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -84.33 -47.85 10.31 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.452 0.644 . . . . 0.0 111.022 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 88.4 m -82.63 0.58 42.44 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -175.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 60.2 t30 56.87 61.68 2.53 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 122.175 0.988 . . . . 0.0 109.963 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 74.9 mt -95.09 158.52 15.43 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.735 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -72.55 17.65 0.11 Allowed 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.93 0.892 . . . . 0.0 113.318 -172.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 72' ' ' CYS . 83.1 m -148.31 158.01 43.83 Favored 'General case' 0 C--N 1.268 -2.949 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 -169.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 31.9 p -134.69 146.88 49.9 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.403 HG12 ' HG3' ' A' ' 107' ' ' PRO . 33.6 mm . . . . . 0 C--N 1.303 -1.431 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 177.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.479 0 N-CA-C 111.286 -0.726 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.58 ' HG3' ' HA2' ' A' ' 15' ' ' GLY . 48.6 mtm180 -76.47 141.07 41.44 Favored 'General case' 0 CA--C 1.485 -1.535 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 66.7 m -132.92 144.73 50.35 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 51.8 p -83.38 154.71 23.88 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.85 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -85.86 69.58 10.58 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.5 m -158.6 168.23 27.45 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 81.5 mt -128.22 123.16 22.38 Favored Pre-proline 0 C--N 1.309 -1.192 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -71.53 142.76 74.42 Favored 'Cis proline' 0 C--O 1.244 0.809 0 C-N-CA 123.642 -1.399 . . . . 0.0 112.61 0.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.88 142.49 39.15 Favored 'Trans proline' 0 N--CA 1.45 -1.038 0 C-N-CA 122.353 2.035 . . . . 0.0 110.857 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.496 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 44.8 mm -101.68 107.72 22.13 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.262 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.56 ' HA ' ' O ' ' A' ' 2' ' ' ARG . 77.5 m -104.06 131.72 51.03 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 121.899 0.856 . . . . 0.0 111.618 -178.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -90.1 157.36 45.63 Favored Pre-proline 0 C--N 1.297 -1.685 0 CA-C-N 113.946 -1.479 . . . . 0.0 111.435 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.91 -6.78 17.8 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 122.881 2.388 . . . . 0.0 113.66 -177.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -144.16 160.36 41.06 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . 0.58 ' HA2' ' HG3' ' A' ' 2' ' ' ARG . . . -153.0 90.32 0.13 Allowed Glycine 0 N--CA 1.419 -2.443 0 C-N-CA 118.787 -1.673 . . . . 0.0 114.198 178.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -70.76 -27.55 64.02 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 174.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.574 ' HA ' ' OE1' ' A' ' 69' ' ' GLN . 12.6 t70 -98.47 105.59 17.76 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.323 -1.308 . . . . 0.0 107.831 176.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -141.84 61.37 12.69 Favored Pre-proline 0 C--N 1.304 -1.372 0 CA-C-O 121.055 0.455 . . . . 0.0 111.703 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.53 ' HA ' ' SG ' ' A' ' 22' ' ' CYS . 98.3 Cg_endo -75.54 8.02 2.81 Favored 'Trans proline' 0 N--CA 1.484 0.94 0 C-N-CA 123.042 2.495 . . . . 0.0 113.714 -172.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.496 ' HD3' ' H ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -102.87 -31.17 10.4 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 -179.3 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -135.6 46.07 1.06 Allowed Glycine 0 N--CA 1.419 -2.462 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.96 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.53 ' SG ' ' HA ' ' A' ' 19' ' ' PRO . 33.7 m -57.67 121.06 9.49 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-N 114.558 -0.821 . . . . 0.0 110.65 175.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -101.73 112.46 25.06 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 122.092 0.948 . . . . 0.0 109.994 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.406 HG21 ' CB ' ' A' ' 74' ' ' ALA . 3.0 mp -120.08 131.22 73.02 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.284 0 N-CA-C 105.637 -1.986 . . . . 0.0 105.637 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.471 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 24.4 ptt-85 -73.03 123.52 23.69 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 121.099 0.476 . . . . 0.0 109.744 -176.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.75 -16.65 21.38 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -174.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.437 ' CD ' ' HB2' ' A' ' 25' ' ' ARG . 17.8 pm0 -75.77 -18.31 59.57 Favored 'General case' 0 N--CA 1.421 -1.915 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.973 -178.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 6.3 pt20 -83.83 -19.53 34.8 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.408 HD22 ' HG2' ' A' ' 28' ' ' GLN . 2.4 mm? -91.75 3.26 55.52 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.624 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -59.11 -34.47 72.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 123.762 0.664 . . . . 0.0 109.317 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -69.73 -50.35 44.35 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.057 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.813 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.5 OUTLIER -58.11 -48.73 79.31 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 120.772 0.32 . . . . 0.0 110.338 178.408 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.453 HE21 ' HG3' ' A' ' 81' ' ' GLN . 19.0 tt0 -52.52 -52.15 56.05 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 123.44 0.696 . . . . 0.0 111.651 176.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.4 ptm -70.64 -38.41 73.86 Favored 'General case' 0 C--O 1.205 -1.288 0 C-N-CA 120.676 -0.41 . . . . 0.0 111.062 -177.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.813 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 1.4 p80 -70.83 -23.36 62.34 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.371 -0.532 . . . . 0.0 111.926 -176.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.449 HD22 ' O ' ' A' ' 99' ' ' MET . 91.5 mt -88.86 -39.08 14.09 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.218 174.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.529 ' HA ' HG13 ' A' ' 96' ' ' VAL . 41.1 p -83.61 -22.79 32.13 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 118.21 -1.396 . . . . 0.0 112.31 -175.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 t -92.5 121.74 34.25 Favored 'General case' 0 C--N 1.291 -1.952 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.903 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -87.06 93.14 9.28 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 169.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -65.26 169.92 5.21 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.025 -1.443 . . . . 0.0 112.455 -171.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 26.7 p90 -89.18 -31.73 17.8 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -166.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.42 -6.06 56.03 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 121.536 0.684 . . . . 0.0 110.09 -176.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 50.5 mt -78.52 86.9 4.51 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.236 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -95.78 -51.14 4.62 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 26.5 mmt -129.85 76.72 1.74 Allowed 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.651 ' HA ' ' OE1' ' A' ' 52' ' ' GLN . . . -80.86 78.83 7.62 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 114.823 -1.08 . . . . 0.0 112.022 -175.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 47.8 t -123.41 -70.76 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.59 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 176.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -137.48 96.37 3.24 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.51 0.671 . . . . 0.0 111.928 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.449 ' HB2' ' HG3' ' A' ' 52' ' ' GLN . 45.2 m-80 -146.62 120.45 5.15 Favored Pre-proline 0 C--N 1.303 -1.45 0 N-CA-C 105.712 -1.958 . . . . 0.0 105.712 176.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -53.23 -37.45 80.42 Favored 'Trans proline' 0 N--CA 1.484 0.947 0 C-N-CA 123.444 2.763 . . . . 0.0 114.625 -172.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -69.74 -15.08 63.08 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -176.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.651 ' OE1' ' HA ' ' A' ' 46' ' ' ALA . 19.1 mt-30 -68.44 -40.47 81.12 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -76.96 3.79 11.4 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.247 -0.888 . . . . 0.0 113.173 -175.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.611 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 11.8 pt20 -58.24 -36.4 73.14 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 121.102 0.477 . . . . 0.0 110.402 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -65.34 -26.66 68.13 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.344 -178.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -83.13 -41.6 18.34 Favored 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.8 m -56.67 -31.52 64.51 Favored 'General case' 0 C--O 1.212 -0.882 0 O-C-N 123.708 0.63 . . . . 0.0 110.121 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 65.8 mt -82.99 -48.06 11.06 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.232 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.2 t -65.94 -50.07 65.72 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -178.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.536 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.7 t -59.31 -30.8 68.61 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.101 0.56 . . . . 0.0 110.29 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.486 ' HA ' ' NE2' ' A' ' 64' ' ' GLN . 27.5 t-20 -78.7 -25.04 44.69 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.43 0.633 . . . . 0.0 111.471 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -84.9 -42.9 14.58 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.198 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.569 HD22 HD11 ' A' ' 75' ' ' ILE . 3.7 pp -68.49 -31.99 71.65 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.647 -177.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.486 ' NE2' ' HA ' ' A' ' 61' ' ' ASN . 9.3 pt20 -71.2 -10.36 59.63 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -177.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -86.11 -12.43 50.04 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-O 121.816 0.817 . . . . 0.0 109.424 176.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 15.6 t -83.46 163.28 2.97 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.24 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 174.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.439 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 1.6 mp0 -48.2 142.23 5.58 Favored 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 124.187 0.995 . . . . 0.0 111.738 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -53.65 -35.58 61.15 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 124.767 1.227 . . . . 0.0 112.915 -174.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.574 ' OE1' ' HA ' ' A' ' 17' ' ' ASP . 3.2 pt20 -87.49 -20.81 26.02 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.221 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 59.5 m -95.17 -8.84 35.16 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.681 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.554 ' HB3' HD22 ' A' ' 112' ' ' LEU . 23.0 mt-30 -57.33 -43.12 83.1 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.87 176.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 6.5 p -80.87 -24.21 38.49 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.163 0.506 . . . . 0.0 111.177 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -67.92 -33.18 74.19 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.483 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.441 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -58.72 -31.29 68.15 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.459 177.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.569 HD11 HD22 ' A' ' 63' ' ' LEU . 21.1 mm -73.18 -27.57 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.238 0 CA-C-N 115.095 -0.957 . . . . 0.0 109.94 -177.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -74.54 -39.81 62.11 Favored 'General case' 0 CA--C 1.484 -1.589 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 -175.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -56.22 -40.42 74.04 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 112.626 -2.079 . . . . 0.0 109.215 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 74' ' ' ALA . 25.9 t -60.64 -47.9 90.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.929 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 42.3 t -61.6 -48.71 87.51 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.198 -174.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -61.75 -41.53 97.79 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.655 -175.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.453 ' HG3' HE21 ' A' ' 33' ' ' GLN . 11.3 pt20 -79.97 -28.82 39.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.634 0.254 . . . . 0.0 111.163 -179.009 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.98 -41.12 60.15 Favored 'General case' 0 C--N 1.311 -1.077 0 O-C-N 122.19 -0.319 . . . . 0.0 111.314 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -69.48 -35.63 75.78 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.126 -178.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.434 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -72.01 -36.23 69.66 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.178 -178.388 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.434 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 5.8 pt20 -72.8 -34.51 66.94 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.355 -174.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.472 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 2.4 mm? -76.79 -36.62 56.85 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.62 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -66.39 -40.35 89.62 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.623 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -75.12 -17.46 60.42 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.367 0.604 . . . . 0.0 110.157 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -83.08 -65.52 1.59 Allowed Glycine 0 N--CA 1.421 -2.357 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -158.43 -26.2 0.08 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -175.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.472 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 146.38 -114.97 0.77 Allowed Glycine 0 CA--C 1.492 -1.397 0 N-CA-C 108.476 -1.85 . . . . 0.0 108.476 -174.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.23 -32.17 2.3 Favored Glycine 0 C--O 1.196 -2.252 0 CA-C-O 118.909 -0.94 . . . . 0.0 114.488 172.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -48.1 -32.66 7.11 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.921 0.888 . . . . 0.0 113.396 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -72.87 -38.12 67.11 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.964 0.412 . . . . 0.0 111.429 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.46 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 20.0 pt20 -85.43 -44.19 12.96 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 121.475 0.655 . . . . 0.0 109.662 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.529 HG13 ' HA ' ' A' ' 37' ' ' THR . 92.0 t -61.19 -22.53 27.55 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 C-N-CA 125.412 1.485 . . . . 0.0 110.933 176.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.41 ' HA ' HG12 ' A' ' 100' ' ' VAL . 53.3 tt0 -46.44 -46.23 18.63 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 20.1 pt20 -63.55 -18.5 63.92 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -178.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.449 ' O ' HD22 ' A' ' 36' ' ' LEU . 4.7 tpt -100.43 -46.83 5.11 Favored 'General case' 0 N--CA 1.438 -1.072 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -177.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.41 HG12 ' HA ' ' A' ' 97' ' ' GLN . 7.9 p -62.08 -26.17 39.38 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-O 120.834 0.35 . . . . 0.0 111.771 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -23.42 67.34 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.805 -0.559 . . . . 0.0 111.345 177.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -65.93 -25.59 67.21 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.024 178.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.22 -28.82 69.04 Favored 'General case' 0 C--O 1.203 -1.385 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.332 176.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.17 -24.52 62.26 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.265 1.031 . . . . 0.0 109.083 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 49.0 mtm -92.37 -13.02 30.78 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.528 178.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.46 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.1 OUTLIER -54.0 -46.75 98.52 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.226 0.61 . . . . 0.0 111.06 -177.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.597 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 20.3 Cg_endo -60.72 -26.89 83.88 Favored 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 121.382 1.388 . . . . 0.0 112.666 175.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -77.97 -46.98 19.62 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -64.64 -47.96 76.61 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.305 -0.862 . . . . 0.0 112.44 -177.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.4 ' SG ' HD11 ' A' ' 63' ' ' LEU . 10.2 t -84.08 -3.32 57.99 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.2 0.524 . . . . 0.0 109.701 -175.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.2 t30 58.17 64.23 1.55 Allowed 'General case' 0 C--O 1.247 0.944 0 CA-C-O 123.072 1.415 . . . . 0.0 110.717 -179.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.554 HD22 ' HB3' ' A' ' 71' ' ' GLN . 31.6 mt -101.63 158.52 16.03 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 112.992 -1.913 . . . . 0.0 109.015 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -72.92 44.68 0.14 Allowed 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 124.368 1.067 . . . . 0.0 112.988 -176.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.597 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 67.0 m -160.47 152.14 19.75 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -175.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.8 m -151.33 114.92 4.87 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 6.3 pt . . . . . 0 N--CA 1.428 -1.547 0 CA-C-O 118.459 -0.781 . . . . 0.0 112.546 -177.448 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.325 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.4 mtt85 -95.85 145.16 25.59 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 117.093 0.447 . . . . 0.0 110.538 -178.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 72.6 m -129.12 148.88 51.1 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 177.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 75.4 p -75.65 142.43 42.58 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 176.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.66 68.88 10.55 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.825 0.821 . . . . 0.0 109.976 178.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.1 t -150.5 170.96 17.86 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 105.936 -1.875 . . . . 0.0 105.936 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.3 mp -127.39 125.35 23.91 Favored Pre-proline 0 C--N 1.298 -1.635 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.29 143.26 76.7 Favored 'Cis proline' 0 C--O 1.243 0.76 0 C-N-CA 123.722 -1.366 . . . . 0.0 111.985 -1.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.77 129.76 21.72 Favored 'Trans proline' 0 C--O 1.254 1.282 0 C-N-CA 122.122 1.882 . . . . 0.0 111.43 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.416 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 37.6 mm -92.41 111.69 24.75 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 75.9 m -106.5 137.79 43.86 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.449 0.642 . . . . 0.0 111.305 -175.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -112.87 143.06 28.33 Favored Pre-proline 0 N--CA 1.415 -2.186 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.721 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -85.23 28.03 0.58 Allowed 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 123.056 2.504 . . . . 0.0 111.567 -179.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -120.06 135.4 54.95 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 115.271 -0.877 . . . . 0.0 108.896 -178.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 148.68 -94.26 0.16 Allowed Glycine 0 CA--C 1.476 -2.351 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.486 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 20.6 tp -156.3 -56.72 0.09 Allowed 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 121.457 0.646 . . . . 0.0 109.921 -174.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -70.01 111.64 5.84 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.876 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.413 ' ND2' ' HA2' ' A' ' 21' ' ' GLY . 23.0 t-20 -134.62 85.14 37.53 Favored Pre-proline 0 C--N 1.296 -1.748 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -81.99 -23.31 4.63 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 121.665 1.576 . . . . 0.0 111.587 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -144.16 -53.97 0.34 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.126 -1.805 . . . . 0.0 106.126 177.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.413 ' HA2' ' ND2' ' A' ' 18' ' ' ASN . . . 152.59 -53.5 0.47 Allowed Glycine 0 CA--C 1.473 -2.572 0 N-CA-C 105.527 -3.029 . . . . 0.0 105.527 -178.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 60.0 m -86.23 127.75 34.8 Favored 'General case' 0 N--CA 1.409 -2.494 0 CA-C-N 113.231 -1.485 . . . . 0.0 108.576 170.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -107.6 117.07 33.12 Favored 'General case' 0 N--CA 1.416 -2.137 0 CA-C-O 121.871 0.843 . . . . 0.0 108.948 172.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.408 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.3 mp -111.69 143.34 21.69 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.64 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 -177.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.524 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.2 ptt180 -69.72 116.27 9.92 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 118.399 0.545 . . . . 0.0 110.382 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 pp -63.66 -14.8 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.395 0.617 . . . . 0.0 112.393 -175.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -73.43 -22.9 60.09 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.698 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.524 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.0 pt20 -83.73 -18.5 37.67 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -178.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.431 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.4 mm? -94.87 -0.7 53.8 Favored 'General case' 0 CA--C 1.48 -1.715 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.441 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -59.14 -30.97 68.53 Favored 'General case' 0 C--N 1.309 -1.178 0 O-C-N 123.751 0.657 . . . . 0.0 111.273 -178.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.404 ' O ' ' HG2' ' A' ' 34' ' ' MET . 3.4 t-160 -71.08 -52.56 18.68 Favored 'General case' 0 C--O 1.216 -0.662 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.825 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 1.6 t -56.47 -46.79 80.22 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 124.173 0.989 . . . . 0.0 109.032 -178.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -53.11 -56.02 19.48 Favored 'General case' 0 N--CA 1.425 -1.692 0 C-N-CA 124.926 1.291 . . . . 0.0 111.349 174.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 31' ' ' HIS . 24.7 ptm -70.29 -33.66 71.82 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.397 -173.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.825 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -69.89 -23.42 63.25 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.631 -178.72 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.9 mt -88.54 -36.14 16.54 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.862 175.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.414 ' HB ' HD21 ' A' ' 86' ' ' LEU . 72.4 p -80.15 -19.78 46.41 Favored 'General case' 0 C--N 1.308 -1.216 0 C-N-CA 119.161 -1.016 . . . . 0.0 112.809 -176.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 66.4 p -89.57 135.43 33.61 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -178.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -116.05 113.97 23.92 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 172.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -83.52 169.23 15.68 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -176.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 9.0 p90 -108.7 -28.56 9.17 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.544 -173.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.418 ' O ' ' HG2' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -82.56 10.95 6.32 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 119.676 -0.81 . . . . 0.0 111.467 -174.562 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -66.82 106.7 1.95 Allowed 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.185 -1.042 . . . . 0.0 108.185 174.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.418 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 33.2 mmt180 -114.68 0.57 13.93 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.138 0.494 . . . . 0.0 110.678 -175.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 20.2 ptm -161.67 29.88 0.13 Allowed 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.463 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.71 89.23 3.07 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-O 121.445 0.64 . . . . 0.0 111.702 -177.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 61.1 t -122.39 -61.96 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 105.566 -2.012 . . . . 0.0 105.566 172.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -130.88 97.76 4.42 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 105.877 -1.897 . . . . 0.0 105.877 170.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.43 ' HB3' ' HG3' ' A' ' 52' ' ' GLN . 39.1 t-20 -144.59 129.95 9.49 Favored Pre-proline 0 C--N 1.286 -2.171 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -173.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.55 -26.99 83.83 Favored 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 123.084 2.523 . . . . 0.0 113.034 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -74.61 -9.56 58.69 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -178.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.43 ' HG3' ' HB3' ' A' ' 49' ' ' ASN . 21.6 mt-30 -70.87 -31.64 68.38 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.064 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -76.59 10.71 1.98 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.115 -0.948 . . . . 0.0 112.765 -174.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -61.05 -37.6 83.23 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.942 0.877 . . . . 0.0 109.594 175.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.413 ' HB2' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -74.12 -23.68 59.33 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.252 178.932 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.92 -38.73 61.74 Favored 'General case' 0 CA--C 1.495 -1.166 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.082 176.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 m -56.97 -35.59 69.33 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 42.4 mt -73.41 -51.67 16.45 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.247 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.6 t -60.78 -50.5 73.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 122.776 0.43 . . . . 0.0 111.277 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.542 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.4 t -59.44 -33.63 71.51 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 124.168 0.987 . . . . 0.0 110.161 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.43 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 16.9 t-20 -79.22 -23.21 43.93 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.517 0.675 . . . . 0.0 110.411 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -82.26 -48.26 11.44 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.833 -0.622 . . . . 0.0 109.857 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.593 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -67.41 -33.36 75.02 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.431 -177.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -69.59 -12.77 61.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.982 -176.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 68.6 mm-40 -89.39 -11.01 44.43 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.464 0.649 . . . . 0.0 109.569 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -80.84 164.45 3.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 174.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -45.6 136.5 5.81 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.828 0.451 . . . . 0.0 110.9 173.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.452 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 17.2 ptpt -57.9 -33.99 69.33 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -174.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.429 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 24.5 pt20 -76.11 -20.46 57.62 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.835 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.429 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 58.8 m -102.29 -9.38 20.44 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.776 -174.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.452 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 29.6 mt-30 -59.45 -42.62 92.38 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 121.17 0.509 . . . . 0.0 110.773 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.2 p -78.82 -24.22 44.62 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.279 0.562 . . . . 0.0 111.406 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -71.43 -32.54 68.49 Favored 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.442 179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.477 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.84 -29.85 69.75 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.766 176.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.593 HD11 HD22 ' A' ' 63' ' ' LEU . 28.2 mm -68.9 -35.64 70.27 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.654 -178.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -63.48 -44.62 93.88 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 -176.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 4.6 mt-30 -61.65 -41.92 98.18 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 113.322 -1.763 . . . . 0.0 110.32 -177.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 74' ' ' ALA . 38.2 t -53.31 -47.56 57.23 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.082 0 O-C-N 124.413 1.07 . . . . 0.0 109.359 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 75' ' ' ILE . 41.4 t -67.76 -45.83 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.091 0 CA-C-N 115.476 -0.783 . . . . 0.0 108.939 -174.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -56.94 -51.61 68.48 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.208 -178.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.465 ' HA ' ' HG3' ' A' ' 84' ' ' LYS . 20.3 pt20 -72.61 -31.74 65.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.648 -177.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.18 -38.46 66.15 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.871 0.367 . . . . 0.0 111.37 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -75.72 -34.75 60.37 Favored 'General case' 0 C--N 1.312 -1.043 0 C-N-CA 120.014 -0.674 . . . . 0.0 110.144 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.465 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -72.82 -31.7 65.0 Favored 'General case' 0 N--CA 1.442 -0.873 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.14 -178.415 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -71.32 -33.33 69.57 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.579 -177.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.591 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 4.1 mm? -78.66 -37.04 42.87 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.009 175.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -58.03 -41.73 83.85 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.924 0.89 . . . . 0.0 110.732 179.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -79.28 -14.41 59.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.777 -176.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -96.75 -105.88 2.3 Favored Glycine 0 N--CA 1.425 -2.04 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.988 -176.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -102.92 -17.35 15.53 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.145 0.498 . . . . 0.0 111.649 -175.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.591 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 128.08 -93.12 0.36 Allowed Glycine 0 N--CA 1.428 -1.889 0 N-CA-C 108.601 -1.8 . . . . 0.0 108.601 -173.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.576 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 72.25 -37.37 0.67 Allowed Glycine 0 C--O 1.193 -2.46 0 N-CA-C 115.77 1.068 . . . . 0.0 115.77 172.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -49.63 -27.7 4.93 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 118.538 1.169 . . . . 0.0 113.111 -178.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.439 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 4.5 pt20 -67.3 -45.0 77.84 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 120.67 0.271 . . . . 0.0 110.477 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 19.2 pt20 -86.51 -42.64 13.37 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 121.521 0.677 . . . . 0.0 111.075 -175.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.449 HG21 ' HG ' ' A' ' 86' ' ' LEU . 91.0 t -64.57 -22.95 32.33 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.191 0 C-N-CA 125.108 1.363 . . . . 0.0 111.766 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -48.1 -45.09 32.37 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 28.8 pt20 -61.3 -21.79 64.29 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 122.961 0.504 . . . . 0.0 112.322 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 3.3 tpt -100.42 -44.89 5.75 Favored 'General case' 0 CA--C 1.49 -1.335 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -175.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.95 -24.13 34.88 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.516 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -23.66 67.38 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.755 -0.59 . . . . 0.0 110.578 176.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -63.26 -29.25 70.61 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -63.71 -29.88 71.05 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 121.191 0.52 . . . . 0.0 110.266 177.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -73.14 -17.23 61.41 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.792 0.806 . . . . 0.0 109.511 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 50.7 mtp -92.14 -20.61 21.06 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.331 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 5.0 mp -52.15 -45.51 93.84 Favored Pre-proline 0 N--CA 1.468 0.43 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.425 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 14.1 Cg_endo -59.79 -22.5 68.3 Favored 'Trans proline' 0 C--N 1.369 1.624 0 C-N-CA 121.141 1.227 . . . . 0.0 112.862 176.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -89.45 -45.82 9.16 Favored 'General case' 0 N--CA 1.411 -2.39 0 CA-C-O 121.126 0.488 . . . . 0.0 109.971 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -68.31 -38.95 82.09 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.868 -176.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.456 ' SG ' HD21 ' A' ' 112' ' ' LEU . 16.7 t -87.3 -6.46 58.51 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -179.01 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 8.1 t30 57.74 64.4 1.57 Allowed 'General case' 0 CA--C 1.508 -0.638 0 C-N-CA 124.91 1.284 . . . . 0.0 110.082 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.456 HD21 ' SG ' ' A' ' 110' ' ' CYS . 47.5 mt -96.04 159.46 14.95 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 113.372 -1.74 . . . . 0.0 109.935 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -71.7 37.53 0.06 Allowed 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 123.612 0.765 . . . . 0.0 112.709 -177.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 74.4 m -157.15 154.58 29.55 Favored 'General case' 0 C--N 1.28 -2.416 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -175.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 12.0 p -149.74 134.14 17.42 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 43.0 mm . . . . . 0 C--N 1.307 -1.241 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -178.872 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.814 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.444 ' HG2' ' HA3' ' A' ' 15' ' ' GLY . 34.7 mmt180 -86.27 141.71 29.08 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-N 117.546 0.673 . . . . 0.0 110.002 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 63.7 m -123.37 149.28 45.14 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 177.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 77.5 p -86.96 157.74 19.41 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.865 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -91.98 76.81 5.46 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.305 0.574 . . . . 0.0 109.594 176.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.9 t -152.01 172.0 16.96 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.6 mp -128.33 117.77 20.22 Favored Pre-proline 0 N--CA 1.435 -1.206 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.34 147.74 90.18 Favored 'Cis proline' 0 C--O 1.246 0.908 0 C-N-CA 123.596 -1.418 . . . . 0.0 111.801 -0.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -69.92 139.57 39.98 Favored 'Trans proline' 0 C--O 1.247 0.952 0 C-N-CA 122.164 1.909 . . . . 0.0 111.094 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.53 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 44.3 mm -97.44 111.44 27.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.955 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 73.6 m -105.35 125.0 50.49 Favored 'General case' 0 C--N 1.288 -2.082 0 CA-C-O 121.491 0.662 . . . . 0.0 110.235 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -84.36 155.42 63.06 Favored Pre-proline 0 C--N 1.284 -2.244 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.422 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -70.58 -8.23 23.13 Favored 'Trans proline' 0 C--O 1.24 0.609 0 C-N-CA 122.657 2.238 . . . . 0.0 113.211 -177.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.413 ' CG ' ' H ' ' A' ' 15' ' ' GLY . 23.3 t70 -161.79 -148.16 0.14 Allowed 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . 0.444 ' HA3' ' HG2' ' A' ' 2' ' ' ARG . . . 161.51 -42.09 0.4 Allowed Glycine 0 N--CA 1.435 -1.422 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -141.96 -58.76 0.47 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -165.59 92.59 0.54 Allowed 'General case' 0 C--N 1.284 -2.24 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -130.46 75.15 79.47 Favored Pre-proline 0 C--N 1.297 -1.711 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.215 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -73.25 -40.02 1.86 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 121.956 1.771 . . . . 0.0 111.237 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.488 ' HD2' ' H ' ' A' ' 20' ' ' ARG . 0.1 OUTLIER -88.16 -34.11 17.96 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.086 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 124.57 -67.94 0.5 Allowed Glycine 0 CA--C 1.464 -3.123 0 N-CA-C 107.955 -2.058 . . . . 0.0 107.955 -177.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 67.8 m -67.1 133.09 49.17 Favored 'General case' 0 N--CA 1.418 -2.05 0 CA-C-N 114.307 -0.946 . . . . 0.0 109.414 172.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -107.11 108.54 20.05 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-O 121.869 0.843 . . . . 0.0 108.893 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.446 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.0 mp -102.49 141.3 18.84 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.691 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -175.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.5 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 20.6 ptt180 -67.11 114.14 5.63 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 121.672 0.749 . . . . 0.0 111.12 -177.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.23 -15.65 12.95 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -73.75 -23.19 59.7 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.835 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.5 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.3 pt20 -83.37 -33.31 25.83 Favored 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.721 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.472 HD11 ' HB1' ' A' ' 74' ' ' ALA . 2.0 mm? -82.15 -8.64 59.66 Favored 'General case' 0 CA--C 1.474 -1.971 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.021 -177.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -58.09 -30.27 66.11 Favored 'General case' 0 C--N 1.314 -0.937 0 O-C-N 124.17 0.919 . . . . 0.0 110.855 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -70.18 -54.66 11.9 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -54.08 -50.52 66.6 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.396 1.079 . . . . 0.0 108.524 -178.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -53.86 -61.15 2.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 125.504 1.522 . . . . 0.0 112.581 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -67.17 -34.87 78.46 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.831 0.348 . . . . 0.0 111.825 -172.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.433 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 8.9 t-80 -67.51 -33.13 74.46 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.804 -177.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 91.4 mt -84.64 -34.68 23.03 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.539 ' HB ' HD21 ' A' ' 86' ' ' LEU . 41.8 p -79.71 -21.01 45.14 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 118.83 -1.148 . . . . 0.0 113.165 -176.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 57.2 p -88.68 154.73 20.07 Favored 'General case' 0 N--CA 1.424 -1.727 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.829 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -128.09 132.0 49.03 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 173.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.466 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 5.2 t0 -85.65 171.71 11.44 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -176.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 55.3 p90 -102.78 -34.57 8.97 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -172.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.81 8.18 21.0 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.993 -175.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.466 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 60.0 mt -65.19 102.8 0.69 Allowed 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 175.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -94.16 -37.96 11.32 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-O 121.107 0.48 . . . . 0.0 111.212 -177.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 20.5 ptm -155.29 26.34 0.41 Allowed 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.96 -177.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.17 91.65 6.18 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.514 -177.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 92.0 t -116.3 -47.88 4.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.993 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -144.81 107.73 4.5 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-O 121.57 0.7 . . . . 0.0 110.607 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 30.8 p30 -157.36 154.25 25.23 Favored Pre-proline 0 C--N 1.302 -1.466 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.492 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 12.6 Cg_endo -55.39 -30.23 72.03 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.352 2.701 . . . . 0.0 113.137 -178.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -68.21 -33.5 74.53 Favored 'General case' 0 C--O 1.206 -1.196 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -177.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -70.75 -20.77 62.6 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.867 0.365 . . . . 0.0 111.252 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.492 ' OE1' ' HA ' ' A' ' 50' ' ' PRO . 45.7 mt-30 -79.65 4.17 16.89 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.196 -178.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.582 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 13.7 pt20 -59.42 -39.49 83.66 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.637 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.433 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -67.08 -20.75 65.86 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.498 -177.944 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.3 tp -74.97 -52.27 11.57 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 175.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.7 m -55.31 -27.66 48.41 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.929 -178.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 50.1 mt -88.34 -51.37 5.78 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.958 178.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.44 -50.19 60.35 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.94 0.496 . . . . 0.0 112.129 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.542 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 10.1 t -59.37 -41.43 89.29 Favored 'General case' 0 CA--C 1.492 -1.274 0 C-N-CA 123.412 0.685 . . . . 0.0 109.664 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -72.08 -26.67 62.25 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.944 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.465 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 0.1 OUTLIER -78.27 -48.92 14.67 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.474 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.644 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -67.61 -31.64 71.82 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.651 -177.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.404 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 11.7 pt20 -74.23 -6.96 50.92 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.693 -178.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.7 -24.12 56.2 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 174.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.9 t -81.19 161.84 3.68 Favored 'Isoleucine or valine' 0 C--O 1.248 1.025 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.302 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.452 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 47.7 mt-10 -50.2 141.48 11.3 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.984 0.914 . . . . 0.0 112.263 176.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -62.57 -24.79 67.73 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -174.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.465 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 12.4 pt20 -82.55 -15.36 52.59 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.458 0.647 . . . . 0.0 110.533 178.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.465 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 64.2 m -107.81 -9.34 15.78 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.167 -174.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 76.9 mt-30 -59.33 -40.83 87.57 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.42 ' HA ' HG12 ' A' ' 75' ' ' ILE . 14.5 p -81.2 -24.54 37.4 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.488 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.415 ' O ' ' HG3' ' A' ' 77' ' ' GLN . 7.7 mm-40 -67.74 -32.97 73.95 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.145 179.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.513 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -61.57 -34.89 76.37 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.361 177.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.644 HD11 HD22 ' A' ' 63' ' ' LEU . 30.8 mm -65.12 -37.18 79.57 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.787 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.274 -178.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -66.0 -43.18 88.45 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 -175.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.491 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.4 mt-30 -62.7 -41.22 99.01 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 113.47 -1.696 . . . . 0.0 109.402 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 74' ' ' ALA . 27.8 t -55.17 -46.82 77.87 Favored 'Isoleucine or valine' 0 C--N 1.356 0.859 0 O-C-N 123.769 0.668 . . . . 0.0 109.845 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 75' ' ' ILE . 21.2 t -70.07 -46.7 71.84 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.101 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -173.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -64.85 -35.25 80.53 Favored 'General case' 0 N--CA 1.424 -1.734 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.183 -174.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 3.8 pt20 -85.61 -26.35 26.13 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.979 0.419 . . . . 0.0 111.607 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.476 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -72.27 -44.94 62.07 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.105 0.478 . . . . 0.0 110.22 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -69.21 -29.55 67.54 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.413 ' HB3' ' HA ' ' A' ' 81' ' ' GLN . 7.4 tttt -65.04 -46.26 81.98 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 124.477 1.111 . . . . 0.0 111.332 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 2.7 pt20 -69.07 -23.29 64.01 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-O 121.339 0.59 . . . . 0.0 110.791 -175.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.539 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.4 mm? -86.13 -36.0 19.83 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.918 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -65.13 -37.4 87.32 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 123.327 0.651 . . . . 0.0 110.981 177.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.416 HE21 ' HA ' ' A' ' 85' ' ' GLN . 29.8 pt20 -82.02 0.47 40.13 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.677 0.751 . . . . 0.0 111.069 -178.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -96.68 -120.15 3.83 Favored Glycine 0 N--CA 1.424 -2.119 0 N-CA-C 108.986 -1.646 . . . . 0.0 108.986 175.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -116.45 -56.56 2.28 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-O 121.114 0.483 . . . . 0.0 109.961 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -155.62 -141.07 3.13 Favored Glycine 0 CA--C 1.493 -1.29 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 -178.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.441 ' HA2' HE21 ' A' ' 95' ' ' GLN . . . 95.09 -30.3 8.27 Favored Glycine 0 C--O 1.202 -1.886 0 CA-C-O 119.128 -0.818 . . . . 0.0 113.227 177.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -49.44 -34.62 17.06 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 123.513 0.725 . . . . 0.0 112.812 -175.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -78.8 -33.24 46.38 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.441 HE21 ' HA2' ' A' ' 92' ' ' GLY . 29.9 pt20 -85.45 -39.24 17.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.854 0.835 . . . . 0.0 110.092 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.514 HG13 ' HA ' ' A' ' 37' ' ' THR . 84.5 t -63.72 -22.67 31.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-N 114.328 -1.305 . . . . 0.0 110.501 174.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -46.15 -47.34 17.55 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 123.429 0.455 . . . . 0.0 112.128 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -59.46 -21.55 60.24 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 121.159 0.504 . . . . 0.0 112.028 -178.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.9 tpt -104.07 -45.22 4.79 Favored 'General case' 0 N--CA 1.423 -1.79 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.747 -173.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.26 -24.01 31.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.362 0 CA-C-O 121.077 0.465 . . . . 0.0 110.765 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -22.66 66.48 Favored 'General case' 0 C--N 1.333 -0.118 0 O-C-N 121.91 -0.494 . . . . 0.0 111.017 176.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -66.2 -28.24 68.61 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.37 177.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.536 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -62.85 -35.34 79.65 Favored 'General case' 0 C--O 1.201 -1.476 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 176.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -68.01 -18.87 64.84 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.565 0.698 . . . . 0.0 110.026 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 36.1 mtp -92.67 -13.97 28.73 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.317 -178.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 1.7 mm? -51.15 -44.97 88.82 Favored Pre-proline 0 N--CA 1.476 0.839 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.616 ' HD3' HG21 ' A' ' 75' ' ' ILE . 18.5 Cg_endo -60.67 -31.04 91.61 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 121.387 1.391 . . . . 0.0 112.417 176.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -77.26 -36.02 54.76 Favored 'General case' 0 N--CA 1.427 -1.608 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -178.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -75.11 -49.57 19.19 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.454 0.645 . . . . 0.0 111.254 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 38.8 t -82.19 -2.24 51.65 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.456 -173.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 66.46 42.93 2.74 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 122.765 1.269 . . . . 0.0 110.19 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 68.4 mt -82.4 157.67 23.61 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.057 -178.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -74.74 31.44 0.09 Allowed 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.587 1.155 . . . . 0.0 112.895 -175.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 99.3 m -154.5 160.04 41.32 Favored 'General case' 0 C--N 1.28 -2.419 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -173.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 27.1 p -146.4 144.57 29.82 Favored 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 177.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 70.8 mt . . . . . 0 C--N 1.301 -1.528 0 CA-C-O 118.243 -0.884 . . . . 0.0 109.076 -178.159 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.418 ' HA3' ' O ' ' A' ' 12' ' ' PHE . . . . . . . . 0 CA--C 1.502 -0.765 0 N-CA-C 111.364 -0.695 . . . . 0.0 111.364 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 77.9 mtp180 -95.24 139.88 30.93 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 50.5 m -120.5 145.09 47.63 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-O 120.828 0.347 . . . . 0.0 111.631 -175.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.4 p -79.01 161.33 26.69 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.438 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -85.37 69.71 10.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.438 0.637 . . . . 0.0 109.765 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.8 t -143.01 169.66 17.15 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 8' ' ' PRO . 34.7 mm -129.15 112.61 18.39 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 178.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 7' ' ' ILE . 3.9 Cg_exo -76.92 146.48 84.0 Favored 'Cis proline' 0 C--O 1.246 0.891 0 C-N-CA 123.969 -1.263 . . . . 0.0 109.919 -2.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.44 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 43.4 Cg_endo -64.46 142.51 78.69 Favored 'Trans proline' 0 C--N 1.328 -0.549 0 C-N-CA 122.56 2.173 . . . . 0.0 112.065 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.431 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 42.0 mm -92.35 116.15 32.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.6 m -104.63 121.85 44.39 Favored 'General case' 0 C--N 1.285 -2.198 0 CA-C-O 121.609 0.718 . . . . 0.0 110.736 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.418 ' O ' ' HA3' ' A' ' 1' ' ' GLY . 60.0 m-85 -100.79 142.36 24.46 Favored Pre-proline 0 N--CA 1.427 -1.577 0 CA-C-N 114.69 -1.141 . . . . 0.0 110.386 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -79.64 -10.75 14.37 Favored 'Trans proline' 0 N--CA 1.454 -0.825 0 C-N-CA 122.387 2.058 . . . . 0.0 113.626 -177.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -137.41 -167.31 2.09 Favored 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -173.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 90.56 24.54 28.07 Favored Glycine 0 N--CA 1.432 -1.568 0 N-CA-C 111.399 -0.68 . . . . 0.0 111.399 -175.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.6 HD23 ' H ' ' A' ' 16' ' ' LEU . 1.9 pt? -101.41 -18.13 16.16 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 121.044 0.45 . . . . 0.0 111.352 -176.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -122.47 110.51 15.7 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 -133.29 99.88 14.37 Favored Pre-proline 0 C--N 1.293 -1.876 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.453 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . 32.0 Cg_exo -63.07 -40.73 32.05 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.323 2.016 . . . . 0.0 109.423 174.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.508 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 4.1 mpt_? -126.68 -47.51 1.54 Allowed 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 172.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.26 38.45 4.8 Favored Glycine 0 CA--C 1.473 -2.574 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.487 -177.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 68.1 m -67.98 137.67 55.31 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 114.256 -0.972 . . . . 0.0 110.028 177.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -100.61 112.83 25.27 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-O 121.714 0.769 . . . . 0.0 109.216 175.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.4 HG21 ' HB2' ' A' ' 74' ' ' ALA . 3.9 mp -114.33 139.03 42.3 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.969 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 -175.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.462 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 21.4 ptt-85 -67.12 121.77 16.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.487 0.66 . . . . 0.0 111.616 -175.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.38 -18.91 19.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-N 115.536 -0.757 . . . . 0.0 112.717 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -74.0 -17.23 61.02 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.192 -177.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.518 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 1.2 pt20 -91.85 -19.05 22.93 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.157 -177.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.411 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.3 mm? -96.45 2.33 52.45 Favored 'General case' 0 CA--C 1.476 -1.869 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.306 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.538 ' O ' ' HG2' ' A' ' 34' ' ' MET . 43.5 t30 -52.05 -39.72 60.06 Favored 'General case' 0 C--N 1.307 -1.272 0 O-C-N 124.754 1.283 . . . . 0.0 111.488 -178.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -70.61 -52.77 19.2 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 -175.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.511 ' HB3' HG11 ' A' ' 78' ' ' VAL . 1.2 m -55.26 -50.2 70.11 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 123.866 0.729 . . . . 0.0 110.32 178.103 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -54.01 -59.84 4.12 Favored 'General case' 0 N--CA 1.433 -1.286 0 C-N-CA 123.707 0.803 . . . . 0.0 112.319 176.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.538 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.4 ptm -65.39 -41.05 94.12 Favored 'General case' 0 C--O 1.204 -1.322 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -66.8 -26.23 66.84 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 120.904 0.383 . . . . 0.0 110.302 -176.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 91.7 mt -88.32 -26.5 22.22 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.416 ' HA ' HG13 ' A' ' 96' ' ' VAL . 69.8 p -88.51 -19.25 26.66 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.587 -1.245 . . . . 0.0 111.578 176.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 74.3 p -90.01 139.4 30.64 Favored 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -120.62 86.73 2.62 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -74.94 174.2 9.63 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 114.186 -1.37 . . . . 0.0 111.017 -173.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -106.06 -30.68 9.13 Favored 'General case' 0 C--N 1.284 -2.283 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.917 -172.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.5 10.67 12.35 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.657 -0.817 . . . . 0.0 111.63 -174.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 52.5 mt -71.06 91.11 0.88 Allowed 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.313 175.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.3 mtm180 -93.22 -31.11 14.86 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 121.155 0.502 . . . . 0.0 110.687 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 65.5 mtt -116.91 69.48 0.76 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.866 0.841 . . . . 0.0 109.984 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -127.02 27.99 5.86 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.267 -1.333 . . . . 0.0 109.58 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 49.8 t -81.75 -66.54 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.224 -177.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -154.25 29.42 0.45 Allowed 'General case' 0 C--N 1.307 -1.246 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -82.98 132.91 49.47 Favored Pre-proline 0 C--N 1.284 -2.264 0 CA-C-N 114.15 -1.387 . . . . 0.0 111.477 -169.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -61.39 -17.4 53.15 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 122.695 2.263 . . . . 0.0 110.651 175.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -67.57 -17.72 64.74 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.404 178.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -70.2 -26.51 63.92 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.473 0.654 . . . . 0.0 109.594 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -74.6 5.42 4.83 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.772 -177.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.571 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 26.2 pt20 -53.99 -43.07 69.71 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.743 0.817 . . . . 0.0 110.031 176.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.439 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.0 OUTLIER -66.99 -26.46 66.81 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.321 -178.565 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -75.08 -43.69 51.69 Favored 'General case' 0 C--O 1.209 -1.071 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.6 m -57.87 -30.64 65.98 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.31 0.576 . . . . 0.0 110.79 178.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 56.5 mt -84.77 -56.16 3.73 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.506 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.3 t -62.1 -48.98 77.77 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 124.637 1.175 . . . . 0.0 111.397 -176.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.496 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 43.5 t -59.27 -36.53 75.7 Favored 'General case' 0 C--O 1.215 -0.755 0 C-N-CA 122.397 0.279 . . . . 0.0 110.456 178.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.532 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 8.6 t30 -71.71 -36.56 70.57 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-O 121.217 0.532 . . . . 0.0 110.466 -178.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.518 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 8.2 tp-100 -71.72 -44.24 64.49 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.914 -179.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.496 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.3 pp -72.8 -30.7 64.28 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 121.178 0.513 . . . . 0.0 110.961 -177.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.531 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 11.9 pt20 -72.36 -14.33 61.7 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -176.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.532 ' HG3' ' O ' ' A' ' 61' ' ' ASN . 44.3 mt-10 -80.22 -16.41 54.83 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-O 121.758 0.79 . . . . 0.0 109.363 177.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.423 HG12 ' HB2' ' A' ' 70' ' ' CYS . 18.8 t -79.61 163.13 3.65 Favored 'Isoleucine or valine' 0 C--O 1.25 1.128 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 175.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -51.03 145.09 7.89 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 123.856 0.862 . . . . 0.0 111.334 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.607 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 8.9 ptpp? -58.9 -32.53 69.6 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -176.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.429 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 13.1 pt20 -80.05 -21.61 43.26 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.637 0.732 . . . . 0.0 109.785 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.429 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.8 m -97.66 -13.07 21.72 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.653 -173.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.607 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 50.6 mt-30 -57.29 -46.62 82.97 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 121.175 0.512 . . . . 0.0 110.363 175.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.527 ' HA ' HG12 ' A' ' 75' ' ' ILE . 14.9 p -79.35 -23.63 43.27 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 119.985 -0.686 . . . . 0.0 111.924 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.551 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 10.2 mm-40 -66.62 -35.59 80.55 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 175.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.443 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.83 -25.25 66.49 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 123.551 0.74 . . . . 0.0 110.526 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.699 HG21 ' HD3' ' A' ' 107' ' ' PRO . 30.0 mm -73.8 -27.02 22.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.945 -178.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -75.89 -38.91 57.33 Favored 'General case' 0 CA--C 1.486 -1.494 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -175.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 73' ' ' GLU . 67.6 mm-40 -59.46 -44.15 93.05 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 111.56 -2.563 . . . . 0.0 109.711 -178.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.511 HG11 ' HB3' ' A' ' 32' ' ' CYS . 21.4 t -57.79 -45.72 87.13 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.708 0 O-C-N 123.627 0.579 . . . . 0.0 109.996 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 25.9 t -68.05 -47.04 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.317 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -174.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -55.28 -57.34 12.19 Favored 'General case' 0 N--CA 1.428 -1.571 0 O-C-N 124.836 1.335 . . . . 0.0 110.081 -178.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 9.7 pt20 -68.63 -30.02 68.65 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.02 -39.68 60.96 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 120.917 0.389 . . . . 0.0 111.093 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.448 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 13.7 pt20 -77.58 -37.02 51.42 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.649 -178.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.488 ' CG ' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -70.83 -30.45 66.88 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.34 0.126 . . . . 0.0 111.34 -177.794 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 2.8 pt20 -69.03 -28.68 66.78 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.229 0.537 . . . . 0.0 109.749 -178.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.433 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.3 mm? -87.8 -44.03 11.42 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.935 174.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -66.26 -22.48 66.32 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.47 1.108 . . . . 0.0 113.404 -176.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -66.5 -12.52 57.89 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -179.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 138.48 67.14 0.05 OUTLIER Glycine 0 CA--C 1.48 -2.138 0 C-N-CA 119.676 -1.25 . . . . 0.0 112.171 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -145.96 -58.11 0.31 Allowed 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 129.83 -134.91 8.09 Favored Glycine 0 N--CA 1.427 -1.963 0 N-CA-C 106.152 -2.779 . . . . 0.0 106.152 -174.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.63 -34.82 1.6 Allowed Glycine 0 C--O 1.196 -2.278 0 N-CA-C 115.352 0.901 . . . . 0.0 115.352 171.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -48.06 -29.52 3.62 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.651 1.18 . . . . 0.0 114.118 -176.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.479 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 3.3 pt20 -80.88 -43.72 19.45 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.287 0.565 . . . . 0.0 111.054 177.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.529 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 25.8 pt20 -84.08 -44.27 14.24 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 121.254 0.55 . . . . 0.0 111.649 -173.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.433 HG21 ' HG ' ' A' ' 86' ' ' LEU . 64.3 t -64.53 -23.48 33.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 C-N-CA 124.86 1.264 . . . . 0.0 110.418 178.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -51.11 -47.41 61.96 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 19.4 pt20 -67.82 -16.92 64.33 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.351 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 7.3 tpt -100.1 -49.07 4.41 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.5 p -59.95 -28.12 40.23 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.673 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.426 ' HE3' ' O ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -58.7 -25.05 62.49 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 175.468 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -65.13 -28.94 69.78 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 122.64 0.376 . . . . 0.0 110.529 177.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.423 ' HB2' ' CD1' ' A' ' 36' ' ' LEU . . . -60.78 -28.73 68.97 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 121.465 0.65 . . . . 0.0 110.987 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -73.16 -15.76 61.45 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.561 0.696 . . . . 0.0 110.988 -177.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 46.1 mtt -91.69 -13.97 30.83 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.878 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.474 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 98.3 mt -50.67 -48.09 83.54 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.452 -177.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.699 ' HD3' HG21 ' A' ' 75' ' ' ILE . 19.7 Cg_endo -59.19 -26.95 83.62 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 122.105 1.87 . . . . 0.0 113.113 177.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -83.59 -44.41 14.63 Favored 'General case' 0 N--CA 1.41 -2.438 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -74.93 -24.87 58.56 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.303 -175.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.416 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 25.6 t -98.8 -7.49 27.4 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.915 -178.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.3 t30 58.75 64.82 1.35 Allowed 'General case' 0 C--O 1.239 0.534 0 CA-C-O 122.819 1.295 . . . . 0.0 110.732 -176.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 107' ' ' PRO . 60.8 mt -99.67 158.95 15.41 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 113.272 -1.786 . . . . 0.0 110.07 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -72.7 35.26 0.07 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.806 1.242 . . . . 0.0 112.608 -177.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 40.3 m -157.3 159.71 37.82 Favored 'General case' 0 C--N 1.276 -2.598 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 30.6 m -148.47 143.79 26.96 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 39.7 mm . . . . . 0 C--N 1.311 -1.091 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.316 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.466 ' HA2' ' O ' ' A' ' 14' ' ' ASP . . . . . . . . 0 CA--C 1.502 -0.739 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.5 mmt85 -94.43 126.36 39.65 Favored 'General case' 0 CA--C 1.477 -1.839 0 CA-C-N 117.805 0.803 . . . . 0.0 109.612 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 5.4 m -123.57 146.37 48.19 Favored 'General case' 0 C--N 1.279 -2.465 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.138 -173.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.8 p -73.68 156.26 38.13 Favored 'General case' 0 C--O 1.253 1.267 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -84.1 70.21 10.48 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.9 t -153.14 163.34 40.04 Favored 'General case' 0 N--CA 1.419 -1.996 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -178.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 78.2 mt -129.15 119.01 19.51 Favored Pre-proline 0 C--N 1.301 -1.539 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.26 144.18 72.34 Favored 'Cis proline' 0 C--O 1.246 0.878 0 C-N-CA 123.921 -1.283 . . . . 0.0 112.417 -1.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -71.45 133.74 23.11 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.1 1.866 . . . . 0.0 111.459 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.3 mm -92.01 113.58 27.58 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 178.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 9.2 t -123.06 134.83 54.25 Favored 'General case' 0 N--CA 1.41 -2.442 0 C-N-CA 118.771 -1.171 . . . . 0.0 111.872 -172.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -76.45 151.55 83.14 Favored Pre-proline 0 N--CA 1.427 -1.608 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.747 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.07 -27.63 84.66 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.552 2.168 . . . . 0.0 112.083 -176.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.466 ' O ' ' HA2' ' A' ' 1' ' ' GLY . 13.1 t70 -139.0 -71.11 0.41 Allowed 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.922 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.34 3.72 69.16 Favored Glycine 0 C--N 1.292 -1.893 0 N-CA-C 115.163 0.825 . . . . 0.0 115.163 173.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -125.48 -24.18 3.95 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 118.568 1.184 . . . . 0.0 112.117 -177.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -87.76 119.86 28.5 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 175.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -141.91 81.64 14.4 Favored Pre-proline 0 C--N 1.296 -1.732 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -175.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -79.97 -21.95 7.78 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.236 1.957 . . . . 0.0 112.683 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -133.34 -63.87 0.74 Allowed 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 105.828 -1.915 . . . . 0.0 105.828 176.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -179.18 -60.88 0.08 OUTLIER Glycine 0 CA--C 1.476 -2.385 0 N-CA-C 106.989 -2.445 . . . . 0.0 106.989 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 94.9 m -74.84 129.35 37.52 Favored 'General case' 0 C--N 1.28 -2.423 0 CA-C-N 114.565 -0.817 . . . . 0.0 109.191 172.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -106.75 120.37 41.81 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.42 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.3 mp -114.51 143.8 23.46 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.631 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 -178.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.504 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 39.1 ptt180 -66.79 116.54 7.79 Favored 'General case' 0 N--CA 1.432 -1.355 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -67.51 -15.54 19.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.363 -173.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -84.5 -9.74 58.08 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.6 -177.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 7.7 pt20 -87.23 -20.68 26.58 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 118.963 -1.095 . . . . 0.0 108.157 176.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.404 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.7 mm? -89.25 -5.24 57.78 Favored 'General case' 0 CA--C 1.474 -1.959 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.203 179.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -53.31 -31.99 46.74 Favored 'General case' 0 C--O 1.209 -1.061 0 O-C-N 124.525 1.141 . . . . 0.0 111.101 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -67.23 -58.33 5.03 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.774 -0.371 . . . . 0.0 110.122 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -54.1 -49.98 67.9 Favored 'General case' 0 C--O 1.22 -0.451 0 O-C-N 123.752 0.657 . . . . 0.0 109.71 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -50.18 -58.66 5.09 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 124.579 1.151 . . . . 0.0 112.321 174.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -67.85 -43.46 79.42 Favored 'General case' 0 C--O 1.208 -1.118 0 O-C-N 121.992 -0.443 . . . . 0.0 112.136 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -66.21 -26.22 67.28 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.418 ' CD1' ' HB2' ' A' ' 103' ' ' ALA . 98.7 mt -88.58 -28.32 20.79 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 176.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.463 HG22 HG11 ' A' ' 96' ' ' VAL . 66.1 p -86.31 -11.69 51.49 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 119.305 -0.958 . . . . 0.0 111.341 178.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.5 p -89.08 121.88 31.85 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -107.77 101.66 10.94 Favored 'General case' 0 N--CA 1.423 -1.796 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 168.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.455 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 5.8 t70 -82.09 172.15 13.54 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.604 -174.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -104.28 -31.32 9.63 Favored 'General case' 0 C--N 1.284 -2.245 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -171.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.17 5.74 36.45 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.483 -0.887 . . . . 0.0 111.79 -175.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.455 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 50.9 mt -66.22 90.63 0.15 Allowed 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.405 177.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -120.57 -35.45 3.39 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.492 0.663 . . . . 0.0 109.57 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 58.4 mtt -105.59 5.67 31.48 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.789 -1.096 . . . . 0.0 108.89 -177.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -128.78 95.51 4.12 Favored 'General case' 0 N--CA 1.427 -1.599 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.18 -177.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 61.8 t -116.02 -63.91 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.587 0 N-CA-C 105.829 -1.915 . . . . 0.0 105.829 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -128.42 98.33 5.01 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 104.768 -2.308 . . . . 0.0 104.768 170.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -137.9 137.19 20.87 Favored Pre-proline 0 C--N 1.296 -1.752 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -170.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.556 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 11.0 Cg_endo -54.51 -28.52 55.31 Favored 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 123.445 2.764 . . . . 0.0 113.167 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -78.57 -14.1 59.5 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-O 120.991 0.424 . . . . 0.0 111.312 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -84.03 -17.28 40.92 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.099 0.476 . . . . 0.0 109.739 175.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.556 ' OE1' ' HA ' ' A' ' 50' ' ' PRO . 51.6 mt-30 -78.6 -0.11 28.53 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.025 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.572 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 4.2 pt20 -53.17 -40.38 64.31 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 124.532 1.133 . . . . 0.0 110.351 178.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.409 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.0 OUTLIER -65.92 -25.01 66.95 Favored 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.842 -176.699 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -79.75 -43.6 22.27 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.2 m -57.64 -33.26 68.1 Favored 'General case' 0 C--N 1.321 -0.648 0 O-C-N 123.702 0.626 . . . . 0.0 110.562 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 51.0 mt -84.52 -50.77 7.43 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.734 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.4 t -62.56 -49.56 74.81 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 123.243 0.617 . . . . 0.0 111.574 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.472 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 33.0 t -58.3 -38.62 77.42 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 122.597 0.359 . . . . 0.0 110.115 178.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.56 ' O ' ' HG3' ' A' ' 65' ' ' GLU . 7.5 t30 -73.35 -29.97 63.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.317 0.58 . . . . 0.0 110.686 -177.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -77.15 -43.61 33.33 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.277 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.491 HD22 HD11 ' A' ' 75' ' ' ILE . 3.5 pp -72.23 -34.18 68.12 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.514 -177.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -70.65 -12.97 61.89 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -176.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 61' ' ' ASN . 37.0 mt-10 -84.5 -8.95 58.76 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-O 121.643 0.735 . . . . 0.0 110.294 177.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.405 HG12 ' HB2' ' A' ' 70' ' ' CYS . 39.9 t -83.92 163.23 2.92 Favored 'Isoleucine or valine' 0 C--O 1.247 0.971 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 173.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.464 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.1 mt-10 -51.51 142.69 13.45 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.072 0.549 . . . . 0.0 111.36 177.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -56.91 -33.79 67.3 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -175.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.44 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 19.7 pt20 -78.96 -21.3 47.36 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 121.381 0.61 . . . . 0.0 110.42 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.44 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 49.7 m -100.4 -11.02 20.58 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.473 -174.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 74.2 mt-30 -59.21 -43.81 92.29 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 123.241 0.617 . . . . 0.0 110.881 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.474 ' HA ' HG12 ' A' ' 75' ' ' ILE . 10.9 p -78.32 -23.39 47.07 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 120.258 -0.577 . . . . 0.0 111.728 177.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -68.37 -34.08 75.41 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 121.472 0.653 . . . . 0.0 110.323 177.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.67 -27.83 66.74 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.367 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.55 HG21 ' HD3' ' A' ' 107' ' ' PRO . 28.9 mm -71.64 -34.96 54.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.973 -178.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -64.29 -44.73 90.76 Favored 'General case' 0 C--O 1.249 1.052 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.8 mt-30 -58.28 -45.52 87.75 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 112.682 -2.054 . . . . 0.0 110.914 -176.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.404 HG22 ' HB3' ' A' ' 29' ' ' LEU . 19.6 t -52.45 -44.87 45.08 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.954 0 O-C-N 124.103 0.877 . . . . 0.0 110.06 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.19 -48.88 71.84 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -174.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.97 -39.26 94.15 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.632 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 20.2 pt20 -78.66 -32.65 47.29 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 120.751 0.31 . . . . 0.0 111.698 -179.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.6 -35.06 60.63 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.105 0.479 . . . . 0.0 111.642 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -76.03 -36.0 59.27 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.373 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.7 -32.2 65.57 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.059 -176.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 17.7 pt20 -69.4 -38.15 77.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.038 0.447 . . . . 0.0 110.176 -178.502 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.512 ' HG ' HG21 ' A' ' 96' ' ' VAL . 3.7 mm? -74.91 -33.34 61.99 Favored 'General case' 0 C--O 1.246 0.903 0 CA-C-O 121.074 0.464 . . . . 0.0 110.713 178.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.47 ' HA ' ' NE2' ' A' ' 93' ' ' GLN . 50.0 tt0 -60.0 -43.59 95.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.948 -1.023 . . . . 0.0 110.511 178.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -88.92 -2.45 58.6 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.773 -176.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -98.57 -82.09 1.64 Allowed Glycine 0 N--CA 1.425 -2.053 0 CA-C-N 115.424 -0.807 . . . . 0.0 113.041 -177.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -134.95 -23.4 1.54 Allowed 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -172.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 132.98 -127.89 4.92 Favored Glycine 0 CA--C 1.473 -2.556 0 N-CA-C 105.966 -2.854 . . . . 0.0 105.966 -170.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.542 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 78.86 -20.66 4.36 Favored Glycine 0 C--O 1.192 -2.487 0 CA-C-N 118.605 1.202 . . . . 0.0 114.151 174.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.47 ' NE2' ' HA ' ' A' ' 87' ' ' GLN . 46.3 mt-30 -50.73 -37.95 44.63 Favored 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 125.551 1.541 . . . . 0.0 110.71 -175.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -78.57 -37.6 42.27 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.843 -178.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.542 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 10.5 pt20 -81.02 -42.55 20.93 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.345 0.593 . . . . 0.0 110.025 -178.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.512 HG21 ' HG ' ' A' ' 86' ' ' LEU . 90.3 t -63.96 -24.57 36.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 CA-C-N 114.823 -1.081 . . . . 0.0 110.205 177.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.429 ' HA ' HG12 ' A' ' 100' ' ' VAL . 28.3 tt0 -49.0 -44.5 41.28 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.05 0.54 . . . . 0.0 112.003 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 13.9 pt20 -69.4 -17.84 63.7 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -176.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 7.3 tpt -98.87 -47.18 5.38 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.429 HG12 ' HA ' ' A' ' 97' ' ' GLN . 14.6 p -62.76 -25.0 37.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.396 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -20.17 65.4 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.644 -0.66 . . . . 0.0 112.089 175.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -66.41 -28.59 68.74 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 174.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.483 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -64.25 -24.41 67.65 Favored 'General case' 0 C--O 1.211 -0.949 0 CA-C-O 121.353 0.597 . . . . 0.0 110.562 178.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -75.17 -16.4 60.51 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.526 0.679 . . . . 0.0 110.38 -179.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . 0.459 ' O ' ' HG2' ' A' ' 109' ' ' GLN . 46.0 mtt -88.18 -14.91 37.42 Favored 'General case' 0 CA--C 1.491 -1.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.423 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.483 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 93.4 mt -49.46 -49.96 68.35 Favored Pre-proline 0 C--N 1.322 -0.589 0 O-C-N 123.654 0.596 . . . . 0.0 112.537 -177.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.55 ' HD3' HG21 ' A' ' 75' ' ' ILE . 20.8 Cg_endo -62.22 -23.97 75.79 Favored 'Trans proline' 0 C--N 1.365 1.421 0 C-N-CA 121.734 1.623 . . . . 0.0 113.267 177.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -82.75 -45.67 14.09 Favored 'General case' 0 N--CA 1.417 -2.119 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.459 ' HG2' ' O ' ' A' ' 105' ' ' MET . 10.6 mm100 -74.15 -39.15 63.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.958 -175.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 10.2 t -86.16 -3.62 59.0 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -177.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 58.33 61.79 2.18 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 124.701 1.2 . . . . 0.0 109.884 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.445 ' C ' ' H ' ' A' ' 114' ' ' CYS . 52.7 mt -94.59 160.16 14.76 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.591 -178.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -67.2 30.66 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.494 0 C-N-CA 124.935 1.294 . . . . 0.0 113.218 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.445 ' H ' ' C ' ' A' ' 112' ' ' LEU . 67.7 m -155.25 143.77 20.44 Favored 'General case' 0 C--N 1.274 -2.69 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -176.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 38.0 m -133.08 116.9 16.9 Favored 'General case' 0 C--N 1.286 -2.16 0 CA-C-O 120.873 0.368 . . . . 0.0 110.152 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.9 mm . . . . . 0 C--N 1.31 -1.126 0 N-CA-C 107.035 -1.469 . . . . 0.0 107.035 178.368 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -1.002 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mmm180 -95.08 151.28 19.33 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.795 ' SG ' ' HB2' ' A' ' 9' ' ' PRO . 4.0 t -146.64 161.25 40.95 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.5 p -85.47 157.2 20.52 Favored 'General case' 0 C--N 1.283 -2.312 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.304 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -87.74 76.58 8.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 177.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.7 m -147.41 160.26 42.76 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.153 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 69.4 mt -129.54 111.6 17.75 Favored Pre-proline 0 C--N 1.309 -1.156 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -73.65 143.83 79.08 Favored 'Cis proline' 0 C--O 1.241 0.648 0 C-N-CA 124.362 -1.099 . . . . 0.0 111.78 -0.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.795 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 74.5 Cg_endo -72.75 155.9 53.55 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.586 2.191 . . . . 0.0 112.681 -178.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.8 mm -110.96 112.0 38.65 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.493 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 64.6 m -103.51 143.89 32.12 Favored 'General case' 0 C--N 1.298 -1.653 0 C-N-CA 119.124 -1.03 . . . . 0.0 110.285 -174.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -98.36 153.23 38.12 Favored Pre-proline 0 C--N 1.296 -1.719 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.73 -175.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.79 45.96 1.92 Allowed 'Trans proline' 0 C--N 1.358 1.067 0 C-N-CA 123.638 2.892 . . . . 0.0 110.275 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.76 -53.0 63.31 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 125.994 1.718 . . . . 0.0 112.146 -177.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -106.04 -43.02 1.57 Allowed Glycine 0 C--N 1.291 -1.945 0 C-N-CA 120.237 -0.983 . . . . 0.0 110.668 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.4 pp -166.42 169.85 13.53 Favored 'General case' 0 N--CA 1.415 -2.184 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 -178.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -140.71 19.25 2.34 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-O 121.231 0.538 . . . . 0.0 110.445 174.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.48 ' HB3' ' HB3' ' A' ' 23' ' ' GLN . 3.9 p-10 -72.44 118.17 65.3 Favored Pre-proline 0 CA--C 1.514 -0.437 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.148 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 18' ' ' ASN . 11.7 Cg_exo -75.35 -24.23 12.48 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.737 1.625 . . . . 0.0 111.884 177.256 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.465 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 1.5 mpt_? -132.26 -63.43 0.8 Allowed 'General case' 0 CA--C 1.483 -1.606 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 175.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -150.03 -52.21 0.02 OUTLIER Glycine 0 CA--C 1.474 -2.479 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.736 -177.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.5 m -85.12 128.66 34.74 Favored 'General case' 0 C--N 1.28 -2.423 0 CA-C-O 121.139 0.495 . . . . 0.0 110.487 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.48 ' HB3' ' HB3' ' A' ' 18' ' ' ASN . 23.4 pt20 -106.92 103.28 12.66 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.415 177.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.408 HG21 ' HB2' ' A' ' 74' ' ' ALA . 2.9 mp -108.54 132.34 56.7 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.557 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 -179.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.47 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 18.9 ptt-85 -67.42 121.42 15.73 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 123.799 0.687 . . . . 0.0 110.607 -177.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -64.58 -15.81 18.37 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.403 ' HG2' ' HB2' ' A' ' 25' ' ' ARG . 20.9 pt20 -75.56 -8.89 57.91 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.523 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.596 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 1.4 pt20 -98.49 -18.2 18.33 Favored 'General case' 0 N--CA 1.42 -1.959 0 C-N-CA 118.861 -1.136 . . . . 0.0 109.989 178.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -99.33 -3.84 33.07 Favored 'General case' 0 CA--C 1.476 -1.874 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.68 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.51 ' HA ' HE21 ' A' ' 33' ' ' GLN . 26.7 p30 -54.24 -32.24 55.5 Favored 'General case' 0 C--N 1.311 -1.1 0 O-C-N 124.022 0.826 . . . . 0.0 112.938 -178.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -68.8 -56.82 6.8 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.455 ' HB3' HG11 ' A' ' 78' ' ' VAL . 1.2 m -55.35 -49.82 71.25 Favored 'General case' 0 C--O 1.213 -0.827 0 O-C-N 123.869 0.731 . . . . 0.0 110.172 178.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.51 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.0 tt0 -51.93 -57.2 10.13 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 123.489 0.716 . . . . 0.0 112.425 176.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 26.3 ptt? -68.31 -41.44 80.85 Favored 'General case' 0 CA--C 1.507 -0.709 0 C-N-CA 120.242 -0.583 . . . . 0.0 112.418 -174.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 59.2 m-70 -72.05 -24.41 61.52 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.436 ' O ' ' HB3' ' A' ' 99' ' ' MET . 99.3 mt -88.65 -21.76 23.79 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 119.916 -0.713 . . . . 0.0 111.988 177.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.465 ' HA ' HG13 ' A' ' 96' ' ' VAL . 32.1 p -85.73 -21.15 28.4 Favored 'General case' 0 C--N 1.298 -1.651 0 C-N-CA 118.177 -1.409 . . . . 0.0 111.548 176.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.8 m -89.8 122.97 33.38 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.648 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -83.28 101.28 11.17 Favored 'General case' 0 N--CA 1.437 -1.108 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 171.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -76.34 177.98 6.87 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.508 -1.223 . . . . 0.0 111.106 -175.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -97.74 -38.93 9.29 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -171.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.82 4.6 9.37 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.943 0.878 . . . . 0.0 111.534 -175.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 69.8 mt -75.54 -8.86 57.84 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.354 176.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -55.07 -29.19 57.02 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 124.477 1.111 . . . . 0.0 112.433 177.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 65.7 mtm -120.12 21.59 11.74 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -134.87 95.41 3.32 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.628 -177.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 42.7 t -84.08 -60.96 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 176.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -140.1 86.7 2.1 Favored 'General case' 0 C--N 1.309 -1.187 0 C-N-CA 125.134 1.373 . . . . 0.0 107.597 173.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -120.48 150.57 52.36 Favored Pre-proline 0 C--N 1.306 -1.319 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.392 -175.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.418 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 36.9 Cg_endo -61.63 -23.13 75.96 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.985 2.457 . . . . 0.0 112.588 -177.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.7 mtpt -65.24 -23.13 66.98 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 178.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -68.89 -29.79 68.15 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.154 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 50' ' ' PRO . 10.8 pt20 -79.72 12.8 2.4 Favored 'General case' 0 C--O 1.211 -0.922 0 C-N-CA 119.698 -0.801 . . . . 0.0 112.205 -177.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.415 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 13.2 pt20 -61.1 -47.39 86.5 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-O 121.686 0.755 . . . . 0.0 109.13 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.4 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.4 p-80 -72.13 -20.79 61.57 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.637 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.83 -44.12 56.63 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 176.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.0 m -56.43 -34.72 67.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.069 0.461 . . . . 0.0 110.317 177.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 45.9 mt -78.49 -51.55 9.83 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-O 121.233 0.54 . . . . 0.0 110.838 178.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.9 t -63.57 -49.75 72.19 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 124.417 1.087 . . . . 0.0 111.076 -176.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.483 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 12.8 t -58.02 -37.99 75.35 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.613 0.765 . . . . 0.0 110.479 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -75.31 -25.05 57.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.514 0.673 . . . . 0.0 110.789 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.596 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 8.2 tp-100 -83.22 -42.91 16.7 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.321 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.483 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 4.0 pp -68.92 -28.29 66.53 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.609 0.718 . . . . 0.0 110.572 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.444 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 12.0 pt20 -75.77 -6.83 52.51 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.265 -177.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -84.03 -11.75 56.26 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-O 121.721 0.772 . . . . 0.0 109.12 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 12.4 t -89.25 164.5 2.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 CA-C-N 114.902 -1.045 . . . . 0.0 108.767 177.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -46.79 144.49 2.35 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.628 0.771 . . . . 0.0 111.031 173.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.539 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -61.3 -33.47 73.64 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 114.017 1.118 . . . . 0.0 114.017 -176.348 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.458 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 28.4 pt20 -75.53 -25.12 56.92 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.764 0.792 . . . . 0.0 110.004 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.458 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 60.1 m -94.27 -13.63 26.32 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.099 -174.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.539 ' OE1' ' HA ' ' A' ' 68' ' ' LYS . 54.3 mt-30 -56.87 -43.86 81.63 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 121.211 0.529 . . . . 0.0 110.202 175.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.476 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.8 p -79.9 -23.81 41.57 Favored 'General case' 0 N--CA 1.435 -1.213 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.414 178.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -68.88 -32.0 71.34 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.251 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 77' ' ' GLN . . . -62.28 -26.17 68.25 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 123.59 0.756 . . . . 0.0 110.183 177.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.527 HG21 ' HD3' ' A' ' 107' ' ' PRO . 31.0 mm -72.63 -31.2 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.356 -178.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -72.66 -40.81 66.05 Favored 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -175.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 53.2 mm-40 -57.6 -42.33 83.02 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 112.256 -2.247 . . . . 0.0 110.927 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.455 HG11 ' HB3' ' A' ' 32' ' ' CYS . 23.4 t -58.94 -46.49 91.39 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.79 0 O-C-N 123.833 0.708 . . . . 0.0 109.255 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.424 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 19.7 t -69.17 -42.24 81.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -58.88 -48.4 81.53 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.677 -178.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 9.1 pt20 -76.26 -35.55 58.89 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 123.122 0.264 . . . . 0.0 111.386 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.412 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -69.97 -35.92 74.81 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.901 0.381 . . . . 0.0 111.681 -178.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 28.9 pt20 -79.06 -35.46 42.48 Favored 'General case' 0 C--N 1.308 -1.215 0 C-N-CA 118.798 -1.161 . . . . 0.0 110.537 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.46 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -69.39 -30.16 68.08 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.097 -177.314 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -71.35 -37.99 71.66 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 121.216 0.531 . . . . 0.0 109.621 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.496 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 2.6 mm? -78.44 -35.45 46.82 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.471 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -58.16 -43.39 87.38 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.222 0.609 . . . . 0.0 111.547 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.1 pt20 -81.85 -14.42 56.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.311 0.577 . . . . 0.0 110.141 -178.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -84.87 -88.82 0.87 Allowed Glycine 0 N--CA 1.428 -1.848 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.262 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -125.79 -18.34 5.18 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.28 0.562 . . . . 0.0 111.873 -175.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.496 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 127.45 -104.2 0.68 Allowed Glycine 0 CA--C 1.476 -2.355 0 N-CA-C 106.713 -2.555 . . . . 0.0 106.713 -171.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.408 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 75.33 -32.21 1.15 Allowed Glycine 0 C--O 1.196 -2.247 0 N-CA-C 115.634 1.013 . . . . 0.0 115.634 170.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -47.36 -34.27 6.77 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.504 1.122 . . . . 0.0 112.291 -178.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -68.91 -45.08 71.8 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.528 178.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 4.1 pt20 -82.93 -47.18 12.07 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 121.074 0.464 . . . . 0.0 110.171 -176.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.465 HG13 ' HA ' ' A' ' 37' ' ' THR . 91.5 t -59.41 -22.69 23.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 125.66 1.584 . . . . 0.0 110.224 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -43.02 -45.12 5.02 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.165 0.986 . . . . 0.0 112.67 178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 3.7 pt20 -68.63 -17.77 64.17 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 7.7 tpt -101.96 -47.34 4.6 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.8 p -65.05 -24.13 34.79 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 120.831 0.348 . . . . 0.0 111.354 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.506 ' HA ' HE21 ' A' ' 104' ' ' GLN . 15.2 ptpt -62.3 -24.82 67.52 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 121.748 -0.595 . . . . 0.0 110.956 174.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.413 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 26.3 mtpp -63.55 -30.9 71.95 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.49 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -59.9 -38.72 83.06 Favored 'General case' 0 C--O 1.204 -1.34 0 O-C-N 123.722 0.638 . . . . 0.0 109.861 176.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.506 HE21 ' HA ' ' A' ' 101' ' ' LYS . 38.6 mt-30 -72.79 -16.9 61.62 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.632 -177.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 43.4 mtt -82.23 -21.2 36.47 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.879 -0.513 . . . . 0.0 110.517 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 7.5 mp -47.43 -46.59 58.59 Favored Pre-proline 0 N--CA 1.481 1.076 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.527 ' HD3' HG21 ' A' ' 75' ' ' ILE . 18.8 Cg_endo -62.3 -22.38 74.03 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 120.897 1.356 . . . . 0.0 112.871 178.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 61.7 m-80 -89.35 -42.79 11.35 Favored 'General case' 0 N--CA 1.403 -2.799 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -73.56 -36.74 65.64 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.831 -177.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.404 ' SG ' HD21 ' A' ' 112' ' ' LEU . 16.1 t -89.94 -3.8 57.84 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 60.3 t30 55.43 63.4 2.1 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 124.779 1.232 . . . . 0.0 110.276 -177.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.419 HD21 HD11 ' A' ' 63' ' ' LEU . 52.4 mt -93.28 159.75 15.13 Favored 'General case' 0 C--N 1.284 -2.276 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.305 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 12.4 mm-40 -70.43 35.03 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.392 1.077 . . . . 0.0 113.405 -175.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 72' ' ' CYS . 57.4 m -158.02 156.4 31.05 Favored 'General case' 0 C--N 1.284 -2.249 0 C-N-CA 125.171 1.388 . . . . 0.0 107.284 -175.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 42.1 m -142.46 120.95 12.45 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.45 HG21 ' HB3' ' A' ' 104' ' ' GLN . 67.7 mt . . . . . 0 C--N 1.299 -1.619 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.769 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -71.9 143.41 49.36 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.7 m -134.34 161.21 35.61 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.46 -177.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 43.2 p -90.29 158.06 17.36 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 175.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -87.26 72.0 9.93 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.0 p -145.73 159.42 43.19 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 75.3 mt -128.83 117.24 19.38 Favored Pre-proline 0 C--N 1.299 -1.598 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -71.49 146.35 85.12 Favored 'Cis proline' 0 C--O 1.242 0.694 0 C-N-CA 124.109 -1.205 . . . . 0.0 112.3 0.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -71.97 145.83 45.94 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.619 2.213 . . . . 0.0 113.083 -177.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.6 mm -96.2 108.78 21.73 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 176.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.7 m -108.19 135.58 49.29 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-O 121.473 0.654 . . . . 0.0 112.271 -175.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -88.64 154.82 50.86 Favored Pre-proline 0 C--N 1.305 -1.35 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.268 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -37.45 -56.81 0.8 Allowed 'Trans proline' 0 C--N 1.368 1.576 0 C-N-CA 124.198 3.265 . . . . 0.0 113.997 -178.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -152.55 -64.15 0.16 Allowed 'General case' 0 CA--C 1.502 -0.898 0 C-N-CA 120.478 -0.489 . . . . 0.0 111.086 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . 0.423 ' HA3' HE22 ' A' ' 23' ' ' GLN . . . -157.07 107.27 0.32 Allowed Glycine 0 N--CA 1.418 -2.506 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 -176.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.622 HD23 ' H ' ' A' ' 16' ' ' LEU . 2.2 pt? -83.12 -13.32 55.87 Favored 'General case' 0 C--N 1.278 -2.517 0 CA-C-N 115.132 -0.534 . . . . 0.0 111.55 -179.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -99.47 94.79 6.6 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.767 0.794 . . . . 0.0 111.99 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -128.73 82.71 68.1 Favored Pre-proline 0 C--N 1.292 -1.92 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.962 175.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -65.5 -27.12 54.31 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 123.485 2.79 . . . . 0.0 113.473 -174.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.49 ' HD2' ' H ' ' A' ' 20' ' ' ARG . 0.2 OUTLIER -96.49 -51.18 4.44 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 -178.039 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 153.74 -55.68 0.43 Allowed Glycine 0 CA--C 1.457 -3.565 0 N-CA-C 107.48 -2.248 . . . . 0.0 107.48 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.466 ' SG ' ' HG3' ' A' ' 73' ' ' GLU . 95.2 m -84.51 134.62 34.42 Favored 'General case' 0 N--CA 1.405 -2.694 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 171.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.423 HE22 ' HA3' ' A' ' 15' ' ' GLY . 11.1 pt20 -106.2 113.06 26.36 Favored 'General case' 0 C--N 1.288 -2.099 0 CA-C-O 122.036 0.922 . . . . 0.0 108.82 173.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.442 HD11 ' HB2' ' A' ' 73' ' ' GLU . 3.3 mp -106.94 146.08 13.72 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.504 0 CA-C-N 114.116 -1.402 . . . . 0.0 107.785 -174.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.469 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 34.2 ptt180 -65.64 120.16 12.44 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-O 121.551 0.691 . . . . 0.0 109.171 -178.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 pp -69.88 -15.98 19.84 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.466 -175.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -71.67 -23.21 61.62 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.488 -177.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.497 ' HB2' ' CG ' ' A' ' 62' ' ' GLN . 6.9 pt20 -83.83 -18.8 36.37 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.587 -178.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -94.31 -4.06 49.36 Favored 'General case' 0 CA--C 1.48 -1.719 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.236 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.529 ' O ' ' HG2' ' A' ' 34' ' ' MET . 3.4 t-20 -57.15 -32.02 65.96 Favored 'General case' 0 C--N 1.317 -0.816 0 O-C-N 123.89 0.744 . . . . 0.0 110.646 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -69.53 -53.74 17.54 Favored 'General case' 0 C--O 1.221 -0.406 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.418 ' HB3' HG11 ' A' ' 78' ' ' VAL . 0.4 OUTLIER -55.61 -51.69 66.3 Favored 'General case' 0 C--O 1.222 -0.393 0 O-C-N 123.605 0.566 . . . . 0.0 109.832 178.778 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.466 HE21 ' HG3' ' A' ' 81' ' ' GLN . 17.0 tt0 -51.77 -56.58 13.02 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 123.899 0.88 . . . . 0.0 112.468 176.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.529 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 26.6 ptm -69.92 -42.87 72.75 Favored 'General case' 0 CA--C 1.504 -0.81 0 C-N-CA 119.967 -0.693 . . . . 0.0 112.263 -174.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -67.35 -27.12 66.86 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.916 -175.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 94.8 mt -88.63 -28.48 20.62 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 112.17 0.434 . . . . 0.0 112.17 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.518 ' HA ' HG13 ' A' ' 96' ' ' VAL . 35.2 p -84.64 -21.67 30.18 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 118.233 -1.387 . . . . 0.0 111.451 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.8 p -91.36 121.65 33.28 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -89.55 90.18 8.15 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 166.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -76.61 169.88 17.46 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.473 -171.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -100.91 -33.64 10.12 Favored 'General case' 0 C--N 1.283 -2.286 0 CA-C-N 115.723 -0.671 . . . . 0.0 112.724 -168.154 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.68 7.23 21.12 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.054 -1.058 . . . . 0.0 111.974 -177.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 73.5 mt -80.1 37.84 0.39 Allowed 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 124.065 0.946 . . . . 0.0 110.582 177.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -73.44 -23.85 60.17 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -172.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 84.8 mtp -110.2 13.37 23.11 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-O 121.488 0.661 . . . . 0.0 109.512 177.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -137.68 84.09 2.02 Favored 'General case' 0 N--CA 1.428 -1.552 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.19 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 57.3 t -93.67 -68.37 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.464 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -134.66 16.6 3.62 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 173.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.408 ' HB3' ' HD2' ' A' ' 50' ' ' PRO . 16.3 m120 -64.65 163.92 24.15 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 113.863 -1.517 . . . . 0.0 109.29 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 49' ' ' ASN . 17.8 Cg_endo -58.51 -19.5 44.72 Favored 'Trans proline' 0 C--N 1.367 1.548 0 C-N-CA 122.595 2.196 . . . . 0.0 112.117 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.3 mmmm -59.64 -23.64 63.2 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.51 175.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -70.2 -15.45 62.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.942 0.401 . . . . 0.0 111.471 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -74.96 0.7 14.93 Favored 'General case' 0 C--N 1.313 -0.999 0 O-C-N 122.189 -0.319 . . . . 0.0 110.8 176.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.629 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 26.6 pt20 -55.07 -54.05 48.01 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.65 0.78 . . . . 0.0 110.275 175.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.458 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.8 p-80 -74.75 -22.17 58.93 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.54 -176.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -70.3 -44.89 67.41 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 175.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 51.0 m -57.37 -36.3 71.06 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 123.563 0.54 . . . . 0.0 110.574 178.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.629 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 35.9 mt -80.85 -53.19 6.69 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.627 -178.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 19.6 t -66.2 -48.34 70.95 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.198 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.502 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 32.8 t -58.46 -34.23 70.63 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 117.868 0.304 . . . . 0.0 110.653 176.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -76.41 -24.68 54.02 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.626 0.727 . . . . 0.0 110.6 -178.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.497 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 6.1 tp-100 -85.58 -46.88 10.39 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.639 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.541 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -64.27 -31.61 72.88 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.673 -177.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.417 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 7.3 pt20 -70.87 -10.28 59.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.641 -177.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -75.87 -21.07 57.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 122.062 0.934 . . . . 0.0 108.841 176.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.468 HG12 ' HB2' ' A' ' 70' ' ' CYS . 8.9 t -82.26 163.61 3.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 176.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.59 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 31.9 mt-10 -54.84 144.07 23.8 Favored 'General case' 0 C--O 1.207 -1.182 0 CA-C-O 119.268 -0.396 . . . . 0.0 110.695 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.437 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 18.1 ptpt -57.8 -31.78 66.9 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -77.18 -20.17 55.79 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.075 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.468 ' HB2' HG12 ' A' ' 66' ' ' VAL . 63.0 m -103.97 -10.67 17.94 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.866 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.59 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 29.2 mt-30 -62.82 -37.76 88.03 Favored 'General case' 0 C--O 1.217 -0.637 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.498 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.8 p -80.96 -24.51 38.03 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.549 176.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.466 ' HG3' ' SG ' ' A' ' 22' ' ' CYS . 8.4 mm-40 -67.22 -36.1 80.97 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 177.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.412 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -61.1 -28.5 69.13 Favored 'General case' 0 N--CA 1.443 -0.821 0 C-N-CA 123.577 0.751 . . . . 0.0 110.645 178.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.541 HD11 HD22 ' A' ' 63' ' ' LEU . 31.5 mm -69.68 -37.51 74.16 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.598 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -65.55 -41.11 93.36 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -177.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.465 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.8 mt-30 -61.03 -38.63 86.82 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 113.505 -1.68 . . . . 0.0 110.621 -178.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.418 HG11 ' HB3' ' A' ' 32' ' ' CYS . 20.8 t -61.11 -44.58 98.58 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.906 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 29.0 t -65.63 -47.77 84.99 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.894 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -174.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.414 ' CD ' HH21 ' A' ' 20' ' ' ARG . 52.6 mt-10 -58.68 -50.63 73.15 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.68 -178.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.466 ' HG3' HE21 ' A' ' 33' ' ' GLN . 11.0 pt20 -71.82 -31.72 66.83 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.835 0.35 . . . . 0.0 111.886 -177.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.72 -38.23 54.67 Favored 'General case' 0 C--N 1.315 -0.908 0 O-C-N 122.131 -0.356 . . . . 0.0 111.307 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -72.95 -34.08 66.3 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.357 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.551 ' O ' ' HG2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -70.67 -38.12 73.74 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.46 -178.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -68.07 -37.97 81.87 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.136 -175.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.479 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.6 mm? -76.64 -33.73 58.33 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.872 178.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.417 ' HB2' ' NE2' ' A' ' 93' ' ' GLN . 10.0 tt0 -64.85 -37.3 87.16 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.252 0.549 . . . . 0.0 110.509 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 84' ' ' LYS . 4.6 pt20 -90.49 0.33 57.36 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.667 0.746 . . . . 0.0 110.422 178.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -99.29 -100.6 2.26 Favored Glycine 0 N--CA 1.421 -2.337 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.896 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -118.18 -5.88 10.89 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.008 0.432 . . . . 0.0 112.025 -174.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.479 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 116.57 -101.37 0.97 Allowed Glycine 0 CA--C 1.468 -2.867 0 N-CA-C 106.825 -2.51 . . . . 0.0 106.825 -173.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.466 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 72.4 -34.81 0.67 Allowed Glycine 0 C--O 1.196 -2.229 0 N-CA-C 116.082 1.193 . . . . 0.0 116.082 170.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.417 ' NE2' ' HB2' ' A' ' 87' ' ' GLN . 90.8 mt-30 -46.53 -34.25 4.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 118.322 1.061 . . . . 0.0 112.866 -176.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -71.41 -42.19 68.63 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 120.982 0.42 . . . . 0.0 111.449 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 92' ' ' GLY . 20.5 pt20 -82.83 -47.88 11.39 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 -176.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.518 HG13 ' HA ' ' A' ' 37' ' ' THR . 80.7 t -59.04 -22.83 22.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 125.461 1.504 . . . . 0.0 110.725 178.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -44.48 -46.15 9.56 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 123.562 0.745 . . . . 0.0 112.502 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -67.57 -18.02 64.85 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -176.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.8 tpt -102.29 -48.24 4.25 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.0 p -63.72 -24.09 34.96 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 CA-C-O 121.06 0.457 . . . . 0.0 111.183 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.565 ' HA ' HE21 ' A' ' 104' ' ' GLN . 0.0 OUTLIER -65.49 -21.02 66.59 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.703 -0.623 . . . . 0.0 111.539 176.228 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -67.33 -27.89 67.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 176.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.454 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -62.99 -32.11 73.38 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 121.599 0.714 . . . . 0.0 109.807 175.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.565 HE21 ' HA ' ' A' ' 101' ' ' LYS . 43.8 mt-30 -74.4 -15.46 60.92 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.645 -178.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 61.2 mtp -90.33 -18.29 25.81 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.793 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.454 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 96.4 mt -50.25 -51.23 65.0 Favored Pre-proline 0 C--N 1.323 -0.544 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -176.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.511 ' HD3' HG21 ' A' ' 75' ' ' ILE . 18.0 Cg_endo -60.79 -24.92 80.13 Favored 'Trans proline' 0 C--N 1.362 1.282 0 C-N-CA 121.73 1.62 . . . . 0.0 113.169 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -84.47 -41.0 17.03 Favored 'General case' 0 N--CA 1.414 -2.251 0 CA-C-O 121.157 0.503 . . . . 0.0 109.822 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -80.37 -37.32 32.58 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.123 -176.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.415 ' SG ' HD21 ' A' ' 112' ' ' LEU . 24.2 t -84.38 -6.04 59.34 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.199 0.524 . . . . 0.0 109.693 -178.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 57.45 65.03 1.43 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 122.989 1.376 . . . . 0.0 110.784 -177.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.446 HD22 HE21 ' A' ' 71' ' ' GLN . 41.9 mt -93.67 159.41 15.23 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 113.272 -1.785 . . . . 0.0 109.363 178.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -75.88 35.79 0.13 Allowed 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 121.658 0.742 . . . . 0.0 112.094 -174.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.401 ' H ' ' C ' ' A' ' 112' ' ' LEU . 78.7 m -154.0 149.06 26.82 Favored 'General case' 0 C--N 1.285 -2.23 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 -176.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 25.7 p -136.1 132.38 36.04 Favored 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 118.114 0.416 . . . . 0.0 110.189 -176.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 26.6 mm . . . . . 0 C--N 1.308 -1.205 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 178.738 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.591 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.481 ' HG2' HD21 ' A' ' 18' ' ' ASN . 12.0 mmt180 -95.14 127.52 41.26 Favored 'General case' 0 CA--C 1.471 -2.063 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 58.3 m -118.95 140.81 49.37 Favored 'General case' 0 C--N 1.26 -3.297 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.288 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.9 p -71.27 151.11 44.55 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.773 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -79.12 72.0 5.65 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.359 0.6 . . . . 0.0 110.355 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.9 t -149.08 163.92 36.17 Favored 'General case' 0 N--CA 1.419 -2.02 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.3 mt -129.75 118.82 18.87 Favored Pre-proline 0 C--N 1.304 -1.391 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -75.32 140.93 69.67 Favored 'Cis proline' 0 C--O 1.243 0.727 0 C-N-CA 123.809 -1.329 . . . . 0.0 110.876 -1.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.416 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 43.7 Cg_endo -67.08 152.01 80.76 Favored 'Trans proline' 0 C--O 1.244 0.79 0 C-N-CA 122.954 2.436 . . . . 0.0 113.21 -175.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.7 mm -102.81 118.26 49.45 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 75.8 m -105.81 130.75 53.73 Favored 'General case' 0 C--N 1.29 -1.983 0 CA-C-O 121.62 0.724 . . . . 0.0 111.625 -176.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -114.05 152.53 45.86 Favored Pre-proline 0 C--N 1.29 -2.013 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.83 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -57.34 -46.02 30.76 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 122.417 2.078 . . . . 0.0 110.235 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.439 ' HA ' ' ND2' ' A' ' 18' ' ' ASN . 15.8 t0 -147.11 160.71 42.1 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 115.049 -0.978 . . . . 0.0 108.532 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -130.98 -13.54 1.96 Allowed Glycine 0 N--CA 1.413 -2.838 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.32 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -170.27 -50.49 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 117.124 0.462 . . . . 0.0 111.474 -178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -170.08 100.65 0.29 Allowed 'General case' 0 C--N 1.294 -1.815 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.764 -174.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.481 HD21 ' HG2' ' A' ' 2' ' ' ARG . 94.3 m-20 -117.93 85.67 23.61 Favored Pre-proline 0 C--N 1.312 -1.045 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.375 176.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -82.48 -15.65 8.55 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.006 1.804 . . . . 0.0 110.586 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.435 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 0.7 OUTLIER -140.91 -47.22 0.4 Allowed 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 176.901 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 144.7 -63.92 0.47 Allowed Glycine 0 CA--C 1.478 -2.236 0 N-CA-C 108.977 -1.649 . . . . 0.0 108.977 178.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.7 m -66.63 135.58 54.31 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 114.577 -0.811 . . . . 0.0 109.033 171.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -99.95 91.74 4.95 Favored 'General case' 0 N--CA 1.422 -1.831 0 CA-C-O 122.439 1.114 . . . . 0.0 110.978 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.409 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 3.5 mp -94.14 138.39 20.67 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.818 0 N-CA-C 105.328 -2.101 . . . . 0.0 105.328 177.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.463 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.5 ptt-85 -71.66 120.54 17.39 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.057 0.456 . . . . 0.0 110.0 -176.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -63.53 -16.31 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-O 121.288 0.566 . . . . 0.0 112.236 -176.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -77.14 -17.74 58.4 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.62 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.463 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.6 pt20 -86.62 -29.2 22.74 Favored 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 119.401 -0.919 . . . . 0.0 108.544 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -85.11 -7.79 58.93 Favored 'General case' 0 CA--C 1.473 -2.004 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.491 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 34' ' ' MET . 8.6 t30 -54.12 -34.84 61.32 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 124.335 1.022 . . . . 0.0 110.889 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.411 ' CE1' HD13 ' A' ' 58' ' ' LEU . 3.1 t-160 -69.06 -55.12 11.74 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -52.29 -53.74 40.27 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 125.114 1.366 . . . . 0.0 108.347 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -49.55 -61.34 2.16 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 126.101 1.76 . . . . 0.0 112.45 175.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.3 ptm -69.82 -28.69 65.91 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -173.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.624 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 3.0 t-80 -72.48 -25.72 61.53 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-O 121.139 0.495 . . . . 0.0 109.834 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.5 mt -88.52 -32.17 18.33 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.41 177.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.492 ' HA ' HG13 ' A' ' 96' ' ' VAL . 58.9 p -82.75 -22.14 34.45 Favored 'General case' 0 C--N 1.309 -1.171 0 C-N-CA 118.622 -1.231 . . . . 0.0 111.785 -178.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.8 t -90.94 127.73 36.51 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.256 0.551 . . . . 0.0 111.934 -178.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -105.2 -179.56 3.98 Favored 'General case' 0 N--CA 1.423 -1.791 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 171.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -139.92 172.71 12.38 Favored 'General case' 0 C--N 1.285 -2.236 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.6 p90 -96.53 -34.63 11.39 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -168.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.2 15.03 18.31 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.44 -175.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 68.4 mt -65.36 96.25 0.23 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.673 177.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -106.93 -24.72 11.93 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 69.9 mtm -137.15 87.63 2.29 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 106.625 -1.62 . . . . 0.0 106.625 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.483 ' HA ' ' HG3' ' A' ' 52' ' ' GLN . . . -131.46 12.95 5.01 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.695 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 22.0 t -73.3 -59.56 3.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-O 121.298 0.571 . . . . 0.0 110.035 -177.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -134.54 82.06 1.94 Allowed 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -140.3 136.61 17.0 Favored Pre-proline 0 C--N 1.297 -1.689 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.027 -174.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -41.25 -50.62 4.34 Favored 'Trans proline' 0 C--N 1.363 1.307 0 C-N-CA 124.856 3.704 . . . . 0.0 114.639 -176.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -75.86 -10.02 59.08 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -175.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.483 ' HG3' ' HA ' ' A' ' 46' ' ' ALA . 12.6 mm100 -102.87 -11.63 18.13 Favored 'General case' 0 C--N 1.295 -1.787 0 C-N-CA 119.948 -0.701 . . . . 0.0 109.922 -178.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.5 pt20 -117.13 8.54 13.31 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 121.772 0.796 . . . . 0.0 109.789 178.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.483 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 13.7 pt20 -65.47 -28.88 69.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.035 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.624 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.6 OUTLIER -58.17 -26.62 62.96 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.349 179.494 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.3 tp -72.22 -52.03 18.33 Favored 'General case' 0 CA--C 1.489 -1.403 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.0 m -59.23 -21.76 60.05 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.614 -176.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 41.1 mt -89.76 -57.66 2.79 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.014 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 52.2 t -64.39 -50.51 67.39 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.155 0.982 . . . . 0.0 112.372 -175.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.547 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 12.1 t -59.23 -39.68 83.52 Favored 'General case' 0 CA--C 1.495 -1.145 0 CA-C-O 121.613 0.721 . . . . 0.0 109.281 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.425 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 27.9 t-20 -70.77 -28.03 64.36 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.956 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -81.13 -42.56 20.73 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.325 0.583 . . . . 0.0 110.446 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.547 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.7 pp -72.25 -31.65 65.99 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.908 -176.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.425 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 17.6 pt20 -68.9 -15.16 63.42 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.711 -176.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -81.7 -22.67 37.28 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.7 t -70.75 161.65 4.54 Favored 'Isoleucine or valine' 0 C--O 1.249 1.026 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.438 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.3 mt-10 -50.09 140.63 12.29 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 123.417 0.687 . . . . 0.0 112.298 178.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -55.17 -33.31 62.86 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.111 0.564 . . . . 0.0 112.471 -177.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.417 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 13.9 pt20 -81.9 -7.35 59.6 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.068 0.461 . . . . 0.0 110.576 -178.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.417 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 61.3 m -117.5 -11.28 10.51 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -174.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.536 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 75.9 mt-30 -57.96 -48.54 79.64 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.258 0.623 . . . . 0.0 112.03 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.408 ' HA ' HG12 ' A' ' 75' ' ' ILE . 14.7 p -74.82 -23.12 58.42 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.804 -0.759 . . . . 0.0 112.145 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -68.3 -32.54 72.75 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-O 121.613 0.721 . . . . 0.0 109.614 178.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.43 -28.75 67.24 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.704 177.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.561 HG21 ' HD3' ' A' ' 107' ' ' PRO . 27.8 mm -70.98 -32.95 50.03 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -176.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -66.46 -44.14 83.58 Favored 'General case' 0 CA--C 1.491 -1.32 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 -177.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.515 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 5.3 mt-30 -59.16 -46.22 88.95 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 113.103 -1.862 . . . . 0.0 110.349 -177.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 74' ' ' ALA . 19.6 t -53.42 -44.7 56.08 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 O-C-N 124.211 0.944 . . . . 0.0 110.138 -179.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 75' ' ' ILE . 26.1 t -70.12 -45.04 77.5 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -175.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -60.04 -52.58 64.75 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.678 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 20.7 pt20 -70.61 -31.76 68.86 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.855 -176.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.465 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -72.11 -41.46 67.21 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.76 0.314 . . . . 0.0 111.193 178.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.5 pt20 -72.1 -37.84 69.47 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 119.99 -0.684 . . . . 0.0 110.089 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.451 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -68.77 -32.34 72.01 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -178.097 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 1.7 pt20 -71.19 -28.84 64.51 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 121.683 0.754 . . . . 0.0 109.755 -177.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.604 HD12 ' HA3' ' A' ' 92' ' ' GLY . 3.7 mm? -86.29 -37.28 18.7 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.965 176.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -58.18 -36.45 73.07 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.925 1.29 . . . . 0.0 111.333 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -80.19 -9.89 59.74 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-O 121.018 0.437 . . . . 0.0 111.302 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -113.82 -115.57 3.21 Favored Glycine 0 N--CA 1.43 -1.732 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.017 -177.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 -71.24 -43.26 67.62 Favored 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 124.198 0.999 . . . . 0.0 111.371 -174.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.536 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 142.68 -85.95 0.19 Allowed Glycine 0 CA--C 1.478 -2.224 0 N-CA-C 107.007 -2.437 . . . . 0.0 107.007 -171.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.604 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 74.18 -44.55 1.36 Allowed Glycine 0 C--O 1.199 -2.08 0 N-CA-C 115.531 0.972 . . . . 0.0 115.531 171.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.466 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 56.2 mt-30 -44.37 -30.94 0.92 Allowed 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 125.292 1.437 . . . . 0.0 113.677 -176.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -75.88 -41.3 52.54 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 120.819 0.342 . . . . 0.0 111.321 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -85.51 -43.88 13.17 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.62 0.724 . . . . 0.0 110.227 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.492 HG13 ' HA ' ' A' ' 37' ' ' THR . 75.9 t -63.81 -22.72 31.62 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 C-N-CA 125.781 1.632 . . . . 0.0 110.547 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 64.5 tt0 -45.48 -45.65 13.22 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.478 0.711 . . . . 0.0 112.844 -178.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -67.25 -21.97 65.71 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -177.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.9 tpt -94.94 -49.55 5.51 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -176.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.9 p -61.51 -28.31 43.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.813 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -24.45 65.21 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 177.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -62.46 -38.03 88.22 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.507 ' HA ' HD13 ' A' ' 106' ' ' LEU . . . -52.07 -35.55 47.91 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.581 178.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -68.14 -17.25 64.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.134 0.492 . . . . 0.0 111.239 -178.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 40.8 mtt -91.81 -14.57 29.57 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -178.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.507 HD13 ' HA ' ' A' ' 103' ' ' ALA . 6.9 mp -53.16 -45.49 98.25 Favored Pre-proline 0 C--O 1.207 -1.182 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.561 ' HD3' HG21 ' A' ' 75' ' ' ILE . 19.6 Cg_endo -61.52 -26.49 80.88 Favored 'Trans proline' 0 C--N 1.358 1.07 0 CA-C-N 121.067 1.417 . . . . 0.0 112.125 176.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -83.51 -42.87 16.38 Favored 'General case' 0 N--CA 1.417 -2.124 0 CA-C-O 121.277 0.56 . . . . 0.0 110.277 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -79.92 -38.89 31.48 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -176.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 19.6 t -80.77 -5.73 57.55 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 45.4 t30 64.32 58.82 1.07 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 122.952 1.358 . . . . 0.0 109.873 179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 49.5 mt -100.23 158.43 15.87 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-N 113.536 -1.666 . . . . 0.0 108.228 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -82.83 45.53 1.01 Allowed 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.62 0.724 . . . . 0.0 111.194 -174.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 48.7 m -157.35 160.55 38.59 Favored 'General case' 0 C--N 1.292 -1.893 0 C-N-CA 124.994 1.318 . . . . 0.0 107.889 -176.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.8 m -149.36 135.77 19.25 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 176.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 81.0 mt . . . . . 0 C--N 1.304 -1.402 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -178.673 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.167 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -94.92 141.68 28.36 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-N 116.982 0.391 . . . . 0.0 109.979 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 62.7 m -116.81 149.35 40.13 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.3 p -84.6 156.56 21.53 Favored 'General case' 0 C--N 1.296 -1.727 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -79.81 74.57 6.53 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 122.082 0.944 . . . . 0.0 109.595 174.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 47.5 t -136.92 157.72 46.1 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.101 -1.409 . . . . 0.0 107.286 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.6 mm -128.51 109.65 19.15 Favored Pre-proline 0 C--N 1.294 -1.819 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 176.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -73.97 150.81 96.17 Favored 'Cis proline' 0 C--O 1.253 1.271 0 C-N-CA 124.177 -1.176 . . . . 0.0 111.322 -3.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.417 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 57.9 Cg_endo -70.18 150.84 66.2 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.722 2.281 . . . . 0.0 113.178 -175.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.416 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 46.9 mm -97.31 114.19 33.73 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 82.3 m -106.6 129.04 54.59 Favored 'General case' 0 C--N 1.288 -2.107 0 CA-C-O 121.277 0.56 . . . . 0.0 111.522 -176.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -73.38 151.93 89.86 Favored Pre-proline 0 C--N 1.307 -1.239 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.283 177.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -78.22 2.62 7.84 Favored 'Trans proline' 0 C--O 1.249 1.062 0 C-N-CA 122.685 2.256 . . . . 0.0 113.407 -176.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -167.21 -169.67 1.31 Allowed 'General case' 0 C--O 1.25 1.109 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 -177.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 102.8 0.26 48.92 Favored Glycine 0 CA--C 1.487 -1.696 0 N-CA-C 115.235 0.854 . . . . 0.0 115.235 173.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -152.4 120.32 6.17 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 118.655 -1.218 . . . . 0.0 110.139 -176.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.411 ' HB2' ' OE1' ' A' ' 69' ' ' GLN . 3.9 p30 -103.82 141.29 36.38 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 176.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -135.97 61.76 42.61 Favored Pre-proline 0 C--N 1.299 -1.612 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -173.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -72.89 -6.65 19.39 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.332 2.021 . . . . 0.0 113.597 -173.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.447 ' HD3' ' N ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -104.63 -25.26 12.8 Favored 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 178.789 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -102.38 18.22 51.69 Favored Glycine 0 N--CA 1.411 -3.001 0 CA-C-N 113.95 -1.477 . . . . 0.0 112.656 -177.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 29.9 m -65.66 113.36 4.19 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-O 121.036 0.446 . . . . 0.0 110.907 175.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -106.54 109.83 21.87 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-O 121.819 0.819 . . . . 0.0 108.882 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.744 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 2.7 mp -115.02 143.72 24.14 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.107 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.571 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 18.6 ptt180 -71.61 122.12 19.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.81 -13.34 16.69 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.045 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -75.72 -18.88 59.43 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.9 -178.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.571 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.4 pt20 -81.13 -16.97 51.51 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.525 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.458 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.2 mm? -96.59 2.59 52.42 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.138 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.459 ' HA ' HE21 ' A' ' 33' ' ' GLN . 28.6 t-20 -52.52 -39.27 61.17 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 124.343 1.027 . . . . 0.0 112.223 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -69.2 -54.78 13.07 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -177.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.413 ' HB3' HG11 ' A' ' 78' ' ' VAL . 1.2 m -55.13 -47.25 75.32 Favored 'General case' 0 C--O 1.221 -0.418 0 O-C-N 123.467 0.48 . . . . 0.0 110.652 178.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.459 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.7 tt0 -54.55 -55.39 29.79 Favored 'General case' 0 N--CA 1.437 -1.095 0 C-N-CA 123.457 0.703 . . . . 0.0 112.335 176.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 14.2 ptp -68.43 -41.74 79.88 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -176.26 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -70.25 -25.41 63.36 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.057 -175.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.451 ' O ' ' HB3' ' A' ' 99' ' ' MET . 86.9 mt -88.33 -25.13 22.92 Favored 'General case' 0 C--O 1.214 -0.816 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 177.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.507 ' HA ' HG13 ' A' ' 96' ' ' VAL . 29.9 p -87.78 -21.57 25.04 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 117.919 -1.512 . . . . 0.0 111.333 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.2 m -90.63 143.47 26.71 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.558 174.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.464 ' CZ ' ' HA ' ' A' ' 96' ' ' VAL . 48.8 m-85 -106.41 130.24 54.25 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.63 ' OD2' ' HD3' ' A' ' 42' ' ' LYS . 10.2 t70 -60.87 148.5 39.25 Favored 'General case' 0 N--CA 1.421 -1.897 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.26 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -124.65 -26.8 3.77 Favored 'General case' 0 C--N 1.264 -3.152 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.229 -172.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.63 ' HD3' ' OD2' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -91.95 9.52 32.73 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.806 -175.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.424 ' HG ' ' OD2' ' A' ' 40' ' ' ASP . 83.9 mt -49.43 113.15 0.76 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.764 173.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -105.15 -79.3 0.56 Allowed 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 67.0 mtt -102.56 3.04 36.96 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.309 0.576 . . . . 0.0 109.915 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.514 ' HA ' ' CG ' ' A' ' 49' ' ' ASN . . . -72.16 105.75 4.1 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.18 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 29.8 t -112.38 -62.53 2.18 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 176.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -134.72 33.07 3.23 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.514 ' CG ' ' HA ' ' A' ' 46' ' ' ALA . 2.9 m-20 -59.84 141.38 89.37 Favored Pre-proline 0 C--N 1.313 -0.999 0 CA-C-N 114.218 -1.355 . . . . 0.0 111.391 -177.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -59.44 -23.34 70.11 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.917 2.411 . . . . 0.0 111.913 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -69.17 -15.3 63.37 Favored 'General case' 0 C--O 1.218 -0.586 0 O-C-N 122.092 -0.38 . . . . 0.0 111.749 177.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -81.19 -9.08 59.85 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 121.306 0.574 . . . . 0.0 109.741 178.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -87.3 6.63 32.46 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.77 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.466 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 23.6 pt20 -49.47 -48.77 47.49 Favored 'General case' 0 C--O 1.249 1.05 0 C-N-CA 124.521 1.128 . . . . 0.0 111.084 178.136 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.439 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.4 p-80 -70.93 -22.68 62.21 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.267 -177.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.411 HD23 HD22 ' A' ' 106' ' ' LEU . 3.2 tm? -78.5 -46.15 20.29 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -178.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.9 m -55.06 -33.37 62.68 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.471 0.653 . . . . 0.0 110.519 178.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 58.3 mt -82.95 -56.13 3.99 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.858 178.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 21.8 t -58.68 -49.42 77.61 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.196 0.999 . . . . 0.0 111.348 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.486 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 38.5 t -57.82 -37.08 73.18 Favored 'General case' 0 C--O 1.212 -0.903 0 C-N-CA 123.028 0.531 . . . . 0.0 110.839 178.162 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.516 ' HA ' HE21 ' A' ' 64' ' ' GLN . 12.5 t30 -76.42 -25.32 54.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.872 0.844 . . . . 0.0 110.816 -177.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.543 ' CG ' ' HB2' ' A' ' 28' ' ' GLN . 6.3 tp-100 -79.61 -48.61 13.49 Favored 'General case' 0 C--N 1.283 -2.311 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.369 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.581 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -69.05 -31.7 70.66 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.866 -177.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.516 HE21 ' HA ' ' A' ' 61' ' ' ASN . 25.6 pt20 -71.92 -11.18 60.66 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -176.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.35 -10.23 57.77 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.929 0.871 . . . . 0.0 109.785 175.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -82.73 163.68 2.98 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 106.733 -1.58 . . . . 0.0 106.733 172.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.573 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 27.7 mm-40 -50.55 149.4 3.21 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-N 118.101 0.409 . . . . 0.0 112.023 174.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -62.51 -38.4 89.8 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.779 -171.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.411 ' OE1' ' HB2' ' A' ' 17' ' ' ASP . 24.5 pt20 -76.3 -19.59 58.12 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-O 121.534 0.683 . . . . 0.0 110.158 -179.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 57.2 m -98.83 -11.5 21.72 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.541 -176.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 29.2 mt-30 -62.19 -38.84 90.65 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-O 121.414 0.626 . . . . 0.0 109.365 176.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.6 p -80.31 -24.84 39.68 Favored 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.125 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.3 mm-40 -71.32 -29.89 65.56 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.597 178.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.449 ' HB2' HG21 ' A' ' 24' ' ' ILE . . . -63.71 -30.44 71.54 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.42 176.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.581 HD11 HD22 ' A' ' 63' ' ' LEU . 31.4 mm -69.45 -33.94 59.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.539 -179.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -65.78 -41.11 92.41 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 -177.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.744 ' NE2' ' HB ' ' A' ' 24' ' ' ILE . 9.0 mt-30 -65.49 -33.13 75.2 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.743 -177.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.458 HG22 ' HB3' ' A' ' 29' ' ' LEU . 22.0 t -58.66 -46.7 90.26 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.03 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.477 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 42.7 t -64.46 -50.61 75.34 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.167 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 -176.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -50.5 -47.51 57.27 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.996 -1.457 . . . . 0.0 112.276 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.649 ' HA ' ' CD ' ' A' ' 84' ' ' LYS . 29.6 pt20 -83.1 -32.91 26.5 Favored 'General case' 0 N--CA 1.432 -1.342 0 C-N-CA 119.531 -0.868 . . . . 0.0 113.272 -176.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.463 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -71.27 -32.8 69.13 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-O 121.057 0.456 . . . . 0.0 110.493 -178.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 79' ' ' VAL . 4.4 pt20 -74.1 -43.24 58.37 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.167 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.649 ' CD ' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -72.78 -25.08 61.04 Favored 'General case' 0 CA--C 1.498 -1.047 0 C-N-CA 118.197 -1.401 . . . . 0.0 111.824 -175.333 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -71.03 -34.12 70.99 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 119.777 -0.769 . . . . 0.0 109.863 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.444 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.2 mm? -84.16 -31.47 25.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.802 177.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -63.18 -38.32 90.71 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 122.871 0.469 . . . . 0.0 111.903 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -87.94 4.08 46.18 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.433 0.635 . . . . 0.0 112.156 -174.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -101.72 -130.65 7.1 Favored Glycine 0 C--N 1.286 -2.249 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.433 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -93.81 -8.1 41.45 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.647 0.737 . . . . 0.0 110.435 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.62 -150.65 17.32 Favored Glycine 0 N--CA 1.422 -2.28 0 N-CA-C 108.716 -1.754 . . . . 0.0 108.716 -176.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.409 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 112.91 -19.91 20.4 Favored Glycine 0 C--O 1.189 -2.671 0 C-N-CA 119.723 -1.227 . . . . 0.0 111.079 -177.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -51.38 -37.66 49.31 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 124.088 0.955 . . . . 0.0 111.252 -177.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -76.92 -33.25 57.76 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.014 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.418 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 29.8 pt20 -83.17 -44.51 14.97 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.349 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.507 HG13 ' HA ' ' A' ' 37' ' ' THR . 93.2 t -64.2 -22.54 31.35 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.988 0 C-N-CA 125.537 1.535 . . . . 0.0 110.687 177.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -45.95 -45.39 15.56 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.471 1.108 . . . . 0.0 112.285 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.8 pt20 -65.25 -18.75 65.56 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -178.214 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.451 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 3.6 tpt -98.87 -45.92 5.82 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.86 -25.02 36.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 120.891 0.376 . . . . 0.0 111.253 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -63.21 -22.66 67.01 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.374 -0.829 . . . . 0.0 111.831 174.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -66.45 -25.99 66.99 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 122.393 0.277 . . . . 0.0 110.444 175.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.49 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -60.97 -30.25 70.15 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 121.564 0.697 . . . . 0.0 110.487 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -70.51 -19.82 62.89 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.188 -178.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 56.0 mtp -92.4 -15.07 27.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.67 -178.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.5 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 97.5 mt -55.78 -45.93 99.81 Favored Pre-proline 0 C--N 1.317 -0.819 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.226 -178.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 14.5 Cg_endo -58.25 -25.01 70.28 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 122.222 1.948 . . . . 0.0 113.195 174.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -81.05 -47.71 13.19 Favored 'General case' 0 N--CA 1.419 -1.991 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -67.29 -38.45 85.04 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.595 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.454 ' SG ' HD21 ' A' ' 112' ' ' LEU . 15.9 t -90.33 -4.11 57.32 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-O 120.832 0.349 . . . . 0.0 110.336 -177.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.8 t30 60.31 60.67 1.97 Allowed 'General case' 0 N--CA 1.477 0.916 0 CA-C-O 122.783 1.278 . . . . 0.0 109.67 -178.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.455 ' C ' ' H ' ' A' ' 114' ' ' CYS . 38.5 mt -91.65 160.06 15.56 Favored 'General case' 0 C--N 1.286 -2.192 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.133 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -70.0 26.96 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.477 1.111 . . . . 0.0 112.753 -177.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.455 ' H ' ' C ' ' A' ' 112' ' ' LEU . 85.2 m -157.66 158.81 36.15 Favored 'General case' 0 C--N 1.284 -2.258 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 -173.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.7 p -150.99 130.41 12.9 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 48.5 mt . . . . . 0 C--N 1.309 -1.153 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -178.119 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.453 ' HA2' ' O ' ' A' ' 14' ' ' ASP . . . . . . . . 0 CA--C 1.499 -0.915 0 N-CA-C 112.239 -0.345 . . . . 0.0 112.239 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.52 ' H ' ' HB3' ' A' ' 14' ' ' ASP . 35.1 mmt180 -88.59 127.94 35.57 Favored 'General case' 0 CA--C 1.477 -1.858 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 175.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 63.1 m -140.71 151.81 44.81 Favored 'General case' 0 C--N 1.266 -3.053 0 O-C-N 123.399 0.437 . . . . 0.0 110.36 -174.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 41.3 p -79.43 161.29 26.22 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.825 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.423 ' HD3' ' N ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER -88.11 66.44 8.54 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.725 0.774 . . . . 0.0 109.312 177.285 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 64.8 p -138.57 160.16 40.29 Favored 'General case' 0 N--CA 1.42 -1.967 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.0 mm -128.77 112.85 18.98 Favored Pre-proline 0 C--N 1.302 -1.488 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 176.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -72.62 154.2 98.89 Favored 'Cis proline' 0 CA--C 1.547 1.139 0 C-N-CA 123.716 -1.368 . . . . 0.0 112.228 -0.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.88 150.85 30.76 Favored 'Trans proline' 0 N--CA 1.45 -1.041 0 C-N-CA 122.264 1.976 . . . . 0.0 113.022 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -98.6 113.07 32.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 105.674 -1.972 . . . . 0.0 105.674 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 80.9 m -106.43 139.28 41.16 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 121.592 0.711 . . . . 0.0 111.963 -177.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -92.26 165.45 19.74 Favored Pre-proline 0 C--N 1.302 -1.471 0 CA-C-N 114.537 -1.21 . . . . 0.0 110.648 -178.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -67.16 76.09 0.46 Allowed 'Trans proline' 0 C--N 1.367 1.528 0 C-N-CA 123.064 2.509 . . . . 0.0 111.428 175.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.52 ' HB3' ' H ' ' A' ' 2' ' ' ARG . 9.8 t70 -140.67 132.48 27.47 Favored 'General case' 0 C--N 1.279 -2.469 0 CA-C-N 113.662 -1.608 . . . . 0.0 106.756 175.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.41 23.78 49.67 Favored Glycine 0 C--N 1.304 -1.229 0 C-N-CA 120.296 -0.954 . . . . 0.0 110.935 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.623 HD23 ' H ' ' A' ' 16' ' ' LEU . 1.5 pt? -94.85 -20.88 19.07 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 121.916 0.865 . . . . 0.0 109.13 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -131.33 85.13 2.23 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 174.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -107.93 114.53 59.91 Favored Pre-proline 0 C--N 1.283 -2.294 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.246 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -74.03 -21.36 18.31 Favored 'Trans proline' 0 N--CA 1.451 -1.019 0 C-N-CA 121.319 1.346 . . . . 0.0 110.749 177.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.559 ' HD3' HE22 ' A' ' 77' ' ' GLN . 6.0 mpt_? -127.84 -63.2 1.03 Allowed 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 176.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 175.85 -72.2 0.08 OUTLIER Glycine 0 CA--C 1.479 -2.182 0 N-CA-C 108.81 -1.716 . . . . 0.0 108.81 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 32.8 m -74.79 132.92 41.95 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 171.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -100.51 110.17 22.33 Favored 'General case' 0 N--CA 1.414 -2.271 0 C-N-CA 118.165 -1.414 . . . . 0.0 108.817 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 mp -111.92 137.58 44.06 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.899 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 178.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.488 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 13.9 ptp180 -67.25 116.55 8.15 Favored 'General case' 0 N--CA 1.417 -2.111 0 CA-C-O 121.783 0.802 . . . . 0.0 109.335 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.65 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -67.69 -13.75 17.28 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.958 0 CA-C-N 115.643 -0.708 . . . . 0.0 112.257 -174.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -77.43 -16.55 58.74 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.637 -178.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.1 pt20 -85.92 -20.31 29.19 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 119.116 -1.034 . . . . 0.0 109.29 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.475 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.5 mm? -91.54 -2.9 57.01 Favored 'General case' 0 CA--C 1.483 -1.607 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.52 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.547 ' HA ' HE21 ' A' ' 33' ' ' GLN . 36.2 t-20 -51.38 -35.4 38.6 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.58 -1.191 . . . . 0.0 110.959 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 t-160 -69.76 -54.42 13.77 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.43 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.7 OUTLIER -54.08 -52.21 61.67 Favored 'General case' 0 C--O 1.22 -0.487 0 O-C-N 123.737 0.648 . . . . 0.0 109.92 178.112 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.547 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.2 tt0 -50.31 -60.06 3.35 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.053 0.941 . . . . 0.0 112.44 177.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.9 ptt? -68.13 -39.54 82.68 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 120.872 -0.331 . . . . 0.0 111.682 -172.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -70.9 -26.26 63.14 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.282 -175.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 90.6 mt -87.62 -27.73 22.32 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.543 ' HA ' HG13 ' A' ' 96' ' ' VAL . 39.9 p -86.01 -22.02 27.5 Favored 'General case' 0 N--CA 1.422 -1.836 0 C-N-CA 118.032 -1.467 . . . . 0.0 111.787 179.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.9 p -90.89 148.07 22.72 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.414 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -111.62 157.72 20.09 Favored 'General case' 0 N--CA 1.417 -2.119 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.407 ' H ' ' CD1' ' A' ' 43' ' ' LEU . 9.2 t70 -121.18 177.92 4.96 Favored 'General case' 0 C--N 1.279 -2.487 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 -177.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.1 p90 -95.93 -35.83 11.3 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -170.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.48 8.88 14.98 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 119.382 -0.927 . . . . 0.0 111.576 -175.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.407 ' CD1' ' H ' ' A' ' 40' ' ' ASP . 28.9 mt -76.89 83.49 3.45 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.023 178.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -98.51 -25.24 14.83 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-O 122.4 1.095 . . . . 0.0 109.025 177.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.5 ptp -151.7 82.09 1.28 Allowed 'General case' 0 C--N 1.286 -2.189 0 CA-C-N 113.507 -1.678 . . . . 0.0 107.616 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.8 29.42 7.57 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 113.506 -1.679 . . . . 0.0 108.446 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.3 t -75.24 -61.1 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -144.36 87.77 1.9 Allowed 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -123.15 137.91 29.02 Favored Pre-proline 0 C--N 1.304 -1.4 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.842 -174.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.573 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 11.7 Cg_endo -55.7 -42.15 70.34 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 123.472 2.782 . . . . 0.0 114.298 -178.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -73.76 -18.06 61.02 Favored 'General case' 0 CA--C 1.5 -0.975 0 O-C-N 121.823 -0.548 . . . . 0.0 112.287 -176.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -69.92 -25.23 63.57 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.684 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.573 ' HG2' ' O ' ' A' ' 50' ' ' PRO . 12.7 pt20 -73.05 4.88 3.81 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.803 -177.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.498 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 14.0 pt20 -53.15 -46.55 68.9 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.995 0.918 . . . . 0.0 110.011 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -72.81 -21.47 60.96 Favored 'General case' 0 C--O 1.209 -1.047 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.423 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -77.91 -43.07 31.13 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 44.4 m -56.84 -34.6 67.92 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 123.655 0.597 . . . . 0.0 110.123 177.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 50.5 mt -79.75 -56.14 4.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.191 177.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 22.7 t -58.97 -49.27 78.49 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 124.186 0.994 . . . . 0.0 111.846 -175.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.498 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.7 t -58.99 -34.39 71.78 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 122.838 0.455 . . . . 0.0 110.651 177.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -77.53 -23.49 50.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.603 0.716 . . . . 0.0 110.852 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -83.17 -47.88 11.12 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.514 178.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.501 HD22 HD11 ' A' ' 75' ' ' ILE . 3.7 pp -66.48 -31.57 72.4 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.425 0.631 . . . . 0.0 111.014 -177.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.53 -14.6 63.12 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.134 -177.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -77.25 -22.91 51.45 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.453 0.644 . . . . 0.0 109.312 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.2 t -74.78 161.73 4.72 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.088 175.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.586 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 38.3 mt-10 -53.46 144.01 17.98 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 177.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -55.54 -31.24 61.95 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.99 0.916 . . . . 0.0 112.087 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.576 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.9 pt20 -84.94 -5.08 59.35 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.744 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.576 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 61.5 m -125.61 -6.27 6.93 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.991 -175.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.586 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 99.0 mt-30 -61.97 -41.88 98.51 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.433 0.635 . . . . 0.0 109.93 177.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.456 ' HA ' HG12 ' A' ' 75' ' ' ILE . 6.0 p -78.28 -23.55 47.17 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.329 177.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.432 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 14.7 mm-40 -72.0 -30.96 65.76 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.269 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.478 ' HA ' ' HG3' ' A' ' 77' ' ' GLN . . . -60.77 -24.27 65.64 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.267 176.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.609 HG21 ' HD3' ' A' ' 107' ' ' PRO . 32.6 mm -74.31 -29.97 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.683 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -71.54 -39.19 70.85 Favored 'General case' 0 CA--C 1.489 -1.383 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 -176.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.559 HE22 ' HD3' ' A' ' 20' ' ' ARG . 44.0 mm-40 -56.16 -46.75 79.19 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 112.286 -2.234 . . . . 0.0 109.075 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.475 HG22 ' HB3' ' A' ' 29' ' ' LEU . 12.2 t -57.89 -46.25 87.47 Favored 'Isoleucine or valine' 0 C--N 1.354 0.786 0 O-C-N 124.297 0.998 . . . . 0.0 109.667 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 75' ' ' ILE . 23.6 t -67.49 -41.3 85.84 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.813 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.898 -173.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -60.83 -52.83 63.42 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.107 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.65 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.1 pt20 -68.89 -37.27 78.9 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -176.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.62 -37.14 73.77 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 120.903 0.382 . . . . 0.0 111.508 -177.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -75.72 -38.43 58.55 Favored 'General case' 0 N--CA 1.437 -1.091 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.233 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.499 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -67.34 -33.17 74.69 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-O 120.593 0.235 . . . . 0.0 111.07 -177.197 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.443 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 2.2 pt20 -72.2 -29.82 64.35 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.073 0.463 . . . . 0.0 110.769 -176.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.525 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.2 mm? -87.14 -33.11 19.53 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.534 0.683 . . . . 0.0 111.454 175.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -63.15 -36.5 83.82 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.256 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -81.99 -6.98 59.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.006 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -92.06 -133.08 5.97 Favored Glycine 0 N--CA 1.429 -1.827 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.161 -177.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -104.83 -18.95 14.05 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 120.891 0.377 . . . . 0.0 111.098 -176.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 154.61 -141.57 8.3 Favored Glycine 0 CA--C 1.477 -2.343 0 N-CA-C 109.159 -1.576 . . . . 0.0 109.159 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.404 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 96.06 -24.44 29.98 Favored Glycine 0 N--CA 1.424 -2.112 0 C-N-CA 120.358 -0.925 . . . . 0.0 113.267 176.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -54.05 -31.52 51.76 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -77.11 -35.17 56.57 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.327 179.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.404 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 3.7 pt20 -83.99 -43.54 15.07 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.61 0.719 . . . . 0.0 109.68 -177.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.543 HG13 ' HA ' ' A' ' 37' ' ' THR . 95.4 t -63.04 -23.15 32.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.507 177.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -46.48 -43.73 16.94 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.675 0.79 . . . . 0.0 112.936 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -69.4 -17.94 63.71 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.098 0.475 . . . . 0.0 111.865 -177.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.419 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 5.9 tpt -102.06 -47.38 4.57 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.143 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.5 p -64.73 -24.03 34.7 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.692 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.468 ' HG3' ' N ' ' A' ' 102' ' ' LYS . 34.9 pttt -59.23 -26.96 65.32 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.778 -0.576 . . . . 0.0 110.711 173.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.468 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 26.0 mtpp -65.02 -28.71 69.68 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.411 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -61.43 -43.49 98.78 Favored 'General case' 0 C--O 1.197 -1.659 0 O-C-N 123.931 0.769 . . . . 0.0 108.959 174.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -70.67 -16.89 62.84 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.197 -178.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 27.3 mtm -91.39 -13.38 32.52 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.095 -0.378 . . . . 0.0 111.29 177.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.51 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 95.7 mt -50.64 -45.35 85.62 Favored Pre-proline 0 CA--C 1.543 0.698 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.609 ' HD3' HG21 ' A' ' 75' ' ' ILE . 16.0 Cg_endo -58.25 -24.54 67.96 Favored 'Trans proline' 0 C--N 1.367 1.53 0 C-N-CA 122.172 1.915 . . . . 0.0 112.86 176.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -85.62 -44.06 12.94 Favored 'General case' 0 N--CA 1.413 -2.307 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -73.21 -35.86 66.39 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.315 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 25.0 t -90.05 -3.83 57.73 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-O 121.331 0.586 . . . . 0.0 109.797 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 61.7 t30 62.37 50.86 3.57 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 122.736 1.255 . . . . 0.0 110.853 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.435 HD21 HD11 ' A' ' 63' ' ' LEU . 66.3 mt -89.54 158.61 17.59 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.712 -178.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -80.3 43.79 0.65 Allowed 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 124.067 0.947 . . . . 0.0 112.06 -174.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 59.5 m -159.16 162.63 36.4 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -176.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.4 p -146.32 140.71 26.64 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 73.0 mt . . . . . 0 C--N 1.307 -1.262 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.48 -178.51 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.553 ' HA3' ' O ' ' A' ' 12' ' ' PHE . . . . . . . . 0 CA--C 1.503 -0.713 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 64.7 mtm-85 -94.7 127.16 40.49 Favored 'General case' 0 CA--C 1.493 -1.243 0 CA-C-N 117.161 0.481 . . . . 0.0 109.725 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 21.5 m -113.52 147.82 37.22 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -176.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.4 p -78.58 146.16 34.36 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 175.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -87.82 69.82 9.54 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 121.676 0.75 . . . . 0.0 109.358 177.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.8 t -146.85 171.47 15.15 Favored 'General case' 0 N--CA 1.418 -2.074 0 N-CA-C 106.7 -1.592 . . . . 0.0 106.7 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 37.9 mm -128.84 119.83 20.21 Favored Pre-proline 0 C--N 1.305 -1.362 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 178.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -71.72 146.91 86.89 Favored 'Cis proline' 0 C--O 1.249 1.049 0 C-N-CA 123.751 -1.354 . . . . 0.0 111.645 -1.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -73.97 139.66 27.48 Favored 'Trans proline' 0 N--CA 1.445 -1.353 0 C-N-CA 122.252 1.968 . . . . 0.0 111.347 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.3 mm -106.18 115.54 48.05 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 1.8 t -117.57 132.34 56.54 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 119.431 -0.908 . . . . 0.0 111.028 -176.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.553 ' O ' ' HA3' ' A' ' 1' ' ' GLY . 48.3 m-85 -97.45 150.47 36.83 Favored Pre-proline 0 C--N 1.302 -1.473 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.756 -179.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.36 11.98 2.48 Favored 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.839 2.359 . . . . 0.0 114.097 -175.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -120.91 137.94 54.35 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 178.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -167.55 -97.9 0.12 Allowed Glycine 0 N--CA 1.42 -2.426 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -143.49 165.14 28.39 Favored 'General case' 0 N--CA 1.405 -2.696 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 -178.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -129.38 4.75 5.18 Favored 'General case' 0 C--N 1.272 -2.776 0 CA-C-O 121.421 0.629 . . . . 0.0 111.524 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -105.28 104.56 48.15 Favored Pre-proline 0 C--N 1.299 -1.592 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 174.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.44 -31.82 86.97 Favored 'Trans proline' 0 C--O 1.24 0.598 0 C-N-CA 123.47 2.78 . . . . 0.0 113.822 -174.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.614 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 2.5 mpt_? -99.85 -50.03 4.16 Favored 'General case' 0 CA--C 1.488 -1.412 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.65 34.27 9.37 Favored Glycine 0 CA--C 1.465 -3.065 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 -178.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 64.0 m -63.41 137.46 58.17 Favored 'General case' 0 N--CA 1.417 -2.117 0 CA-C-N 113.95 -1.125 . . . . 0.0 110.146 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -101.7 121.96 43.02 Favored 'General case' 0 N--CA 1.417 -2.124 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 173.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mp -122.26 134.41 65.58 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.395 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 -178.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.539 ' HG2' HE21 ' A' ' 28' ' ' GLN . 14.1 ptp180 -66.75 121.98 16.64 Favored 'General case' 0 N--CA 1.426 -1.655 0 O-C-N 123.913 0.758 . . . . 0.0 110.203 -173.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -64.13 -17.13 20.2 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.267 -175.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -75.94 -13.62 60.25 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.219 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.539 HE21 ' HG2' ' A' ' 25' ' ' ARG . 5.0 pt20 -96.46 -10.53 27.25 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 119.52 -0.872 . . . . 0.0 109.124 178.07 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.436 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.9 mm? -98.7 4.95 47.93 Favored 'General case' 0 CA--C 1.488 -1.42 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.18 176.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.502 ' O ' ' HG2' ' A' ' 34' ' ' MET . 7.8 t30 -50.57 -36.6 35.39 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.27 -1.332 . . . . 0.0 113.099 -179.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -72.23 -53.61 12.06 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -178.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -54.72 -51.36 65.84 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 124.493 1.121 . . . . 0.0 108.809 -178.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -52.25 -56.03 17.39 Favored 'General case' 0 N--CA 1.439 -0.996 0 C-N-CA 124.201 1.001 . . . . 0.0 112.792 176.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.502 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 15.6 ptp -67.88 -43.63 78.91 Favored 'General case' 0 CA--C 1.506 -0.731 0 C-N-CA 119.849 -0.74 . . . . 0.0 112.788 -175.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -65.29 -25.34 67.59 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 99' ' ' MET . 93.1 mt -85.53 -32.54 22.13 Favored 'General case' 0 C--O 1.209 -1.076 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.809 175.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.548 ' HA ' HG13 ' A' ' 96' ' ' VAL . 40.7 p -86.43 -21.13 27.26 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 118.645 -1.222 . . . . 0.0 112.621 -177.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.5 m -89.6 121.11 31.48 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 113.037 0.755 . . . . 0.0 113.037 -177.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -102.34 89.52 3.59 Favored 'General case' 0 C--N 1.29 -2.019 0 N-CA-C 103.436 -2.801 . . . . 0.0 103.436 165.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -74.32 172.69 11.4 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.688 -1.142 . . . . 0.0 112.076 -167.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -98.49 -32.05 11.67 Favored 'General case' 0 C--N 1.295 -1.77 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -168.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.07 5.07 31.13 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 119.003 -1.079 . . . . 0.0 111.554 -176.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 53.1 mt -77.87 86.51 4.1 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 174.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.9 mtt180 -110.32 -56.71 2.3 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.365 -174.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 66.6 mtt -98.14 -12.48 21.71 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 121.648 0.737 . . . . 0.0 110.051 177.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.42 90.73 8.48 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.469 176.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.46 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 49.1 t -124.82 -58.56 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 177.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -121.93 79.51 1.59 Allowed 'General case' 0 N--CA 1.433 -1.3 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 175.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -134.8 161.58 62.87 Favored Pre-proline 0 C--N 1.308 -1.196 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -59.56 -28.03 86.43 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.445 2.097 . . . . 0.0 110.492 173.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -66.59 -12.99 60.46 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.67 -0.695 . . . . 0.0 112.053 178.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' A' ' 47' ' ' VAL . 15.9 mm100 -85.41 -11.58 54.1 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.476 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -117.14 11.94 14.31 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-O 121.114 0.483 . . . . 0.0 110.094 177.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.555 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 11.1 pt20 -59.3 -33.16 70.75 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.91 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.11 -22.26 66.39 Favored 'General case' 0 C--O 1.204 -1.309 0 CA-C-N 114.823 -1.081 . . . . 0.0 111.433 -178.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -81.1 -44.94 17.21 Favored 'General case' 0 CA--C 1.487 -1.45 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.1 m -56.99 -32.09 65.76 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 124.052 0.845 . . . . 0.0 109.671 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 54.7 mt -87.83 -49.52 7.05 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.213 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 52.5 t -61.09 -49.77 75.96 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.294 0.237 . . . . 0.0 111.383 -179.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.525 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 53.1 t -58.78 -32.27 69.16 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 122.581 0.352 . . . . 0.0 110.586 178.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.404 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 47.8 t30 -80.4 -26.04 38.74 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.489 0.661 . . . . 0.0 110.687 -177.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -82.85 -46.13 13.41 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.281 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.651 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -67.36 -32.45 73.38 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.554 -177.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.401 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 11.2 pt20 -70.85 -9.82 58.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.781 -178.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 12.9 mm-40 -78.67 -17.69 55.56 Favored 'General case' 0 C--O 1.247 0.935 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 176.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 8.4 t -85.23 162.48 2.9 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 175.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 2.5 mm-40 -49.89 144.62 6.33 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 124.155 0.982 . . . . 0.0 112.405 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -58.63 -33.51 70.14 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.316 0.579 . . . . 0.0 111.599 -179.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -79.61 -11.49 59.87 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.073 -178.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 62.6 m -116.47 -9.49 11.43 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.929 -175.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 71.7 mt-30 -57.45 -49.37 76.47 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.387 0.675 . . . . 0.0 112.229 178.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.44 ' HA ' HG12 ' A' ' 75' ' ' ILE . 25.4 p -76.57 -23.7 53.52 Favored 'General case' 0 CA--C 1.499 -1.012 0 C-N-CA 119.494 -0.882 . . . . 0.0 111.841 177.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 15.0 mm-40 -66.56 -35.2 79.64 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 178.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.489 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -60.49 -26.66 66.98 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.372 0.669 . . . . 0.0 111.185 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.651 HD11 HD22 ' A' ' 63' ' ' LEU . 19.8 mm -72.94 -26.45 23.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.341 0.591 . . . . 0.0 109.537 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -75.88 -38.87 57.42 Favored 'General case' 0 CA--C 1.495 -1.152 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 -174.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 73' ' ' GLU . 9.4 mm100 -58.09 -44.61 87.72 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 112.335 -2.212 . . . . 0.0 108.996 178.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 74' ' ' ALA . 22.4 t -56.63 -46.38 82.76 Favored 'Isoleucine or valine' 0 C--N 1.359 0.987 0 O-C-N 124.428 1.08 . . . . 0.0 109.601 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 75' ' ' ILE . 41.7 t -65.9 -47.32 85.84 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.59 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -175.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.14 -40.62 86.07 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.297 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -82.02 -31.45 30.98 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.266 0.555 . . . . 0.0 111.275 -178.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.472 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -77.83 -31.23 51.51 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.021 0.439 . . . . 0.0 111.877 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -80.33 -33.75 37.19 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -33.5 63.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.382 -176.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.44 ' HG3' HD22 ' A' ' 86' ' ' LEU . 15.7 pt20 -67.4 -32.52 73.47 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.125 0.488 . . . . 0.0 110.416 -178.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.5 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.0 mm? -84.29 -29.21 26.58 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.993 177.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -66.91 -38.35 86.05 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.423 177.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -79.41 -4.64 52.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.447 0.641 . . . . 0.0 111.084 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -95.5 -133.96 7.59 Favored Glycine 0 N--CA 1.426 -2.021 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -92.13 -49.64 6.09 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.633 0.73 . . . . 0.0 109.726 -178.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.417 ' O ' HD12 ' A' ' 86' ' ' LEU . . . 178.11 -152.7 11.92 Favored Glycine 0 CA--C 1.484 -1.861 0 N-CA-C 107.348 -2.301 . . . . 0.0 107.348 -176.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.4 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 111.53 -23.69 17.25 Favored Glycine 0 C--O 1.201 -1.925 0 C-N-CA 119.975 -1.107 . . . . 0.0 111.872 178.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 48.1 mt-30 -49.96 -34.65 21.5 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 124.297 1.039 . . . . 0.0 112.376 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -75.46 -40.83 56.95 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.554 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 20.8 pt20 -80.08 -45.13 18.81 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-O 121.231 0.539 . . . . 0.0 109.67 -175.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.548 HG13 ' HA ' ' A' ' 37' ' ' THR . 88.1 t -63.04 -22.76 31.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 C-N-CA 124.893 1.277 . . . . 0.0 110.759 177.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.422 ' HA ' HG12 ' A' ' 100' ' ' VAL . 28.6 tt0 -54.25 -35.18 62.22 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.23 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.554 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 10.2 pt20 -69.41 -17.45 63.66 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.033 0.444 . . . . 0.0 111.199 -178.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.421 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 2.9 tpt -103.2 -44.03 5.3 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -177.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.422 HG12 ' HA ' ' A' ' 97' ' ' GLN . 9.2 p -66.82 -23.71 31.48 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.297 0 CA-C-O 121.079 0.466 . . . . 0.0 110.972 177.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -21.57 66.6 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 121.867 -0.52 . . . . 0.0 111.278 175.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -67.12 -28.07 67.85 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 176.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -68.93 -25.42 64.57 Favored 'General case' 0 C--O 1.205 -1.243 0 CA-C-O 121.457 0.646 . . . . 0.0 110.131 176.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -70.71 -25.17 62.83 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 122.014 0.912 . . . . 0.0 108.883 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 38.8 mtp -92.3 -14.67 28.47 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.491 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.451 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 0.2 OUTLIER -52.07 -48.46 88.5 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 124.491 1.116 . . . . 0.0 111.305 -177.553 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 18.6 Cg_endo -59.28 -23.18 68.65 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 121.581 1.521 . . . . 0.0 113.494 177.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -89.19 -40.31 12.96 Favored 'General case' 0 N--CA 1.416 -2.139 0 C-N-CA 119.861 -0.735 . . . . 0.0 110.489 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -66.56 -41.73 88.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.276 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.409 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 30.3 t -88.49 -6.02 57.87 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.283 -176.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 60.56 61.45 1.73 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 123.116 1.436 . . . . 0.0 110.616 -178.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.451 HD21 HD11 ' A' ' 63' ' ' LEU . 54.8 mt -102.34 158.46 16.18 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 113.472 -1.695 . . . . 0.0 109.536 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -78.87 49.79 0.95 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.002 0.921 . . . . 0.0 111.391 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.441 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 18.2 m -158.19 159.08 35.73 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 123.939 0.896 . . . . 0.0 109.99 -176.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.5 p -147.78 116.83 6.82 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 176.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 72.0 mt . . . . . 0 C--N 1.305 -1.33 0 N-CA-C 109.508 -0.552 . . . . 0.0 109.508 -176.387 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.317 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.7 mtp85 -94.93 147.98 22.8 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 81.0 m -143.03 149.38 38.18 Favored 'General case' 0 C--N 1.293 -1.85 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.4 p -74.37 160.85 30.48 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -94.3 71.91 3.85 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 120.112 -0.635 . . . . 0.0 110.707 -178.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.4 t -152.06 167.39 28.61 Favored 'General case' 0 N--CA 1.428 -1.53 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.5 mt -129.05 118.89 19.56 Favored Pre-proline 0 C--N 1.311 -1.104 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.95 148.41 90.73 Favored 'Cis proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.711 -1.37 . . . . 0.0 112.591 0.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -74.2 143.98 32.73 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.36 2.04 . . . . 0.0 112.555 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.6 mm -96.24 115.27 35.1 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 N-CA-C 106.024 -1.843 . . . . 0.0 106.024 176.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 76.8 m -106.05 147.36 29.0 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -174.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.445 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 64.6 m-85 -125.62 135.53 27.09 Favored Pre-proline 0 N--CA 1.433 -1.29 0 C-N-CA 124.238 1.015 . . . . 0.0 111.651 -176.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 12.3 Cg_exo -64.97 -33.94 49.57 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 122.818 2.345 . . . . 0.0 112.078 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -120.2 -78.85 0.6 Allowed 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.03 -178.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 62.25 29.25 72.5 Favored Glycine 0 N--CA 1.439 -1.121 0 O-C-N 123.772 0.67 . . . . 0.0 112.925 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.24 -44.26 1.15 Allowed 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 117.507 0.654 . . . . 0.0 110.721 -175.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -106.14 103.02 12.4 Favored 'General case' 0 C--N 1.288 -2.09 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -134.63 124.31 16.82 Favored Pre-proline 0 C--N 1.304 -1.375 0 CA-C-N 115.92 -0.582 . . . . 0.0 112.412 -173.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -71.1 -37.02 6.54 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.375 2.05 . . . . 0.0 110.864 172.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.509 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 0.3 OUTLIER -112.12 -57.01 2.33 Favored 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.899 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 149.15 -66.85 0.38 Allowed Glycine 0 CA--C 1.481 -2.055 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.774 -177.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 87.0 m -65.81 130.22 42.52 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 115.105 -0.548 . . . . 0.0 110.45 176.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -106.75 114.38 28.44 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-O 122.196 0.998 . . . . 0.0 109.252 175.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 mp -113.45 128.87 70.07 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.551 0 N-CA-C 106.36 -1.718 . . . . 0.0 106.36 -177.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.561 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.6 ptp180 -67.29 124.2 22.46 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-O 121.467 0.651 . . . . 0.0 111.609 -174.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -61.73 -19.74 21.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.539 -176.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -76.33 -11.71 59.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.314 -178.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 3.4 pt20 -98.63 -10.47 23.28 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 119.616 -0.834 . . . . 0.0 110.575 178.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -105.94 3.83 28.87 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.556 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 34' ' ' MET . 3.7 t-20 -57.4 -34.81 69.26 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.492 0.495 . . . . 0.0 111.528 -176.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -69.13 -53.83 18.12 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.17 -52.57 62.89 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.578 -1.192 . . . . 0.0 108.46 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -51.16 -60.77 2.75 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 125.022 1.329 . . . . 0.0 112.415 176.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.498 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 27.6 ptm -66.21 -39.61 89.74 Favored 'General case' 0 C--O 1.208 -1.108 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -173.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.415 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 2.5 t-80 -68.47 -27.08 65.84 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.543 -175.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.8 mt -82.97 -34.74 26.35 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.578 176.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.465 ' HA ' HG13 ' A' ' 96' ' ' VAL . 41.4 p -82.52 -21.68 35.32 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 118.447 -1.301 . . . . 0.0 112.007 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.9 t -90.15 121.73 32.46 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.682 -178.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -98.92 96.79 8.09 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 168.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.422 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 4.4 t70 -67.99 176.76 2.46 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.702 0.763 . . . . 0.0 112.941 -170.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 28.9 p90 -105.29 -32.43 8.62 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 124.004 0.922 . . . . 0.0 112.583 -170.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.82 6.09 29.65 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.866 -175.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.422 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 52.8 mt -75.01 89.79 2.43 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.522 179.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 72.6 mtm180 -117.66 -39.35 3.15 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 178.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 22.7 mmt -99.52 15.72 25.61 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 114.59 -1.187 . . . . 0.0 108.475 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -134.2 88.89 2.5 Favored 'General case' 0 N--CA 1.434 -1.251 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.216 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 59.7 t -109.58 -59.83 3.12 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -139.69 28.34 2.19 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 122.363 1.077 . . . . 0.0 108.189 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -78.28 150.46 77.14 Favored Pre-proline 0 C--N 1.31 -1.117 0 CA-C-N 113.847 -1.524 . . . . 0.0 111.073 -175.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.06 -30.36 89.92 Favored 'Trans proline' 0 C--O 1.216 -0.611 0 C-N-CA 123.509 2.806 . . . . 0.0 112.467 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -64.84 -7.42 11.13 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -178.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -70.31 -14.56 62.64 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-O 120.947 0.403 . . . . 0.0 110.481 175.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -72.52 -2.09 18.38 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.879 176.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.486 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 20.3 pt20 -55.92 -43.62 77.51 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 122.908 0.483 . . . . 0.0 111.703 -178.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.415 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 0.9 OUTLIER -71.19 -20.55 62.26 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-O 120.988 0.423 . . . . 0.0 110.972 -179.802 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -80.5 -41.86 23.53 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 179.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.4 m -57.83 -28.99 64.58 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.374 0.606 . . . . 0.0 110.312 176.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 60.1 mt -86.82 -55.73 3.72 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.801 178.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 51.9 t -59.57 -48.16 82.74 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.291 0.636 . . . . 0.0 111.827 -177.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.56 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 24.9 t -60.49 -33.64 72.89 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 122.835 0.454 . . . . 0.0 110.583 178.351 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.425 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 3.2 t-20 -78.31 -23.85 46.93 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.803 0.811 . . . . 0.0 110.035 -177.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -82.1 -47.93 11.97 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.774 178.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.56 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.8 pp -68.04 -30.71 69.99 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.508 -176.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.425 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 16.9 pt20 -69.05 -15.28 63.42 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.19 -176.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -82.42 -18.36 42.14 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.393 0.616 . . . . 0.0 110.306 177.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.418 HG12 ' HB2' ' A' ' 70' ' ' CYS . 12.0 t -76.76 163.27 3.97 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.513 ' HB2' ' SG ' ' A' ' 70' ' ' CYS . 46.0 mt-10 -47.73 147.48 1.88 Allowed 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 123.545 0.738 . . . . 0.0 112.295 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.534 ' HB2' HE22 ' A' ' 113' ' ' GLN . 22.0 ptmt -50.83 -38.62 50.02 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.068 0.947 . . . . 0.0 112.874 -176.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.517 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 4.1 pt20 -87.6 -19.55 27.64 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.504 0.669 . . . . 0.0 110.666 -177.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.517 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 44.6 m -96.97 -9.1 28.95 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.152 -171.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.444 ' HB3' HD22 ' A' ' 112' ' ' LEU . 47.3 mt-30 -57.11 -46.91 82.23 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-O 121.339 0.59 . . . . 0.0 109.844 175.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.425 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.5 p -76.87 -23.6 52.62 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.541 0.686 . . . . 0.0 111.546 179.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -72.87 -30.52 64.03 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.425 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.553 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -62.44 -27.42 69.1 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.398 176.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.526 HD11 HD22 ' A' ' 63' ' ' LEU . 32.4 mm -70.21 -27.69 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.528 -179.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -74.78 -41.78 59.38 Favored 'General case' 0 CA--C 1.5 -0.963 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 -176.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.436 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 50.2 mm-40 -59.05 -42.33 90.04 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 112.227 -2.26 . . . . 0.0 110.374 -179.198 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 74' ' ' ALA . 30.5 t -60.39 -43.95 95.02 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 179.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 75' ' ' ILE . 48.0 t -64.4 -47.29 90.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.836 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -177.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.63 -59.46 4.81 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.505 -179.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 9.5 pt20 -66.41 -30.24 70.56 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 120.931 0.396 . . . . 0.0 112.024 -175.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -74.3 -40.45 62.25 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 121.019 -0.273 . . . . 0.0 110.905 -179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -76.67 -36.94 57.0 Favored 'General case' 0 C--N 1.312 -1.042 0 C-N-CA 119.794 -0.762 . . . . 0.0 110.646 -177.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.25 -26.46 62.91 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.618 -0.265 . . . . 0.0 110.869 -177.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -77.63 -30.28 52.15 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.493 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.573 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.0 mm? -86.18 -40.81 15.24 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.809 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.44 -31.76 70.73 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.629 0.772 . . . . 0.0 112.12 -177.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -77.55 -12.9 60.01 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.782 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -129.09 -100.83 0.97 Allowed Glycine 0 N--CA 1.44 -1.044 0 C-N-CA 119.766 -1.207 . . . . 0.0 113.894 -175.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -71.2 -22.46 62.02 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -173.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.573 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 106.45 -88.54 0.56 Allowed Glycine 0 CA--C 1.472 -2.62 0 N-CA-C 107.917 -2.073 . . . . 0.0 107.917 -174.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.535 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 79.03 -46.56 2.97 Favored Glycine 0 C--O 1.189 -2.712 0 CA-C-O 118.98 -0.9 . . . . 0.0 114.559 171.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.468 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 52.3 mt-30 -46.45 -27.62 1.14 Allowed 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 125.001 1.321 . . . . 0.0 114.399 -175.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.438 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 7.8 pt20 -71.98 -46.56 56.87 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.783 0.325 . . . . 0.0 111.019 176.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.438 ' N ' ' HG3' ' A' ' 94' ' ' GLN . 28.9 pt20 -85.63 -47.17 10.09 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.632 0.73 . . . . 0.0 110.265 -176.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.465 HG13 ' HA ' ' A' ' 37' ' ' THR . 69.6 t -59.82 -22.56 24.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 C-N-CA 126.331 1.852 . . . . 0.0 110.679 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 8.6 tt0 -46.2 -44.73 16.34 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.085 0.554 . . . . 0.0 112.469 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -68.17 -18.74 64.69 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -177.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 3.9 tpt -100.33 -46.69 5.18 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -175.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.6 p -65.74 -25.85 37.44 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.194 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -24.54 67.93 Favored 'General case' 0 C--O 1.219 -0.515 0 O-C-N 121.93 -0.481 . . . . 0.0 111.335 176.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -65.46 -29.29 69.94 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 122.963 0.505 . . . . 0.0 110.447 178.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.548 ' HA ' HD13 ' A' ' 106' ' ' LEU . . . -58.26 -32.08 68.03 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-O 121.383 0.611 . . . . 0.0 110.556 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.56 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 37.1 mt-30 -68.78 -18.19 64.16 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.864 -178.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 42.9 mtp -91.56 -15.09 29.19 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 103' ' ' ALA . 6.4 mp -53.44 -49.07 90.42 Favored Pre-proline 0 C--N 1.319 -0.728 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 25.5 Cg_endo -61.64 -22.31 74.14 Favored 'Trans proline' 0 C--N 1.364 1.39 0 C-N-CA 121.567 1.511 . . . . 0.0 113.077 177.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -85.09 -41.59 15.59 Favored 'General case' 0 N--CA 1.411 -2.385 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -75.88 -42.45 49.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.858 -178.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.449 ' SG ' HD11 ' A' ' 63' ' ' LEU . 8.9 t -84.09 -2.08 56.08 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.649 -174.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 60.69 61.47 1.69 Allowed 'General case' 0 CA--C 1.508 -0.67 0 CA-C-O 122.991 1.377 . . . . 0.0 109.84 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.444 HD22 ' HB3' ' A' ' 71' ' ' GLN . 39.4 mt -96.86 158.03 15.62 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 114.106 -1.406 . . . . 0.0 109.53 178.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.534 HE22 ' HB2' ' A' ' 68' ' ' LYS . 70.7 mt-30 -81.37 43.74 0.75 Allowed 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 122.071 0.938 . . . . 0.0 111.57 -174.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 98.3 m -163.39 149.98 12.18 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 104.637 -2.357 . . . . 0.0 104.637 -177.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.7 m -142.38 139.48 31.73 Favored 'General case' 0 C--N 1.288 -2.072 0 CA-C-N 118.632 0.651 . . . . 0.0 109.602 178.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.56 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 55.1 mt . . . . . 0 C--N 1.3 -1.55 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -178.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.662 0 N-CA-C 111.321 -0.712 . . . . 0.0 111.321 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -76.81 127.79 33.4 Favored 'General case' 0 CA--C 1.49 -1.33 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 176.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.475 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 72.2 m -138.65 151.54 47.29 Favored 'General case' 0 C--N 1.282 -2.347 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.117 -176.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 79.9 p -81.79 172.37 13.43 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 120.96 0.409 . . . . 0.0 110.151 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -97.6 81.99 3.01 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.614 0.721 . . . . 0.0 109.87 176.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.1 t -156.27 164.56 38.18 Favored 'General case' 0 C--N 1.289 -2.061 0 N-CA-C 106.021 -1.844 . . . . 0.0 106.021 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.4 mm -129.18 116.62 18.83 Favored Pre-proline 0 C--N 1.305 -1.358 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 177.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -72.65 146.53 86.9 Favored 'Cis proline' 0 C--O 1.244 0.778 0 C-N-CA 124.024 -1.24 . . . . 0.0 111.33 -1.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.475 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 61.2 Cg_endo -70.57 153.25 65.31 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.498 2.132 . . . . 0.0 112.263 -177.241 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.1 mm -95.66 107.92 20.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 N-CA-C 106.46 -1.682 . . . . 0.0 106.46 176.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 80.9 m -104.77 137.77 42.06 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-O 121.687 0.756 . . . . 0.0 112.144 -176.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -81.28 162.38 59.16 Favored Pre-proline 0 C--N 1.295 -1.798 0 CA-C-N 114.185 -1.371 . . . . 0.0 109.811 178.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.0 42.58 1.13 Allowed 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 123.073 2.515 . . . . 0.0 111.266 178.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -78.83 79.43 5.23 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 114.593 -1.185 . . . . 0.0 111.453 -178.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -140.96 33.27 2.04 Favored Glycine 0 C--N 1.289 -2.072 0 N-CA-C 106.964 -2.454 . . . . 0.0 106.964 174.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 pp -135.92 -11.2 2.02 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.215 -1.493 . . . . 0.0 113.32 -172.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -92.76 87.22 5.78 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-O 121.979 0.895 . . . . 0.0 109.188 178.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -135.38 96.26 14.0 Favored Pre-proline 0 C--N 1.289 -2.038 0 N-CA-C 106.663 -1.606 . . . . 0.0 106.663 -177.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.501 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . 85.8 Cg_exo -51.7 -51.55 10.94 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.344 2.696 . . . . 0.0 111.975 -175.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.617 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 1.3 mpt_? -104.58 -51.26 3.12 Favored 'General case' 0 CA--C 1.486 -1.493 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 176.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 170.94 -49.42 0.19 Allowed Glycine 0 N--CA 1.405 -3.432 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 88.4 m -84.19 130.09 34.85 Favored 'General case' 0 C--N 1.271 -2.807 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 173.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -106.43 94.07 4.94 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 122.11 0.957 . . . . 0.0 108.923 177.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.426 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.1 mp -98.05 130.62 46.55 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.606 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 -176.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.504 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 35.7 ptt180 -67.37 116.26 7.92 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-O 121.15 0.5 . . . . 0.0 111.402 -176.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.512 ' HB ' ' OE1' ' A' ' 81' ' ' GLN . 2.6 pp -60.82 -18.5 17.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.918 -176.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -73.67 -16.57 61.21 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.879 -178.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 1.9 pt20 -89.56 -15.86 31.95 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.482 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.7 mm? -97.67 6.37 48.07 Favored 'General case' 0 CA--C 1.485 -1.555 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.417 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -56.59 -34.15 66.89 Favored 'General case' 0 C--N 1.31 -1.136 0 O-C-N 124.068 0.855 . . . . 0.0 111.655 -178.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -70.58 -52.88 18.56 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.5 t -54.51 -50.57 67.52 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.759 -1.109 . . . . 0.0 108.166 -178.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -52.94 -58.49 6.77 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 124.401 1.08 . . . . 0.0 112.161 175.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -66.14 -39.04 89.55 Favored 'General case' 0 C--O 1.214 -0.788 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.607 -173.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.411 ' CD2' ' HB3' ' A' ' 55' ' ' HIS . 1.9 t-80 -73.05 -24.87 60.75 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.183 -175.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.429 ' O ' ' HB3' ' A' ' 99' ' ' MET . 95.7 mt -88.68 -23.44 23.0 Favored 'General case' 0 C--O 1.21 -0.979 0 C-N-CA 120.866 -0.333 . . . . 0.0 111.781 177.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.54 ' HA ' HG13 ' A' ' 96' ' ' VAL . 40.8 p -89.52 -21.61 22.83 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 118.382 -1.327 . . . . 0.0 111.338 178.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.5 m -90.29 152.96 20.81 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.846 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.413 ' CE2' ' HA ' ' A' ' 96' ' ' VAL . 52.4 m-85 -129.88 -178.64 4.8 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.806 0.812 . . . . 0.0 111.658 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.742 ' OD1' ' HD3' ' A' ' 42' ' ' LYS . 11.8 t70 -127.86 -179.88 5.19 Favored 'General case' 0 N--CA 1.386 -3.666 0 N-CA-C 102.175 -3.269 . . . . 0.0 102.175 175.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -149.86 -33.61 0.19 Allowed 'General case' 0 C--N 1.275 -2.632 0 CA-C-N 119.267 0.94 . . . . 0.0 110.728 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.742 ' HD3' ' OD1' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -86.21 7.43 25.13 Favored 'General case' 0 N--CA 1.425 -1.686 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.092 -177.094 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.507 ' HG ' ' OD1' ' A' ' 40' ' ' ASP . 95.7 mt -58.74 102.28 0.11 Allowed 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.48 0.712 . . . . 0.0 110.303 174.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -89.45 -26.67 20.84 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-O 121.774 0.797 . . . . 0.0 109.495 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 18.2 ptt? -148.01 87.31 1.6 Allowed 'General case' 0 N--CA 1.416 -2.147 0 CA-C-N 114.798 -1.092 . . . . 0.0 109.81 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.447 ' HA ' ' ND2' ' A' ' 49' ' ' ASN . . . -100.95 19.79 16.68 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.338 177.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 46.2 t -68.69 -54.57 20.16 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.455 -176.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -142.64 91.33 2.3 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-O 121.75 0.786 . . . . 0.0 110.983 -177.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.543 ' HB2' ' HG2' ' A' ' 52' ' ' GLN . 73.7 m-20 -129.97 151.57 78.49 Favored Pre-proline 0 C--N 1.303 -1.452 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 178.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -58.6 -34.61 98.98 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.458 2.106 . . . . 0.0 109.802 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.602 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 55.1 mtmt -67.07 -16.57 64.42 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 114.167 -1.379 . . . . 0.0 113.175 -178.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.543 ' HG2' ' HB2' ' A' ' 49' ' ' ASN . 12.3 mm100 -74.96 -23.46 58.29 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 118.601 -1.24 . . . . 0.0 110.782 -179.037 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.405 ' O ' ' HB3' ' A' ' 56' ' ' LEU . 11.5 pt20 -113.98 13.43 18.24 Favored 'General case' 0 N--CA 1.44 -0.969 0 C-N-CA 119.851 -0.74 . . . . 0.0 110.925 177.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.612 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 30.1 pt20 -63.78 -47.73 79.78 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.411 ' HB3' ' CD2' ' A' ' 35' ' ' HIS . 1.0 OUTLIER -66.91 -20.29 65.88 Favored 'General case' 0 C--O 1.214 -0.778 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.433 178.715 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.405 ' HB3' ' O ' ' A' ' 53' ' ' GLN . 12.0 tp -72.71 -54.27 9.42 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 174.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.5 m -57.94 -21.03 41.99 Favored 'General case' 0 C--O 1.209 -1.049 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.057 -179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 58.4 mt -90.19 -57.79 2.72 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.507 176.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 50.7 t -67.3 -50.4 60.42 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.119 0.568 . . . . 0.0 111.849 -176.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.594 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 43.4 t -61.71 -34.94 76.68 Favored 'General case' 0 CA--C 1.495 -1.14 0 CA-C-O 121.645 0.736 . . . . 0.0 109.262 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.488 ' O ' ' HG2' ' A' ' 64' ' ' GLN . 8.9 t30 -72.49 -35.93 68.28 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.631 178.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -76.06 -38.99 56.44 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-O 120.875 0.369 . . . . 0.0 111.376 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.667 HD22 HD11 ' A' ' 75' ' ' ILE . 3.9 pp -71.83 -30.96 66.03 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 121.05 0.452 . . . . 0.0 110.617 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 24.2 pt20 -73.36 -4.27 32.36 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.189 0.518 . . . . 0.0 110.883 -177.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 7.9 mm-40 -84.94 -17.92 36.21 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 122.017 0.913 . . . . 0.0 108.578 176.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 10.2 t -85.07 164.19 2.56 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.471 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 4.9 mp0 -54.21 141.83 28.05 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 124.362 1.065 . . . . 0.0 110.616 177.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -57.6 -33.02 67.76 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -174.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.49 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 16.7 pt20 -80.22 -9.6 59.73 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.597 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.49 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.3 m -112.29 -9.57 13.87 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.215 -174.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 29.1 mt-30 -61.52 -40.24 93.92 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 121.123 0.487 . . . . 0.0 110.774 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 1.9 p -79.47 -27.24 41.58 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.317 0.579 . . . . 0.0 111.295 177.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 8.3 mm-40 -69.35 -33.46 73.13 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.483 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.06 -30.75 68.28 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.003 177.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.667 HD11 HD22 ' A' ' 63' ' ' LEU . 31.6 mm -66.94 -34.81 72.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.045 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -71.84 -40.07 69.3 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 -172.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 73' ' ' GLU . 7.2 mm100 -62.31 -37.12 84.35 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 112.579 -2.101 . . . . 0.0 109.439 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 74' ' ' ALA . 33.3 t -60.86 -48.48 88.71 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 75' ' ' ILE . 40.6 t -64.71 -46.82 91.09 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.92 0 CA-C-N 115.267 -0.879 . . . . 0.0 108.724 -173.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -57.11 -49.67 75.19 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.614 -1.175 . . . . 0.0 112.129 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.512 ' OE1' ' HB ' ' A' ' 26' ' ' ILE . 28.8 pt20 -74.29 -30.33 62.04 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.359 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.402 ' HB1' ' CG2' ' A' ' 37' ' ' THR . . . -75.18 -40.0 59.78 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 120.95 0.405 . . . . 0.0 111.095 -178.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.494 ' HB2' HE22 ' A' ' 93' ' ' GLN . 13.8 pt20 -72.92 -30.3 63.79 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.244 -177.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -75.91 -31.07 59.0 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.484 -179.147 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -75.66 -28.37 58.7 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.202 0.525 . . . . 0.0 111.62 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.492 HD21 ' HB ' ' A' ' 37' ' ' THR . 4.4 mm? -84.6 -35.04 23.0 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.802 174.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -67.09 -32.22 73.23 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.13 0.491 . . . . 0.0 110.526 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -77.81 -11.04 59.85 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.875 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -89.24 -134.27 5.15 Favored Glycine 0 N--CA 1.424 -2.112 0 N-CA-C 110.946 -0.861 . . . . 0.0 110.946 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -103.92 -49.78 3.55 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-O 120.756 0.312 . . . . 0.0 110.67 -178.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -157.02 -148.18 5.01 Favored Glycine 0 N--CA 1.446 -0.637 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 100.53 -31.95 7.94 Favored Glycine 0 C--O 1.205 -1.663 0 CA-C-O 118.918 -0.934 . . . . 0.0 114.185 176.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.494 HE22 ' HB2' ' A' ' 83' ' ' GLN . 14.8 mm100 -48.95 -33.88 11.81 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -177.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -77.26 -37.17 53.6 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.039 -178.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.564 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 29.2 pt20 -82.58 -44.46 15.81 Favored 'General case' 0 CA--C 1.497 -1.072 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.243 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.54 HG13 ' HA ' ' A' ' 37' ' ' THR . 95.8 t -58.55 -23.84 23.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.805 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -49.84 -44.11 49.3 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.912 178.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.564 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 3.7 pt20 -66.4 -18.24 65.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.854 0.359 . . . . 0.0 111.777 -177.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.429 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 6.4 tpt -101.37 -48.69 4.28 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -176.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.6 p -64.97 -24.21 35.05 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 CA-C-O 120.969 0.414 . . . . 0.0 111.499 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.432 ' HG3' ' N ' ' A' ' 102' ' ' LYS . 27.8 pttt -64.27 -23.77 67.42 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.918 -0.489 . . . . 0.0 110.578 176.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.432 ' N ' ' HG3' ' A' ' 101' ' ' LYS . 24.6 mtpp -64.52 -32.71 74.46 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.566 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -64.0 -37.27 86.79 Favored 'General case' 0 C--O 1.196 -1.758 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.148 176.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -68.18 -18.62 64.65 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.226 0.536 . . . . 0.0 110.704 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 29.8 mtm -91.79 -14.8 29.24 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.566 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.6 OUTLIER -52.68 -44.32 95.09 Favored Pre-proline 0 N--CA 1.475 0.794 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -177.368 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.446 ' HB2' ' O ' ' A' ' 114' ' ' CYS . 18.2 Cg_endo -60.34 -24.0 76.22 Favored 'Trans proline' 0 C--N 1.368 1.594 0 CA-C-N 120.935 1.37 . . . . 0.0 112.862 176.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -89.24 -37.67 14.8 Favored 'General case' 0 N--CA 1.408 -2.564 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.138 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -76.88 -34.09 57.79 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 12.4 t -91.97 -2.81 56.56 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 66.3 56.09 0.82 Allowed 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 122.42 1.105 . . . . 0.0 109.696 178.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 107' ' ' PRO . 36.8 mt -101.48 157.1 17.06 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.102 -179.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -78.47 39.83 0.35 Allowed 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.876 0.87 . . . . 0.0 112.979 -173.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 86.3 m -154.8 158.48 39.51 Favored 'General case' 0 C--N 1.282 -2.342 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 -174.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 24.0 p -147.01 141.23 26.2 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 43.1 mm . . . . . 0 C--N 1.313 -1.012 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -179.898 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.057 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 49.3 mtm180 -91.7 127.05 37.01 Favored 'General case' 0 CA--C 1.472 -2.035 0 C-N-CA 119.392 -0.923 . . . . 0.0 108.775 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 60.6 m -124.74 140.5 52.87 Favored 'General case' 0 C--N 1.27 -2.878 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 177.224 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 72.6 p -69.0 140.38 55.0 Favored 'General case' 0 N--CA 1.415 -2.214 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -84.86 69.13 10.71 Favored 'General case' 0 N--CA 1.421 -1.907 0 CA-C-O 121.602 0.715 . . . . 0.0 109.912 -175.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.0 t -148.5 171.79 15.53 Favored 'General case' 0 N--CA 1.417 -2.094 0 N-CA-C 107.014 -1.476 . . . . 0.0 107.014 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 39.7 mm -128.45 118.21 20.17 Favored Pre-proline 0 C--N 1.303 -1.451 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -72.93 145.75 84.95 Favored 'Cis proline' 0 C--O 1.245 0.835 0 C-N-CA 123.877 -1.301 . . . . 0.0 112.668 1.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.446 ' HB3' HE22 ' A' ' 23' ' ' GLN . 71.2 Cg_endo -77.66 136.86 15.72 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 122.401 2.067 . . . . 0.0 112.154 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 42.9 mm -95.88 110.03 23.69 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.126 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 79.0 m -105.38 135.95 45.83 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -176.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -111.37 154.93 43.53 Favored Pre-proline 0 C--N 1.305 -1.363 0 C-N-CA 125.59 1.556 . . . . 0.0 108.801 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -47.78 -56.51 3.03 Favored 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.868 3.045 . . . . 0.0 113.335 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -159.42 -153.34 0.35 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 105.222 -2.14 . . . . 0.0 105.222 -178.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -157.58 -65.41 0.01 OUTLIER Glycine 0 CA--C 1.474 -2.514 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 179.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -137.49 -61.86 0.63 Allowed 'General case' 0 N--CA 1.422 -1.872 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -146.78 107.55 4.13 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.07 178.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -136.38 115.09 10.69 Favored Pre-proline 0 C--N 1.301 -1.502 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.418 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . 36.4 Cg_exo -62.32 -42.79 26.24 Favored 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 121.964 1.776 . . . . 0.0 110.195 177.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.514 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 2.9 mpt_? -126.08 -50.86 1.55 Allowed 'General case' 0 CA--C 1.491 -1.314 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 172.13 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.43 65.77 1.06 Allowed Glycine 0 N--CA 1.407 -3.284 0 N-CA-C 108.643 -1.783 . . . . 0.0 108.643 -174.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 m -91.43 150.39 21.28 Favored 'General case' 0 C--N 1.272 -2.763 0 CA-C-N 114.439 -0.881 . . . . 0.0 109.907 176.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.446 HE22 ' HB3' ' A' ' 9' ' ' PRO . 3.9 pt20 -107.39 98.91 8.48 Favored 'General case' 0 C--N 1.276 -2.599 0 CA-C-O 122.144 0.973 . . . . 0.0 110.05 178.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.49 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 3.3 mp -105.29 138.99 27.73 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.813 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.623 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 16.8 ptt180 -68.51 117.41 10.24 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-O 121.171 0.51 . . . . 0.0 110.734 179.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.473 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -64.06 -13.53 13.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -176.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -77.36 -20.12 55.26 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.953 -178.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.623 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 14.9 pt20 -86.68 -15.91 38.16 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 119.884 -0.726 . . . . 0.0 109.382 -178.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.422 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.6 mm? -98.69 1.77 46.49 Favored 'General case' 0 CA--C 1.483 -1.623 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.79 177.217 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.513 ' HA ' HE21 ' A' ' 33' ' ' GLN . 27.7 t-20 -56.18 -32.96 64.82 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.898 -178.248 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -71.98 -52.9 14.87 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -177.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.416 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -54.72 -53.73 51.12 Favored 'General case' 0 CA--C 1.516 -0.353 0 O-C-N 123.682 0.613 . . . . 0.0 109.863 177.717 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.513 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.5 tt0 -49.42 -58.45 5.12 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 123.88 0.872 . . . . 0.0 112.63 176.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 11.8 ptp -65.96 -43.02 89.15 Favored 'General case' 0 CA--C 1.498 -1.055 0 C-N-CA 119.95 -0.7 . . . . 0.0 111.72 -175.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -67.7 -32.79 73.67 Favored 'General case' 0 C--N 1.312 -1.028 0 O-C-N 123.835 0.71 . . . . 0.0 110.825 -174.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.433 ' O ' ' HB3' ' A' ' 99' ' ' MET . 94.7 mt -78.46 -25.69 45.91 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-O 121.135 0.493 . . . . 0.0 111.171 178.046 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.561 HG21 HE21 ' A' ' 85' ' ' GLN . 68.0 p -91.69 -0.27 57.55 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.709 174.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.8 t -88.29 121.79 31.08 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.747 -175.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -128.34 94.85 3.99 Favored 'General case' 0 N--CA 1.419 -2.017 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 169.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -77.37 178.28 7.28 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.624 -177.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -102.19 -30.95 10.81 Favored 'General case' 0 C--N 1.279 -2.457 0 C-N-CA 123.59 0.756 . . . . 0.0 111.657 -173.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.82 14.28 17.82 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.988 -175.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.5 mt -60.03 103.22 0.2 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.929 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -120.49 -14.92 8.61 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.171 0.51 . . . . 0.0 110.161 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 94.9 mmm -133.83 31.2 3.65 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -116.31 23.27 12.24 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.599 -176.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 46.9 t -76.76 -61.38 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 178.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -148.99 110.81 4.55 Favored 'General case' 0 CA--C 1.496 -1.131 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 174.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.408 ' HB3' ' HG2' ' A' ' 52' ' ' GLN . 45.7 t-20 -149.76 133.55 8.79 Favored Pre-proline 0 C--N 1.288 -2.083 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 -174.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -53.25 -35.61 74.76 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.056 2.504 . . . . 0.0 112.188 178.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -68.11 -20.17 64.9 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.408 ' HG2' ' HB3' ' A' ' 49' ' ' ASN . 23.7 mm-40 -65.43 -26.38 67.94 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.136 178.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -78.05 5.3 10.24 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -178.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.49 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 4.5 pt20 -57.31 -37.34 72.31 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.21 0.604 . . . . 0.0 110.48 177.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.59 -22.59 66.13 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.838 -178.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -74.3 -43.82 55.21 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 177.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.2 m -61.66 -26.7 68.18 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.172 0.511 . . . . 0.0 110.783 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 59.3 mt -84.45 -53.37 5.48 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.397 177.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.5 t -65.4 -48.03 74.25 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.11 0.964 . . . . 0.0 111.16 -175.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.526 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 41.7 t -59.4 -33.3 71.04 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 122.97 0.508 . . . . 0.0 110.53 177.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -81.45 -23.43 37.48 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.712 0.767 . . . . 0.0 110.373 -178.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -83.13 -40.02 20.32 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.326 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.526 ' CD2' ' HA ' ' A' ' 60' ' ' CYS . 3.9 pp -67.5 -32.57 73.47 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 121.229 0.538 . . . . 0.0 110.522 -178.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.402 ' N ' HD12 ' A' ' 63' ' ' LEU . 16.4 pt20 -71.73 -7.25 46.94 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.656 -179.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -78.44 -22.31 47.83 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.747 0.784 . . . . 0.0 109.15 175.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.412 HG12 ' HB2' ' A' ' 70' ' ' CYS . 7.3 t -82.15 163.95 2.99 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.224 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -50.79 144.02 8.97 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.06 0.544 . . . . 0.0 110.579 175.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -62.19 -31.02 71.49 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -174.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -79.27 -10.57 59.85 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.545 0.688 . . . . 0.0 109.94 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.412 ' HB2' HG12 ' A' ' 66' ' ' VAL . 59.8 m -108.44 -10.48 15.28 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.943 -176.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -59.3 -40.61 86.74 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 178.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.515 ' HA ' HG12 ' A' ' 75' ' ' ILE . 8.7 p -83.93 -23.76 31.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 120.024 -0.67 . . . . 0.0 112.625 177.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.03 -36.03 82.15 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.697 0.76 . . . . 0.0 109.534 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.412 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -58.05 -29.54 65.45 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.265 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.576 HG21 ' HD3' ' A' ' 107' ' ' PRO . 28.5 mm -67.39 -35.79 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.09 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.377 -177.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.491 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 14.3 mmmm -69.05 -41.78 77.16 Favored 'General case' 0 CA--C 1.489 -1.385 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 -176.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.52 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 6.7 mt-30 -59.58 -39.35 83.81 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 113.689 -1.596 . . . . 0.0 111.425 -177.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.422 HG22 ' HB3' ' A' ' 29' ' ' LEU . 21.9 t -56.99 -44.6 82.96 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.694 0 O-C-N 123.743 0.652 . . . . 0.0 109.52 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 23.7 t -65.55 -48.55 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 CA-C-N 115.507 -0.769 . . . . 0.0 108.966 -176.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 43.1 mt-10 -55.71 -52.68 63.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.558 -1.201 . . . . 0.0 111.054 -177.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.52 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -71.29 -34.82 71.0 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -177.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.433 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -71.8 -37.64 70.36 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -177.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -76.95 -37.01 56.1 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.753 -179.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.432 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -69.38 -30.62 68.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.693 0.282 . . . . 0.0 111.309 -177.75 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.561 HE21 HG21 ' A' ' 37' ' ' THR . 24.4 pt20 -73.23 -31.47 64.16 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.141 0.496 . . . . 0.0 110.058 -177.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.1 mm? -82.7 -30.48 29.14 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.929 175.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -59.95 -40.1 87.86 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 123.36 0.664 . . . . 0.0 110.045 176.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -83.34 -5.75 59.24 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.701 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -94.58 -136.71 8.46 Favored Glycine 0 N--CA 1.418 -2.515 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.839 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -93.35 -19.02 21.74 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -175.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 148.17 -118.48 0.99 Allowed Glycine 0 CA--C 1.483 -1.924 0 N-CA-C 108.444 -1.863 . . . . 0.0 108.444 -175.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.56 -33.29 2.32 Favored Glycine 0 C--O 1.201 -1.93 0 CA-C-O 118.683 -1.065 . . . . 0.0 114.903 173.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -47.2 -33.08 4.97 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 -177.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -77.15 -37.0 54.83 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 120.797 0.332 . . . . 0.0 111.361 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.559 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 14.0 pt20 -85.59 -41.29 15.38 Favored 'General case' 0 C--O 1.212 -0.905 0 CA-C-O 121.452 0.644 . . . . 0.0 110.038 -177.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.467 HG11 HG22 ' A' ' 37' ' ' THR . 73.2 t -62.32 -23.48 32.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.238 0 C-N-CA 124.9 1.28 . . . . 0.0 111.045 176.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.448 ' HA ' HG12 ' A' ' 100' ' ' VAL . 35.5 tt0 -53.22 -37.32 61.94 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -177.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.6 pt20 -68.96 -18.6 64.1 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.89 0.376 . . . . 0.0 111.629 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.433 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 6.3 tpt -106.04 -45.13 4.42 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -174.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.448 HG12 ' HA ' ' A' ' 97' ' ' GLN . 14.8 p -62.72 -24.9 36.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.987 178.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -61.31 -22.97 65.37 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.862 -0.524 . . . . 0.0 111.173 173.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -67.58 -23.59 65.41 Favored 'General case' 0 N--CA 1.44 -0.941 0 O-C-N 122.055 -0.403 . . . . 0.0 110.484 177.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.453 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -63.92 -34.92 79.05 Favored 'General case' 0 C--O 1.202 -1.429 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 174.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.481 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 44.7 mt-30 -75.39 -19.41 59.55 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.547 -179.095 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 48.2 mtt -86.92 -15.65 38.29 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.796 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.453 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 95.8 mt -52.37 -50.7 78.26 Favored Pre-proline 0 C--N 1.319 -0.758 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -178.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.576 ' HD3' HG21 ' A' ' 75' ' ' ILE . 29.9 Cg_endo -62.96 -22.63 73.92 Favored 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 121.981 1.788 . . . . 0.0 112.524 178.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 63.0 m-20 -83.72 -41.79 17.3 Favored 'General case' 0 N--CA 1.408 -2.546 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -176.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -81.41 -33.84 31.97 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.303 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.403 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 23.2 t -87.52 -1.51 57.98 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 53.34 60.22 3.87 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.146 1.378 . . . . 0.0 110.33 -179.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.462 HD21 HD11 ' A' ' 63' ' ' LEU . 79.5 mt -91.19 159.73 15.91 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-N 113.984 -1.462 . . . . 0.0 110.087 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -74.37 35.83 0.1 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.088 0.955 . . . . 0.0 112.221 -175.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.426 ' H ' ' C ' ' A' ' 112' ' ' LEU . 57.3 m -157.62 149.27 21.95 Favored 'General case' 0 N--CA 1.417 -2.097 0 C-N-CA 125.702 1.601 . . . . 0.0 107.645 -175.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 4.5 p -134.59 131.96 38.48 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-O 120.99 0.424 . . . . 0.0 110.45 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.481 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 62.0 mt . . . . . 0 C--N 1.303 -1.451 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 178.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -1.001 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -75.23 149.6 38.84 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.467 ' HB3' ' HB2' ' A' ' 9' ' ' PRO . 61.8 m -127.89 148.19 50.48 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.7 p -68.29 154.99 40.65 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 176.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -92.04 71.41 5.49 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.713 0.768 . . . . 0.0 109.246 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.0 t -147.12 169.71 18.71 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.4 mp -128.82 114.72 19.09 Favored Pre-proline 0 C--N 1.31 -1.138 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -75.53 147.09 87.63 Favored 'Cis proline' 0 C--O 1.237 0.426 0 C-N-CA 124.075 -1.219 . . . . 0.0 111.816 0.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.467 ' HB2' ' HB3' ' A' ' 3' ' ' CYS . 59.1 Cg_endo -72.74 141.46 33.98 Favored 'Trans proline' 0 N--CA 1.446 -1.293 0 C-N-CA 122.118 1.878 . . . . 0.0 111.941 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.7 mm -92.03 113.1 26.77 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 177.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 84.4 m -104.28 133.8 48.57 Favored 'General case' 0 C--N 1.284 -2.241 0 CA-C-O 121.373 0.606 . . . . 0.0 111.798 -174.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -90.28 149.49 41.32 Favored Pre-proline 0 N--CA 1.413 -2.309 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.688 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -56.97 -31.15 88.9 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.887 2.391 . . . . 0.0 110.299 175.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -152.86 -67.4 0.16 Allowed 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 114.082 -1.417 . . . . 0.0 108.15 174.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 142.61 -35.67 1.7 Allowed Glycine 0 CA--C 1.482 -2.019 0 CA-C-N 114.428 -1.26 . . . . 0.0 110.532 -177.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.442 HD11 ' HA ' ' A' ' 114' ' ' CYS . 17.9 tp -147.3 -28.84 0.36 Allowed 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -175.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.454 ' HA ' ' NZ ' ' A' ' 76' ' ' LYS . 30.2 t70 -135.6 95.24 3.22 Favored 'General case' 0 C--N 1.296 -1.734 0 C-N-CA 119.408 -0.917 . . . . 0.0 113.137 -174.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -144.07 72.54 16.53 Favored Pre-proline 0 C--N 1.302 -1.493 0 CA-C-O 121.567 0.699 . . . . 0.0 112.124 174.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.468 ' HD2' ' NH1' ' A' ' 20' ' ' ARG . 83.9 Cg_endo -82.01 7.7 4.92 Favored 'Trans proline' 0 CA--C 1.534 0.484 0 C-N-CA 122.439 2.092 . . . . 0.0 111.641 176.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.468 ' NH1' ' HD2' ' A' ' 19' ' ' PRO . 2.6 mpt_? -91.64 -42.94 9.9 Favored 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 177.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -73.06 -47.04 25.8 Favored Glycine 0 N--CA 1.426 -2.028 0 CA-C-N 114.313 -1.312 . . . . 0.0 110.398 177.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 56.0 m -78.05 113.24 15.79 Favored 'General case' 0 N--CA 1.406 -2.63 0 CA-C-O 121.316 0.579 . . . . 0.0 110.69 176.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -96.68 102.43 14.21 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-O 121.967 0.889 . . . . 0.0 109.827 177.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.2 mp -109.91 138.53 37.13 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.262 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 178.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.486 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 39.8 ptt180 -79.03 122.19 25.88 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.536 -177.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.494 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.5 pp -62.7 -15.82 15.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -176.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -79.3 -15.89 57.24 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.927 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.1 pt20 -84.88 -27.93 26.35 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 119.265 -0.974 . . . . 0.0 108.531 178.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.462 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.6 mm? -87.31 1.74 52.32 Favored 'General case' 0 CA--C 1.481 -1.707 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.41 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.551 ' HA ' HE21 ' A' ' 33' ' ' GLN . 26.1 t-20 -53.26 -34.72 58.39 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.171 0.919 . . . . 0.0 110.591 -179.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -69.47 -53.41 19.34 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.856 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.8 OUTLIER -55.96 -51.69 66.8 Favored 'General case' 0 CA--C 1.503 -0.843 0 O-C-N 123.164 0.29 . . . . 0.0 110.309 178.442 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.551 HE21 ' HA ' ' A' ' 30' ' ' ASN . 5.7 tt0 -49.51 -55.74 12.27 Favored 'General case' 0 N--CA 1.426 -1.658 0 C-N-CA 123.667 0.787 . . . . 0.0 111.713 176.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.7 ptm -68.69 -38.09 80.05 Favored 'General case' 0 C--O 1.209 -1.028 0 C-N-CA 121.088 -0.245 . . . . 0.0 111.497 -176.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.856 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -70.89 -19.45 62.61 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.009 0.433 . . . . 0.0 111.158 -177.444 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 84.6 mt -88.5 -34.09 17.55 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.902 175.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.499 ' HB ' HD21 ' A' ' 86' ' ' LEU . 82.8 p -85.94 -21.04 28.11 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 119.344 -0.942 . . . . 0.0 111.211 -178.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -89.26 127.07 35.74 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.31 -178.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -102.74 109.4 20.98 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 171.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.425 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 4.7 t70 -68.35 165.83 17.88 Favored 'General case' 0 C--N 1.319 -0.728 0 O-C-N 123.454 0.471 . . . . 0.0 110.346 -173.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 31.6 p90 -102.54 -33.6 9.43 Favored 'General case' 0 C--N 1.29 -2.021 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.628 -169.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.36 5.53 17.14 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 119.678 -0.809 . . . . 0.0 111.596 -173.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.425 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 24.7 mt -76.13 80.08 2.95 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.222 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -107.08 -61.83 1.49 Allowed 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 173.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 16.3 mmt -105.65 -17.28 14.45 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 114.08 -1.418 . . . . 0.0 107.847 178.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.19 97.53 6.96 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.195 -1.366 . . . . 0.0 109.958 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 54.1 t -127.67 -73.14 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 179.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -101.74 107.19 18.33 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -160.66 149.06 13.12 Favored Pre-proline 0 C--N 1.308 -1.231 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 -176.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -48.86 -41.16 39.62 Favored 'Trans proline' 0 C--N 1.361 1.19 0 C-N-CA 123.223 2.615 . . . . 0.0 112.454 176.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -73.95 -11.14 60.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.885 0.374 . . . . 0.0 111.533 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -97.11 -15.31 21.02 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.541 179.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -110.32 6.27 22.28 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 121.157 0.503 . . . . 0.0 110.138 178.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.545 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 3.7 pt20 -51.79 -39.76 59.2 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.059 -178.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.484 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 0.8 OUTLIER -66.37 -23.76 66.39 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 114.903 -1.044 . . . . 0.0 113.158 -176.152 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -75.31 -43.34 51.45 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.1 m -62.93 -25.71 68.46 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 123.658 0.599 . . . . 0.0 110.539 179.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 63.9 mt -84.83 -46.99 10.81 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.538 177.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -68.83 -50.63 48.41 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -176.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.506 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.2 t -58.27 -34.29 70.34 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 120.921 0.391 . . . . 0.0 110.169 178.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.421 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 9.7 t30 -76.22 -27.21 56.73 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.294 0.568 . . . . 0.0 111.506 -178.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -82.78 -41.81 18.71 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.796 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.571 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -70.64 -33.59 71.15 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.026 -178.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.421 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 3.4 pt20 -70.23 -14.97 62.85 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -176.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -79.74 -13.12 59.68 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.514 177.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 18.5 t -77.45 163.68 3.75 Favored 'Isoleucine or valine' 0 C--O 1.254 1.338 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 174.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -48.38 142.44 5.66 Favored 'General case' 0 CA--C 1.508 -0.654 0 C-N-CA 123.566 0.746 . . . . 0.0 110.782 176.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -61.17 -29.13 69.61 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -173.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.493 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 12.1 pt20 -80.31 -22.15 41.85 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-O 121.487 0.66 . . . . 0.0 109.96 178.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.493 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.4 m -99.77 -8.32 24.38 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.051 -172.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.5 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 76.1 mt-30 -60.93 -41.62 96.56 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.197 0.522 . . . . 0.0 110.869 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.42 ' HA ' HG12 ' A' ' 75' ' ' ILE . 5.3 p -78.31 -23.79 46.93 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.637 176.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.431 ' HA ' ' HG2' ' A' ' 76' ' ' LYS . 33.5 mm-40 -69.85 -30.79 68.36 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.935 177.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.446 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -62.7 -27.33 69.18 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.83 176.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.571 HD11 HD22 ' A' ' 63' ' ' LEU . 28.3 mm -73.36 -24.61 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.052 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.454 ' NZ ' ' HA ' ' A' ' 17' ' ' ASP . 32.1 mmtp -74.49 -41.94 59.83 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 -176.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.467 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 64.7 mm-40 -56.12 -46.4 79.19 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 111.818 -2.446 . . . . 0.0 110.052 -179.38 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.462 HG22 ' HB3' ' A' ' 29' ' ' LEU . 22.9 t -54.94 -46.05 76.32 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 O-C-N 124.204 0.94 . . . . 0.0 110.152 -179.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 75' ' ' ILE . 26.0 t -67.78 -47.87 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.748 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -175.157 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.76 -45.85 85.33 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.104 -1.407 . . . . 0.0 111.945 -176.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.494 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.7 pt20 -77.29 -35.24 55.25 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 111.448 0.166 . . . . 0.0 111.448 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.409 ' HA ' ' HG2' ' A' ' 85' ' ' GLN . . . -71.07 -38.87 72.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.884 0.373 . . . . 0.0 111.483 -177.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -72.35 -36.74 68.86 Favored 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.059 -178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.452 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -73.19 -32.47 64.84 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.761 -0.375 . . . . 0.0 111.231 -176.971 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.409 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 2.2 pt20 -71.9 -28.96 63.85 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.745 -176.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.502 ' HG ' HG21 ' A' ' 96' ' ' VAL . 4.2 mm? -85.27 -33.79 22.08 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.208 174.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -59.69 -35.73 75.08 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.552 0.741 . . . . 0.0 111.251 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 85' ' ' GLN . 29.6 pt20 -73.14 -11.72 60.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.137 -178.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -92.79 -126.69 4.15 Favored Glycine 0 N--CA 1.427 -1.96 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.016 -177.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -107.56 -22.4 12.54 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 120.929 0.395 . . . . 0.0 110.588 -178.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 165.91 -128.78 1.82 Allowed Glycine 0 N--CA 1.434 -1.446 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -178.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.41 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 91.12 -28.86 7.52 Favored Glycine 0 C--O 1.202 -1.848 0 CA-C-O 119.549 -0.584 . . . . 0.0 112.479 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -52.76 -34.38 52.83 Favored 'General case' 0 C--N 1.312 -1.023 0 C-N-CA 123.97 0.908 . . . . 0.0 111.714 -176.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.417 ' HG3' ' N ' ' A' ' 95' ' ' GLN . 8.7 pt20 -75.57 -37.2 60.09 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.579 -179.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.569 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 13.1 pt20 -82.59 -45.71 14.24 Favored 'General case' 0 CA--C 1.498 -1.047 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.033 -177.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.502 HG21 ' HG ' ' A' ' 86' ' ' LEU . 96.0 t -57.66 -23.2 19.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 124.376 1.07 . . . . 0.0 110.725 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.482 ' HA ' HG12 ' A' ' 100' ' ' VAL . 53.0 tt0 -50.73 -40.36 54.18 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.803 0.441 . . . . 0.0 111.78 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 11.2 pt20 -68.76 -18.36 64.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.633 -176.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.453 ' O ' HD22 ' A' ' 36' ' ' LEU . 8.1 tpt -102.44 -48.55 4.12 Favored 'General case' 0 CA--C 1.485 -1.546 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -177.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.482 HG12 ' HA ' ' A' ' 97' ' ' GLN . 14.3 p -60.37 -24.27 30.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.095 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.747 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.81 -24.86 64.5 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.851 -0.531 . . . . 0.0 111.688 174.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -64.46 -30.39 71.43 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 120.773 0.321 . . . . 0.0 110.188 177.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.506 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -62.8 -28.79 70.24 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-O 121.418 0.628 . . . . 0.0 109.989 177.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -73.58 -18.6 61.04 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.163 -178.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 42.3 mtt -92.11 -18.28 23.78 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.808 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' A' ' 103' ' ' ALA . 0.9 OUTLIER -48.18 -48.28 64.74 Favored Pre-proline 0 N--CA 1.471 0.619 0 C-N-CA 123.884 0.873 . . . . 0.0 113.121 -178.326 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.491 ' HG2' HG12 ' A' ' 116' ' ' ILE . 22.5 Cg_exo -61.35 -26.09 81.08 Favored 'Trans proline' 0 C--N 1.359 1.104 0 C-N-CA 121.533 1.488 . . . . 0.0 113.355 178.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -89.17 -37.44 15.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.812 177.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -74.68 -34.17 62.61 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 12.8 t -93.75 -2.7 53.38 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 64.1 t30 57.27 63.64 1.83 Allowed 'General case' 0 C--O 1.244 0.785 0 CA-C-O 123.01 1.386 . . . . 0.0 110.885 -179.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.7 mt -100.36 157.88 16.3 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 113.039 -1.891 . . . . 0.0 109.401 178.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -78.22 31.25 0.18 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.747 1.219 . . . . 0.0 112.944 -173.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.442 ' HA ' HD11 ' A' ' 16' ' ' LEU . 91.8 m -150.3 167.84 25.81 Favored 'General case' 0 C--N 1.269 -2.923 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -174.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 69.6 m -150.79 133.72 15.93 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 175.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.491 HG12 ' HG2' ' A' ' 107' ' ' PRO . 46.1 mm . . . . . 0 C--O 1.263 1.764 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -177.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.901 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.0 mmm180 -76.68 141.46 40.93 Favored 'General case' 0 CA--C 1.494 -1.193 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.9 m -137.33 150.87 48.05 Favored 'General case' 0 C--N 1.276 -2.61 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 65.6 p -69.27 155.4 40.48 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.291 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -87.75 73.61 9.27 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 175.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.2 t -150.04 167.23 27.36 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.9 mm -128.49 118.79 20.25 Favored Pre-proline 0 C--N 1.306 -1.311 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.76 147.63 89.91 Favored 'Cis proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.763 -1.349 . . . . 0.0 111.876 -1.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.28 136.08 25.94 Favored 'Trans proline' 0 C--O 1.247 0.94 0 C-N-CA 122.184 1.923 . . . . 0.0 112.063 -178.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 36.8 mm -96.15 124.01 48.65 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 178.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.1 m -109.82 141.21 42.81 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-O 121.579 0.704 . . . . 0.0 112.06 -175.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -107.15 158.47 32.93 Favored Pre-proline 0 C--N 1.298 -1.659 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.019 -177.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -82.81 54.5 4.86 Favored 'Trans proline' 0 C--O 1.248 1.007 0 C-N-CA 122.857 2.372 . . . . 0.0 109.253 174.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -143.39 153.56 42.82 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 114.071 -1.422 . . . . 0.0 107.291 -176.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 118.09 -82.68 0.33 Allowed Glycine 0 CA--C 1.468 -2.88 0 N-CA-C 107.931 -2.067 . . . . 0.0 107.931 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.0 pp -175.4 146.24 0.79 Allowed 'General case' 0 N--CA 1.423 -1.794 0 CA-C-N 114.822 -0.689 . . . . 0.0 109.35 175.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.603 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 5.6 p-10 -135.02 16.89 3.49 Favored 'General case' 0 C--N 1.281 -2.383 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 170.044 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.584 ' ND2' ' HA2' ' A' ' 21' ' ' GLY . 54.4 t30 -99.33 91.23 1.36 Allowed Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 113.645 -1.616 . . . . 0.0 107.012 176.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.609 ' HD2' ' OE1' ' A' ' 73' ' ' GLU . 33.5 Cg_exo -58.17 -54.8 2.73 Favored 'Trans proline' 0 C--N 1.357 1.005 0 C-N-CA 123.89 3.06 . . . . 0.0 115.016 -171.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.483 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 5.4 mpt_? -85.8 -48.29 8.93 Favored 'General case' 0 CA--C 1.47 -2.114 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 -177.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.584 ' HA2' ' ND2' ' A' ' 18' ' ' ASN . . . 99.05 42.58 2.78 Favored Glycine 0 CA--C 1.458 -3.485 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -174.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 57.6 m -73.15 140.15 46.86 Favored 'General case' 0 N--CA 1.405 -2.68 0 CA-C-N 114.201 -1.0 . . . . 0.0 110.116 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -99.84 124.48 45.18 Favored 'General case' 0 N--CA 1.415 -2.193 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 173.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.429 HD11 ' HB2' ' A' ' 73' ' ' GLU . 4.1 mp -119.93 145.47 26.15 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -176.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.496 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 35.1 ptt180 -66.14 120.68 13.63 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-O 121.599 0.714 . . . . 0.0 110.06 -178.231 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.47 -14.99 19.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 121.261 0.553 . . . . 0.0 111.97 -175.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -75.53 -20.84 58.43 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.54 -177.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 6.8 pt20 -85.41 -34.95 21.59 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 119.334 -0.946 . . . . 0.0 109.828 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.423 HD11 ' HB1' ' A' ' 74' ' ' ALA . 2.0 mm? -79.54 -7.81 58.74 Favored 'General case' 0 CA--C 1.475 -1.921 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.21 -177.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.578 ' HA ' HE21 ' A' ' 33' ' ' GLN . 55.6 t30 -54.08 -33.82 58.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 124.246 0.966 . . . . 0.0 110.192 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -69.52 -57.63 4.98 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.449 ' HB3' HG11 ' A' ' 78' ' ' VAL . 0.7 OUTLIER -56.1 -47.5 77.95 Favored 'General case' 0 C--O 1.215 -0.718 0 O-C-N 123.909 0.756 . . . . 0.0 110.392 179.738 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.578 HE21 ' HA ' ' A' ' 30' ' ' ASN . 6.8 tt0 -52.76 -57.95 8.45 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 124.316 1.046 . . . . 0.0 111.842 176.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -67.41 -38.24 84.33 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 120.204 -0.598 . . . . 0.0 111.818 -175.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 -74.0 -28.74 61.6 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 93.3 mt -78.53 -24.33 45.76 Favored 'General case' 0 C--N 1.313 -0.982 0 C-N-CA 120.176 -0.609 . . . . 0.0 110.757 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.509 ' HB ' HD21 ' A' ' 86' ' ' LEU . 73.6 p -89.87 -12.77 38.04 Favored 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 118.734 -1.186 . . . . 0.0 111.25 176.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 40.6 t -88.71 144.9 25.96 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.403 178.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -120.59 129.23 53.67 Favored 'General case' 0 N--CA 1.438 -1.041 0 CA-C-O 121.247 0.546 . . . . 0.0 111.206 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.406 ' OD2' HD11 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -70.89 107.41 4.02 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 122.669 1.224 . . . . 0.0 112.885 178.946 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -105.16 -15.67 15.0 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 112.538 -2.119 . . . . 0.0 109.508 -177.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.81 13.76 3.66 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.581 -178.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.586 ' HB3' ' O ' ' A' ' 46' ' ' ALA . 90.6 mt -66.88 105.99 1.76 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.904 177.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -98.96 -68.27 0.81 Allowed 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.362 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 88.8 mtp -109.31 5.77 23.91 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.462 0.649 . . . . 0.0 110.068 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.586 ' O ' ' HB3' ' A' ' 43' ' ' LEU . . . -109.35 131.91 54.62 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.461 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 43.6 t -106.36 -51.0 8.0 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.994 0 N-CA-C 104.981 -2.229 . . . . 0.0 104.981 171.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -131.93 139.35 48.68 Favored 'General case' 0 N--CA 1.432 -1.352 0 N-CA-C 104.939 -2.245 . . . . 0.0 104.939 172.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.455 ' HB3' ' HG2' ' A' ' 52' ' ' GLN . 26.6 t-20 -158.97 143.54 11.47 Favored Pre-proline 0 C--N 1.303 -1.421 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -176.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -49.46 -38.13 43.14 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 123.835 3.023 . . . . 0.0 113.248 178.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -72.18 -12.11 61.03 Favored 'General case' 0 CA--C 1.505 -0.774 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -177.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.455 ' HG2' ' HB3' ' A' ' 49' ' ' ASN . 79.4 mm-40 -81.91 -24.55 35.58 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -94.09 14.27 20.46 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.489 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.557 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 3.7 pt20 -52.5 -38.41 59.47 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.464 0.706 . . . . 0.0 110.17 177.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.406 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 0.8 OUTLIER -56.46 -29.59 61.87 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-N 114.702 -1.136 . . . . 0.0 112.523 -178.842 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -82.5 -42.36 18.54 Favored 'General case' 0 CA--C 1.49 -1.357 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.3 m -60.42 -31.09 70.07 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.399 0.619 . . . . 0.0 109.93 178.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 44.9 mt -81.8 -53.13 6.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.116 177.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 25.3 t -59.13 -49.72 76.78 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 123.443 0.697 . . . . 0.0 111.731 -177.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.529 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.0 t -58.55 -35.56 72.52 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.45 0.643 . . . . 0.0 110.419 179.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -82.05 -23.69 35.71 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.874 0.845 . . . . 0.0 110.762 -176.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.401 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 64.6 tt0 -86.84 -38.63 16.62 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.7 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.562 HD22 HD11 ' A' ' 75' ' ' ILE . 4.1 pp -68.76 -32.33 72.01 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.11 0.481 . . . . 0.0 109.865 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.464 ' HA ' ' CD ' ' A' ' 71' ' ' GLN . 14.6 pt20 -68.61 -10.32 55.28 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.903 -178.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.42 -15.49 59.31 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-O 121.516 0.674 . . . . 0.0 109.223 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.6 t -86.49 163.37 2.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 174.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.512 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 40.6 mt-10 -49.38 143.05 6.88 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 122.938 0.495 . . . . 0.0 110.675 175.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -59.8 -32.46 70.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -175.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.514 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 27.8 pt20 -72.89 -24.01 60.79 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.612 0.72 . . . . 0.0 109.972 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.514 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.0 m -100.22 -9.14 22.75 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.047 -174.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.512 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 28.0 mt-30 -61.5 -39.17 90.0 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.894 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.415 ' HA ' HG12 ' A' ' 75' ' ' ILE . 11.0 p -83.55 -23.99 31.79 Favored 'General case' 0 CA--C 1.502 -0.874 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.692 177.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.609 ' OE1' ' HD2' ' A' ' 19' ' ' PRO . 7.0 mm-40 -66.03 -34.36 77.91 Favored 'General case' 0 C--O 1.248 1.024 0 CA-C-O 122.073 0.939 . . . . 0.0 108.763 178.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.423 ' HB1' HD11 ' A' ' 29' ' ' LEU . . . -61.21 -31.52 71.29 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.7 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.562 HD11 HD22 ' A' ' 63' ' ' LEU . 31.0 mm -69.62 -33.62 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.638 -176.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.541 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 30.7 mmtp -67.88 -41.15 83.22 Favored 'General case' 0 CA--C 1.487 -1.445 0 CA-C-N 115.234 -0.894 . . . . 0.0 108.871 -178.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 6.6 mt-30 -61.05 -36.37 79.41 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.161 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.449 HG11 ' HB3' ' A' ' 32' ' ' CYS . 23.6 t -57.8 -46.57 87.08 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.702 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 178.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 45.1 t -62.51 -45.49 98.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.359 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.541 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 35.6 mt-10 -57.87 -52.23 66.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.236 -177.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 3.5 pt20 -75.06 -31.95 61.4 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.102 -175.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.16 -37.34 58.07 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -177.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.43 HE21 ' HA ' ' A' ' 80' ' ' GLU . 29.0 pt20 -73.85 -32.86 63.86 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.575 -177.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.95 -32.28 59.45 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.578 -175.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -71.83 -27.49 62.94 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.246 0.546 . . . . 0.0 110.261 -178.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.509 HD21 ' HB ' ' A' ' 37' ' ' THR . 3.8 mm? -83.94 -35.11 24.26 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.988 174.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.536 ' HA ' HE21 ' A' ' 93' ' ' GLN . 29.6 tt0 -60.59 -33.5 72.83 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 123.515 0.726 . . . . 0.0 111.647 178.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -86.8 -1.55 57.86 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.258 0.551 . . . . 0.0 111.329 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -95.86 -144.83 17.72 Favored Glycine 0 N--CA 1.419 -2.434 0 CA-C-O 121.753 0.641 . . . . 0.0 113.023 -177.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -100.23 -41.28 7.16 Favored 'General case' 0 C--N 1.279 -2.458 0 CA-C-N 114.84 -0.68 . . . . 0.0 111.045 -174.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 179.69 -176.84 47.86 Favored Glycine 0 N--CA 1.418 -2.547 0 N-CA-C 108.919 -1.672 . . . . 0.0 108.919 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.481 ' HA2' ' HG2' ' A' ' 95' ' ' GLN . . . 119.66 -25.14 7.75 Favored Glycine 0 N--CA 1.408 -3.205 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.27 -177.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.536 HE21 ' HA ' ' A' ' 87' ' ' GLN . 19.4 mp0 -47.35 -40.3 17.02 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.931 0.892 . . . . 0.0 112.092 -178.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -77.11 -37.31 54.48 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.583 -176.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.663 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 4.1 pt20 -80.66 -43.52 20.29 Favored 'General case' 0 C--O 1.209 -1.065 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.147 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.428 HG21 ' HG ' ' A' ' 86' ' ' LEU . 69.0 t -61.06 -23.51 30.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 C-N-CA 124.594 1.158 . . . . 0.0 110.541 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -54.57 -37.62 65.69 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.873 -179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.663 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 30.0 pt20 -71.8 -18.35 62.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.866 0.365 . . . . 0.0 111.143 -178.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.2 tpt -96.78 -47.26 5.94 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 -176.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -62.45 -27.75 43.37 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.319 178.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.1 pptp? -63.85 -21.2 66.33 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.912 -0.492 . . . . 0.0 111.286 176.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -65.36 -28.82 69.55 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.383 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.43 -30.92 69.94 Favored 'General case' 0 C--O 1.207 -1.135 0 CA-C-O 121.186 0.517 . . . . 0.0 110.313 178.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.445 ' O ' ' HB ' ' A' ' 116' ' ' ILE . 38.6 mt-30 -68.83 -19.31 64.26 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.253 0.549 . . . . 0.0 109.887 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 49.4 mtp -91.97 -19.94 21.89 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 7.0 mp -53.55 -47.5 96.2 Favored Pre-proline 0 C--N 1.325 -0.46 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.59 -22.32 73.86 Favored 'Trans proline' 0 C--N 1.362 1.243 0 CA-C-N 120.74 1.3 . . . . 0.0 112.658 176.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -85.09 -49.5 8.21 Favored 'General case' 0 N--CA 1.411 -2.399 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -73.46 -38.92 65.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.275 -0.875 . . . . 0.0 112.062 -175.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.451 ' SG ' HD21 ' A' ' 112' ' ' LEU . 34.0 t -82.82 -0.83 49.78 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 63.12 40.71 8.75 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.886 1.274 . . . . 0.0 110.477 173.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.451 HD21 ' SG ' ' A' ' 110' ' ' CYS . 48.8 mt -80.97 159.55 24.87 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.314 -177.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -69.36 41.55 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 C-N-CA 125.062 1.345 . . . . 0.0 112.657 -176.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 56.7 m -158.06 146.13 18.67 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -176.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 40.1 m -134.03 119.25 18.74 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-O 121.062 0.458 . . . . 0.0 110.063 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.445 ' HB ' ' O ' ' A' ' 104' ' ' GLN . 67.1 mt . . . . . 0 C--N 1.304 -1.404 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.11 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 44.3 mtp180 -95.96 131.95 41.79 Favored 'General case' 0 CA--C 1.492 -1.262 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 74.3 m -134.15 146.36 50.13 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 175.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 82.6 p -75.87 160.85 29.51 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 121.087 0.47 . . . . 0.0 110.357 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -91.29 66.33 5.56 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.8 t -152.44 172.35 16.65 Favored 'General case' 0 N--CA 1.421 -1.901 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -177.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.8 mm -128.35 118.29 20.31 Favored Pre-proline 0 C--N 1.313 -1.009 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 177.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.62 146.41 86.51 Favored 'Cis proline' 0 C--O 1.244 0.796 0 C-N-CA 123.817 -1.326 . . . . 0.0 111.608 0.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -68.45 126.82 14.71 Favored 'Trans proline' 0 N--CA 1.446 -1.304 0 C-N-CA 121.799 1.666 . . . . 0.0 110.126 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.4 mm -89.58 112.37 24.35 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.187 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -178.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 63.2 m -104.46 136.71 43.53 Favored 'General case' 0 C--N 1.287 -2.147 0 CA-C-O 121.581 0.705 . . . . 0.0 110.82 -176.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.434 ' C ' ' H ' ' A' ' 14' ' ' ASP . 71.5 m-85 -93.16 159.13 36.08 Favored Pre-proline 0 C--N 1.287 -2.126 0 CA-C-N 114.401 -1.272 . . . . 0.0 110.321 -178.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -73.65 36.49 0.39 Allowed 'Trans proline' 0 N--CA 1.486 1.038 0 C-N-CA 123.555 2.837 . . . . 0.0 112.057 178.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.434 ' H ' ' C ' ' A' ' 12' ' ' PHE . 14.8 t70 -90.59 130.46 36.61 Favored 'General case' 0 N--CA 1.424 -1.767 0 C-N-CA 125.275 1.43 . . . . 0.0 110.015 -176.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 167.14 -53.11 0.24 Allowed Glycine 0 C--N 1.281 -2.489 0 N-CA-C 110.324 -1.111 . . . . 0.0 110.324 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -170.75 -60.39 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 179.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -156.45 155.86 32.79 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -161.25 87.03 1.66 Allowed Pre-proline 0 C--N 1.303 -1.413 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 -173.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -65.99 -31.81 45.84 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 123.62 2.88 . . . . 0.0 116.572 -171.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.536 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 2.5 mpt_? -83.82 -34.03 24.77 Favored 'General case' 0 CA--C 1.473 -1.997 0 C-N-CA 119.172 -1.011 . . . . 0.0 109.802 -175.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -94.97 24.63 27.69 Favored Glycine 0 C--N 1.277 -2.712 0 CA-C-N 114.098 -1.41 . . . . 0.0 113.21 -178.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.1 m -60.92 124.58 20.9 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 123.827 0.369 . . . . 0.0 111.273 174.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -106.73 116.82 32.58 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 121.867 0.842 . . . . 0.0 109.727 177.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.428 HG21 ' HB2' ' A' ' 74' ' ' ALA . 3.4 mp -120.49 132.58 69.71 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 -177.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.541 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 21.7 ptt180 -67.49 117.06 8.94 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 121.148 0.499 . . . . 0.0 111.484 -177.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.566 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.7 pp -61.98 -14.37 11.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -177.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -79.24 -17.33 54.97 Favored 'General case' 0 N--CA 1.423 -1.8 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.257 -178.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.0 pt20 -79.98 -23.57 41.5 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.507 ' HB2' ' OE1' ' A' ' 81' ' ' GLN . 2.5 mm? -93.73 4.46 53.9 Favored 'General case' 0 CA--C 1.489 -1.381 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.048 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -55.02 -31.95 61.45 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 123.624 0.577 . . . . 0.0 111.595 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.424 ' O ' ' HB3' ' A' ' 35' ' ' HIS . 5.1 t60 -71.67 -53.11 14.63 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 107.84 -1.171 . . . . 0.0 107.84 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.51 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -55.86 -50.29 71.02 Favored 'General case' 0 C--N 1.314 -0.97 0 O-C-N 124.357 1.036 . . . . 0.0 109.188 -177.988 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -49.92 -58.26 5.79 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 125.148 1.379 . . . . 0.0 111.83 174.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.2 ptm -66.8 -37.88 85.41 Favored 'General case' 0 C--O 1.192 -1.972 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.03 -177.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.424 ' HB3' ' O ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -58.66 -33.87 70.58 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 123.555 0.742 . . . . 0.0 111.246 179.0 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 89.4 mt -81.48 -41.27 22.0 Favored 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.147 178.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.445 ' HA ' HG13 ' A' ' 96' ' ' VAL . 45.8 p -85.24 -21.33 29.13 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.108 -175.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.6 t -90.76 121.23 32.47 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.214 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -98.67 98.92 10.01 Favored 'General case' 0 C--N 1.282 -2.355 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 170.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.434 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 6.7 t70 -73.18 174.59 7.77 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.931 -1.032 . . . . 0.0 109.516 -176.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 28.2 p90 -95.31 -36.52 11.37 Favored 'General case' 0 C--N 1.282 -2.351 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -167.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.4 -0.27 32.15 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-O 121.621 0.724 . . . . 0.0 110.952 -175.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.434 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 47.3 mt -77.55 2.44 16.41 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.419 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.8 ptt180 -62.14 -13.95 32.25 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 124.375 1.07 . . . . 0.0 111.823 178.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 22.1 ptp -151.7 11.68 0.59 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.476 ' HA ' ' OD1' ' A' ' 49' ' ' ASN . . . -139.82 91.75 2.5 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.783 -170.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 45.2 t -130.11 -65.1 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.04 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 177.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -98.84 69.56 1.81 Allowed 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.774 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.476 ' OD1' ' HA ' ' A' ' 46' ' ' ALA . 11.2 m120 -130.37 150.48 76.34 Favored Pre-proline 0 C--N 1.303 -1.454 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -49.78 -50.77 12.29 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 123.453 2.769 . . . . 0.0 114.312 -176.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -80.02 -8.54 59.42 Favored 'General case' 0 CA--C 1.5 -0.947 0 C-N-CA 120.44 -0.504 . . . . 0.0 112.05 -176.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.422 ' HG2' ' HB2' ' A' ' 49' ' ' ASN . 86.5 mm-40 -84.94 -24.87 28.19 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 176.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -69.45 -4.69 19.7 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.252 -179.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.632 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 11.1 pt20 -49.89 -41.18 45.11 Favored 'General case' 0 C--O 1.199 -1.558 0 C-N-CA 123.942 0.897 . . . . 0.0 110.844 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.429 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 0.7 OUTLIER -61.17 -30.19 70.25 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.405 0.621 . . . . 0.0 112.431 -177.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -86.21 -40.11 15.92 Favored 'General case' 0 CA--C 1.496 -1.111 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 -179.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 t -59.27 -24.0 62.86 Favored 'General case' 0 C--O 1.209 -1.054 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.693 176.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.632 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 88.6 mt -87.63 -56.04 3.52 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.769 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 27.4 t -57.88 -51.75 68.32 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.471 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 11.0 t -59.31 -33.42 71.08 Favored 'General case' 0 N--CA 1.428 -1.542 0 C-N-CA 124.197 0.999 . . . . 0.0 110.748 178.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 2.8 t-20 -81.25 -23.19 38.18 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.129 -176.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 21.2 tp60 -80.06 -46.38 16.65 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.28 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.56 ' O ' ' HG2' ' A' ' 71' ' ' GLN . 3.6 pp -69.14 -35.44 76.37 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.291 -175.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.478 ' NE2' HD22 ' A' ' 61' ' ' ASN . 11.1 pt20 -68.88 -17.38 63.97 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 122.991 0.516 . . . . 0.0 111.735 -175.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 63.6 mm-40 -83.61 -13.31 54.61 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 121.377 0.608 . . . . 0.0 109.713 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.3 t -79.63 162.68 3.77 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -50.52 141.59 12.06 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 123.492 0.717 . . . . 0.0 110.98 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.418 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 18.8 ptpt -57.83 -31.77 66.96 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -174.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.447 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 4.1 pt20 -82.11 -12.71 58.05 Favored 'General case' 0 C--N 1.31 -1.147 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.26 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.447 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 42.7 m -110.75 -12.6 14.28 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.584 -174.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.56 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 67.4 mt-30 -56.28 -46.47 79.73 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.434 0.694 . . . . 0.0 110.796 176.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.412 ' HA ' HG12 ' A' ' 75' ' ' ILE . 7.0 p -75.09 -23.86 58.05 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.324 0.583 . . . . 0.0 111.468 178.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 64.7 mm-40 -73.98 -29.52 62.02 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.402 0.62 . . . . 0.0 110.287 177.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.432 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -64.24 -23.13 67.2 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.586 176.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.533 HD11 HD22 ' A' ' 63' ' ' LEU . 35.2 mm -72.87 -27.75 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.362 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -73.03 -41.0 64.67 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 -175.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.47 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 12.1 mm100 -56.6 -47.95 78.49 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 111.676 -2.511 . . . . 0.0 110.133 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.462 HG22 ' HB3' ' A' ' 29' ' ' LEU . 20.0 t -56.23 -44.59 79.8 Favored 'Isoleucine or valine' 0 C--N 1.352 0.707 0 O-C-N 124.03 0.832 . . . . 0.0 109.771 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 75' ' ' ILE . 31.0 t -68.09 -42.34 85.01 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.686 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -174.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -61.95 -53.0 61.7 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.597 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.566 ' NE2' ' HB ' ' A' ' 26' ' ' ILE . 4.7 pt20 -71.55 -31.05 66.58 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.791 0.329 . . . . 0.0 111.852 -176.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -73.2 -40.97 64.32 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 120.881 -0.327 . . . . 0.0 110.954 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -70.55 -41.38 72.56 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.154 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.486 ' HD2' ' N ' ' A' ' 85' ' ' GLN . 0.0 OUTLIER -65.33 -35.99 82.67 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.299 -176.168 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.486 ' N ' ' HD2' ' A' ' 84' ' ' LYS . 17.4 pt20 -71.94 -33.6 68.35 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.604 -174.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.505 HD12 ' HA3' ' A' ' 92' ' ' GLY . 2.7 mm? -84.46 -39.29 19.1 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.391 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -57.48 -41.28 80.37 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 123.804 0.842 . . . . 0.0 111.06 -179.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 84' ' ' LYS . 4.2 pt20 -90.98 -8.67 48.55 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.322 0.582 . . . . 0.0 110.737 -178.081 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -89.9 -78.88 1.34 Allowed Glycine 0 N--CA 1.426 -1.996 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.846 -176.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -132.76 -12.54 2.96 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.74 -106.79 1.42 Allowed Glycine 0 C--N 1.285 -2.254 0 N-CA-C 106.865 -2.494 . . . . 0.0 106.865 -173.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.505 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 77.26 -37.29 1.55 Allowed Glycine 0 C--O 1.185 -2.908 0 CA-C-O 119.039 -0.867 . . . . 0.0 115.04 172.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.427 ' O ' ' HB2' ' A' ' 97' ' ' GLN . 14.0 mm100 -52.29 -21.06 3.12 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -175.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -79.2 -39.72 32.56 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.084 0.469 . . . . 0.0 110.877 174.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -86.0 -38.95 17.37 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 121.625 0.726 . . . . 0.0 110.217 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.445 HG13 ' HA ' ' A' ' 37' ' ' THR . 72.2 t -69.71 -22.52 25.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.207 0 C-N-CA 125.631 1.572 . . . . 0.0 110.633 176.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.427 ' HB2' ' O ' ' A' ' 93' ' ' GLN . 53.6 tt0 -45.91 -44.75 14.89 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -59.87 -28.13 67.27 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 123.069 0.548 . . . . 0.0 112.04 178.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.415 ' O ' HD22 ' A' ' 36' ' ' LEU . 5.2 tpt -96.59 -48.08 5.67 Favored 'General case' 0 CA--C 1.494 -1.206 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -174.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.2 p -60.38 -27.98 41.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.603 179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -25.16 68.18 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.958 -0.464 . . . . 0.0 111.265 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -64.54 -25.58 68.04 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 122.661 0.384 . . . . 0.0 110.855 177.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.443 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -60.36 -36.26 77.59 Favored 'General case' 0 C--O 1.208 -1.091 0 CA-C-O 121.495 0.664 . . . . 0.0 110.032 176.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -73.24 -16.51 61.4 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.74 0.781 . . . . 0.0 110.297 -177.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 54.3 mtp -92.67 -15.85 26.27 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.978 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.45 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 92.6 mt -55.1 -47.07 99.4 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.927 -177.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.471 ' HD3' HG21 ' A' ' 75' ' ' ILE . 12.3 Cg_endo -58.78 -22.28 60.95 Favored 'Trans proline' 0 C--N 1.366 1.497 0 C-N-CA 121.759 1.639 . . . . 0.0 113.127 175.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -84.82 -47.83 9.98 Favored 'General case' 0 N--CA 1.41 -2.461 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -68.49 -47.41 67.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.1 -176.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 97.8 m -81.3 2.05 29.83 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 47.9 t30 53.58 64.48 1.83 Allowed 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 122.97 1.367 . . . . 0.0 110.697 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.422 HD21 HD11 ' A' ' 63' ' ' LEU . 62.9 mt -98.59 158.19 15.76 Favored 'General case' 0 C--N 1.275 -2.673 0 CA-C-N 113.396 -1.729 . . . . 0.0 108.659 -178.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -81.08 45.1 0.81 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.814 0.816 . . . . 0.0 111.068 -175.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 57.2 m -160.88 155.3 23.3 Favored 'General case' 0 C--N 1.285 -2.226 0 C-N-CA 125.722 1.609 . . . . 0.0 106.712 -176.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 41.5 m -150.32 136.76 18.88 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 38.0 mm . . . . . 0 C--N 1.309 -1.158 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -179.001 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.488 -1.63 0 N-CA-C 110.705 -0.958 . . . . 0.0 110.705 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.7 mmm180 -94.63 139.87 30.63 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 -178.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 58.1 m -116.47 150.75 37.35 Favored 'General case' 0 C--N 1.277 -2.582 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.607 -176.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.6 p -82.53 166.1 19.57 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.781 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -90.55 76.98 6.51 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 175.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.1 t -152.67 163.95 38.67 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.1 mm -128.79 115.91 19.26 Favored Pre-proline 0 C--N 1.305 -1.334 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 176.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.59 147.18 88.98 Favored 'Cis proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.869 -1.305 . . . . 0.0 111.692 -1.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.85 140.16 45.46 Favored 'Trans proline' 0 C--O 1.247 0.959 0 C-N-CA 122.661 2.241 . . . . 0.0 111.789 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 40.3 mm -95.32 116.99 38.22 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 65.8 m -104.85 131.3 52.5 Favored 'General case' 0 C--N 1.284 -2.281 0 CA-C-O 121.462 0.649 . . . . 0.0 110.893 -177.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -98.53 142.03 23.92 Favored Pre-proline 0 N--CA 1.426 -1.666 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.477 -178.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.9 -17.51 36.87 Favored 'Trans proline' 0 C--O 1.242 0.708 0 C-N-CA 123.359 2.706 . . . . 0.0 114.79 -175.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -158.36 162.25 37.64 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 -177.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.39 66.06 0.59 Allowed Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 121.569 -0.348 . . . . 0.0 113.026 176.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.407 HD12 ' N ' ' A' ' 17' ' ' ASP . 1.8 pp -99.69 -16.61 18.11 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 121.723 0.773 . . . . 0.0 110.83 177.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.407 ' N ' HD12 ' A' ' 16' ' ' LEU . 27.4 t70 -100.99 103.74 14.89 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.807 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -124.4 104.33 31.63 Favored Pre-proline 0 C--N 1.292 -1.906 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -178.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.493 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . 53.1 Cg_exo -56.56 -41.02 80.37 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 123.034 2.49 . . . . 0.0 112.342 -178.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.493 ' HD2' ' HB2' ' A' ' 19' ' ' PRO . 2.1 mpt_? -123.04 -49.32 1.96 Allowed 'General case' 0 CA--C 1.496 -1.112 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 175.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 90.29 48.95 3.38 Favored Glycine 0 CA--C 1.468 -2.901 0 N-CA-C 109.013 -1.635 . . . . 0.0 109.013 -176.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 86.3 m -75.98 138.87 41.22 Favored 'General case' 0 C--N 1.279 -2.468 0 CA-C-N 114.159 -1.02 . . . . 0.0 110.088 179.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -101.83 102.95 13.62 Favored 'General case' 0 N--CA 1.423 -1.81 0 CA-C-O 122.269 1.033 . . . . 0.0 109.2 174.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.516 HD11 ' HB2' ' A' ' 73' ' ' GLU . 3.1 mp -102.08 144.16 13.75 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.568 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 -178.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.443 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 17.8 ptt180 -70.58 115.28 9.57 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.161 0.505 . . . . 0.0 110.736 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.415 ' HB ' ' NE2' ' A' ' 81' ' ' GLN . 2.6 pp -65.64 -10.9 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.417 ' HG2' ' HB2' ' A' ' 25' ' ' ARG . 4.1 pt20 -78.08 -21.02 51.16 Favored 'General case' 0 N--CA 1.427 -1.609 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.098 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.447 ' HG3' HD22 ' A' ' 29' ' ' LEU . 1.0 OUTLIER -82.06 -26.54 33.63 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 119.492 -0.883 . . . . 0.0 108.813 -179.98 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.491 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.4 mm? -86.58 -1.7 57.87 Favored 'General case' 0 CA--C 1.487 -1.474 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.152 -178.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.573 ' O ' ' HG2' ' A' ' 34' ' ' MET . 8.2 t30 -51.65 -32.65 30.19 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 124.265 0.978 . . . . 0.0 111.692 179.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -70.31 -56.42 6.78 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.452 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER -53.84 -53.28 54.67 Favored 'General case' 0 CA--C 1.507 -0.709 0 O-C-N 123.918 0.761 . . . . 0.0 110.052 178.717 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -47.88 -56.14 8.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.201 1.001 . . . . 0.0 112.283 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.573 ' HG2' ' O ' ' A' ' 30' ' ' ASN . 14.3 ptp -70.66 -44.11 67.78 Favored 'General case' 0 C--O 1.202 -1.402 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.261 -176.11 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -68.28 -22.88 64.71 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -178.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 32' ' ' CYS . 89.0 mt -81.7 -34.24 30.74 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.663 174.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.473 ' HA ' HG13 ' A' ' 96' ' ' VAL . 62.0 p -84.2 -22.16 31.0 Favored 'General case' 0 C--O 1.246 0.898 0 C-N-CA 117.84 -1.544 . . . . 0.0 112.212 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.6 p -90.69 145.95 24.41 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-O 121.735 0.779 . . . . 0.0 112.559 -178.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -122.12 124.49 44.02 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 104.645 -2.354 . . . . 0.0 104.645 169.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.484 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 6.9 t0 -78.46 160.54 27.65 Favored 'General case' 0 N--CA 1.426 -1.667 0 C-N-CA 119.393 -0.923 . . . . 0.0 108.912 -174.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -95.08 -31.79 13.41 Favored 'General case' 0 C--N 1.27 -2.872 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.772 -167.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.5 6.35 38.22 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 118.911 -1.116 . . . . 0.0 111.462 -175.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.484 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 56.2 mt -72.23 84.9 1.05 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.408 177.206 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 82.5 mtp180 -119.7 -22.53 6.84 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 121.22 0.533 . . . . 0.0 109.683 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.4 mmm -117.23 15.68 14.89 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.5 ' HA ' ' CG ' ' A' ' 49' ' ' ASN . . . -137.27 28.03 2.82 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.523 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 59.5 t -56.24 -46.34 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 O-C-N 123.934 0.771 . . . . 0.0 109.029 -178.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -133.39 102.08 5.4 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 169.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.5 ' CG ' ' HA ' ' A' ' 46' ' ' ALA . 0.7 OUTLIER -139.39 151.83 67.83 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.101 -175.746 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.529 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 58.5 Cg_endo -69.6 -15.44 37.69 Favored 'Trans proline' 0 N--CA 1.476 0.487 0 C-N-CA 122.891 2.394 . . . . 0.0 111.019 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 41.8 mtmt -68.49 -15.76 63.65 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.162 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -66.01 -25.74 67.21 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 50' ' ' PRO . 11.3 pt20 -80.45 8.8 6.92 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 120.466 -0.494 . . . . 0.0 111.556 -178.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.505 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 25.5 pt20 -51.15 -46.1 61.9 Favored 'General case' 0 C--O 1.245 0.818 0 C-N-CA 124.34 1.056 . . . . 0.0 111.273 178.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.46 ' N ' ' HG3' ' A' ' 54' ' ' GLN . 1.6 p-80 -72.3 -21.64 61.31 Favored 'General case' 0 N--CA 1.426 -1.627 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.561 -176.031 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -80.22 -42.69 22.79 Favored 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.3 m -59.82 -27.23 66.43 Favored 'General case' 0 C--N 1.317 -0.846 0 O-C-N 123.732 0.645 . . . . 0.0 110.718 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 47.0 mt -88.15 -51.17 5.93 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.775 176.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.7 t -59.72 -48.14 82.85 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.429 0.692 . . . . 0.0 111.895 -177.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.512 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 42.1 t -57.86 -35.94 71.65 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.269 0.557 . . . . 0.0 110.091 178.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.552 ' HA ' ' OE1' ' A' ' 64' ' ' GLN . 4.1 t-20 -76.56 -25.67 54.29 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.16 -176.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -85.57 -44.9 12.26 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.954 178.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.566 HD22 HD11 ' A' ' 75' ' ' ILE . 3.7 pp -66.26 -31.9 73.0 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.365 0.603 . . . . 0.0 110.24 -177.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.552 ' OE1' ' HA ' ' A' ' 61' ' ' ASN . 3.3 pt20 -71.97 -9.24 58.08 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.684 -178.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -78.29 -15.91 58.28 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 121.416 0.627 . . . . 0.0 109.819 175.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.0 t -84.05 161.61 3.22 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 174.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 33.7 mt-10 -49.31 142.2 7.74 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.287 0.635 . . . . 0.0 111.306 177.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.459 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 15.5 ptpt -56.38 -33.42 65.72 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -174.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.502 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.8 pt20 -77.57 -22.81 50.38 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-O 121.758 0.79 . . . . 0.0 110.176 -179.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.502 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 66.3 m -98.57 -13.15 20.56 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.672 -173.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 76.8 mt-30 -57.04 -40.69 77.25 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 123.234 0.614 . . . . 0.0 111.802 178.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.456 ' HA ' HG12 ' A' ' 75' ' ' ILE . 20.4 p -83.47 -24.06 31.95 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 119.409 -0.917 . . . . 0.0 111.981 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.516 ' HB2' HD11 ' A' ' 24' ' ' ILE . 9.4 mm-40 -64.92 -36.8 85.55 Favored 'General case' 0 CA--C 1.553 1.091 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 177.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.466 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -58.12 -31.79 67.52 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.093 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.566 HD11 HD22 ' A' ' 63' ' ' LEU . 28.2 mm -69.91 -32.6 52.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.322 -176.337 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.477 ' O ' ' HG3' ' A' ' 80' ' ' GLU . 14.6 mmmm -68.92 -41.07 78.66 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 -178.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.489 ' NE2' ' HB ' ' A' ' 24' ' ' ILE . 5.9 mt-30 -61.01 -37.87 84.07 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 113.598 -1.637 . . . . 0.0 110.639 -179.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.491 HG22 ' HB3' ' A' ' 29' ' ' LEU . 40.3 t -55.91 -46.85 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 123.94 0.775 . . . . 0.0 109.233 178.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 38.4 t -62.95 -46.08 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.357 -175.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 38.6 mt-10 -56.88 -52.3 65.7 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.307 -178.093 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -73.33 -32.12 64.38 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.816 -176.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.414 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -71.35 -39.69 71.14 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.045 -179.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -72.56 -41.08 66.15 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.545 -179.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.427 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -66.67 -27.92 68.04 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 120.841 0.353 . . . . 0.0 111.62 -176.822 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.428 ' HA ' ' NE2' ' A' ' 88' ' ' GLN . 17.1 pt20 -77.67 -30.33 51.95 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.824 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.495 ' HB3' ' O ' ' A' ' 91' ' ' GLY . 3.2 mm? -87.04 -41.64 13.7 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.165 0.507 . . . . 0.0 111.982 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -58.66 -32.13 68.81 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.727 1.211 . . . . 0.0 112.412 -177.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.428 ' NE2' ' HA ' ' A' ' 85' ' ' GLN . 11.4 pt20 -73.72 -9.48 58.7 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -174.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -154.86 -73.6 0.01 OUTLIER Glycine 0 C--N 1.304 -1.206 0 C-N-CA 118.649 -1.738 . . . . 0.0 113.975 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -61.18 -43.03 99.52 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -175.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.495 ' O ' ' HB3' ' A' ' 86' ' ' LEU . . . 101.49 -106.1 2.98 Favored Glycine 0 CA--C 1.473 -2.54 0 N-CA-C 105.728 -2.949 . . . . 0.0 105.728 -170.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.403 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 75.61 -24.94 1.44 Allowed Glycine 0 C--O 1.186 -2.892 0 N-CA-C 115.555 0.982 . . . . 0.0 115.555 169.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -58.61 -21.6 53.97 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 118.887 1.344 . . . . 0.0 113.719 -174.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -77.65 -38.11 48.49 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.503 174.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.402 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 4.1 pt20 -85.19 -43.0 14.2 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 122.025 0.917 . . . . 0.0 109.38 -178.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.473 HG13 ' HA ' ' A' ' 37' ' ' THR . 72.1 t -63.2 -22.71 31.42 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 C-N-CA 125.821 1.648 . . . . 0.0 110.146 177.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -45.14 -47.45 12.26 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.436 0.694 . . . . 0.0 112.527 -179.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 29.7 pt20 -69.32 -17.6 63.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.041 -177.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 4.9 tpt -100.14 -45.45 5.64 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -178.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.7 p -66.55 -25.85 36.07 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.186 179.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.438 ' HA ' HE21 ' A' ' 104' ' ' GLN . 0.0 OUTLIER -60.88 -26.26 67.28 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 122.025 -0.422 . . . . 0.0 111.395 175.219 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -63.0 -31.9 73.14 Favored 'General case' 0 C--O 1.208 -1.08 0 C-N-CA 122.802 0.441 . . . . 0.0 110.015 178.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 106' ' ' LEU . . . -61.58 -31.81 71.88 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-O 121.147 0.499 . . . . 0.0 110.486 178.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.438 HE21 ' HA ' ' A' ' 101' ' ' LYS . 35.1 mt-30 -72.62 -20.91 61.2 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.728 0.775 . . . . 0.0 109.629 -179.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . 0.433 ' O ' ' HB2' ' A' ' 108' ' ' ASN . 48.2 mtp -92.4 -17.3 24.8 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.563 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.434 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 3.6 mp -53.17 -46.52 97.75 Favored Pre-proline 0 N--CA 1.471 0.603 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 16.3 Cg_endo -60.94 -22.31 74.01 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 121.216 1.278 . . . . 0.0 112.577 176.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 105' ' ' MET . 16.0 m120 -84.71 -49.42 8.51 Favored 'General case' 0 N--CA 1.415 -2.196 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -74.2 -33.3 63.36 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.757 -174.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.472 ' SG ' HD21 ' A' ' 112' ' ' LEU . 34.8 t -89.32 -6.98 56.25 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 60.0 64.33 1.29 Allowed 'General case' 0 C--O 1.241 0.633 0 CA-C-O 123.499 1.619 . . . . 0.0 110.653 -178.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.472 HD21 ' SG ' ' A' ' 110' ' ' CYS . 40.4 mt -101.83 159.24 15.51 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 112.412 -2.176 . . . . 0.0 109.555 178.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -74.32 45.28 0.22 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.092 0.957 . . . . 0.0 111.952 -175.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 107' ' ' PRO . 56.0 m -162.12 164.49 27.97 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 124.046 0.938 . . . . 0.0 109.297 -175.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 55.0 m -150.64 123.74 8.8 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 66.4 mt . . . . . 0 C--N 1.311 -1.085 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -178.329 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.52 0 N-CA-C 109.195 -1.562 . . . . 0.0 109.195 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 49.7 mtm105 -76.79 127.63 33.11 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 117.698 0.749 . . . . 0.0 109.738 179.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 64.5 m -136.48 144.97 44.64 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.209 -175.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.1 p -73.48 148.25 43.34 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -87.75 79.47 8.18 Favored 'General case' 0 N--CA 1.42 -1.93 0 CA-C-O 121.799 0.809 . . . . 0.0 108.876 177.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 53.4 p -140.98 164.91 28.99 Favored 'General case' 0 N--CA 1.417 -2.108 0 CA-C-N 113.984 -1.462 . . . . 0.0 107.99 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 34.1 mm -128.72 110.93 18.89 Favored Pre-proline 0 C--N 1.3 -1.578 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -73.06 151.49 97.14 Favored 'Cis proline' 0 C--O 1.248 1.004 0 C-N-CA 124.341 -1.108 . . . . 0.0 112.192 -0.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -74.02 156.98 47.3 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.258 1.972 . . . . 0.0 111.998 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.7 mm -114.65 117.2 54.87 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 N-CA-C 107.03 -1.471 . . . . 0.0 107.03 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 85.8 m -106.59 145.15 32.26 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-O 121.826 0.822 . . . . 0.0 111.879 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -98.89 152.09 37.67 Favored Pre-proline 0 N--CA 1.416 -2.151 0 CA-C-N 114.0 -1.455 . . . . 0.0 110.155 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.38 45.32 1.55 Allowed 'Trans proline' 0 C--O 1.247 0.949 0 C-N-CA 123.139 2.559 . . . . 0.0 111.541 179.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -153.52 132.57 12.56 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.972 -178.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -161.09 -119.66 0.52 Allowed Glycine 0 N--CA 1.425 -2.034 0 N-CA-C 109.273 -1.531 . . . . 0.0 109.273 177.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -151.4 -52.48 0.13 Allowed 'General case' 0 C--N 1.296 -1.731 0 CA-C-O 121.222 0.534 . . . . 0.0 110.937 177.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -95.86 17.13 15.86 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-O 121.788 0.804 . . . . 0.0 110.199 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -130.01 121.45 19.8 Favored Pre-proline 0 C--N 1.295 -1.772 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.767 -178.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.431 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . 66.9 Cg_exo -57.03 -48.01 20.24 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.692 2.261 . . . . 0.0 110.421 174.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.442 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 1.7 mpt_? -109.21 -59.16 1.93 Allowed 'General case' 0 CA--C 1.492 -1.269 0 N-CA-C 107.996 -1.112 . . . . 0.0 107.996 174.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.45 58.25 0.96 Allowed Glycine 0 CA--C 1.466 -2.983 0 N-CA-C 108.739 -1.744 . . . . 0.0 108.739 -173.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.1 m -83.31 134.69 34.91 Favored 'General case' 0 N--CA 1.404 -2.736 0 CA-C-N 114.362 -0.919 . . . . 0.0 112.08 -177.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.454 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 3.3 pt20 -101.12 101.05 11.7 Favored 'General case' 0 N--CA 1.416 -2.143 0 CA-C-O 122.443 1.116 . . . . 0.0 110.276 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.446 ' HB ' ' NE2' ' A' ' 77' ' ' GLN . 2.4 mp -115.08 132.37 64.54 Favored 'Isoleucine or valine' 0 C--N 1.261 -3.241 0 N-CA-C 105.628 -1.99 . . . . 0.0 105.628 176.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.527 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.6 ptt180 -68.55 118.13 11.18 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 pp -65.67 -16.42 20.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.226 0.536 . . . . 0.0 111.926 -176.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -74.87 -16.52 60.67 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.254 -178.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 7.0 pt20 -89.18 -19.63 25.22 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.277 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.424 ' HB3' HG22 ' A' ' 78' ' ' VAL . 2.7 mm? -89.88 -0.23 57.44 Favored 'General case' 0 CA--C 1.477 -1.859 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.743 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -50.38 -37.66 38.49 Favored 'General case' 0 C--O 1.218 -0.598 0 O-C-N 124.413 1.071 . . . . 0.0 111.146 178.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -66.81 -52.98 37.43 Favored 'General case' 0 C--O 1.215 -0.747 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.839 ' HA ' ' CD2' ' A' ' 35' ' ' HIS . 0.7 OUTLIER -58.28 -51.94 67.68 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 123.274 0.359 . . . . 0.0 110.639 179.523 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -50.05 -52.34 35.2 Favored 'General case' 0 N--CA 1.434 -1.233 0 C-N-CA 124.162 0.985 . . . . 0.0 111.608 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptm -71.71 -41.05 69.06 Favored 'General case' 0 C--O 1.211 -0.946 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.521 -177.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.839 ' CD2' ' HA ' ' A' ' 32' ' ' CYS . 1.4 p80 -68.16 -24.68 65.0 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.995 0.426 . . . . 0.0 111.954 -176.228 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.416 HD22 ' O ' ' A' ' 99' ' ' MET . 95.2 mt -83.39 -40.61 19.15 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.81 176.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.471 ' HA ' HG13 ' A' ' 96' ' ' VAL . 58.5 p -83.7 -21.0 32.49 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 118.947 -1.101 . . . . 0.0 112.929 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.6 m -90.66 121.54 32.66 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -100.94 97.91 8.44 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 169.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.439 ' HB3' ' CD1' ' A' ' 43' ' ' LEU . 8.0 t70 -80.78 174.31 11.74 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.843 -170.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 43.7 p90 -98.15 -37.84 9.55 Favored 'General case' 0 C--N 1.29 -2.022 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 -167.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.74 2.19 43.17 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 119.446 -0.901 . . . . 0.0 111.043 -174.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.439 ' CD1' ' HB3' ' A' ' 40' ' ' ASP . 54.2 mt -81.12 86.67 6.13 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.773 -179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.404 ' HG3' ' HG3' ' A' ' 45' ' ' MET . 37.9 ptt180 -110.36 -32.95 6.77 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.194 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.404 ' HG3' ' HG3' ' A' ' 44' ' ' ARG . 66.1 mtt -109.47 27.52 9.46 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.137 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -141.08 87.13 2.07 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.572 -1.195 . . . . 0.0 109.918 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 45.2 t -132.33 -57.78 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 177.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -136.58 87.12 2.27 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 104.718 -2.327 . . . . 0.0 104.718 172.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -153.12 164.27 20.92 Favored Pre-proline 0 C--N 1.299 -1.619 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 -172.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.89 -24.22 37.91 Favored 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 123.116 2.544 . . . . 0.0 111.6 174.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.555 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 31.3 mmmt -71.07 -10.97 60.66 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.831 178.758 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -88.92 -10.93 46.01 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 122.069 0.938 . . . . 0.0 108.929 176.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -93.93 -10.08 34.96 Favored 'General case' 0 C--N 1.292 -1.912 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.19 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.572 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 4.0 pt20 -60.39 -48.33 82.22 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.347 0.594 . . . . 0.0 110.502 -176.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -74.78 -20.26 59.87 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.05 -179.33 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -72.88 -45.45 58.2 Favored 'General case' 0 C--O 1.214 -0.796 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 174.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.2 m -58.05 -26.89 63.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 122.876 0.471 . . . . 0.0 111.282 177.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 59.3 mt -81.71 -56.39 4.03 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.319 175.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.9 t -62.37 -48.52 79.4 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.2 0.6 . . . . 0.0 112.408 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.539 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 44.0 t -59.03 -32.27 69.59 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.444 0.698 . . . . 0.0 110.117 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.471 ' O ' ' HG2' ' A' ' 64' ' ' GLN . 8.1 t30 -76.88 -41.32 44.31 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.89 0.852 . . . . 0.0 110.322 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.405 HE21 ' HB2' ' A' ' 28' ' ' GLN . 5.9 tp60 -65.13 -36.44 84.26 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.12 -179.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.567 HD22 HD11 ' A' ' 75' ' ' ILE . 3.6 pp -80.21 -33.24 38.29 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.161 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 4.0 pt20 -68.68 -23.11 64.35 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -174.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.93 -22.85 63.15 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.227 0.537 . . . . 0.0 110.053 176.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.8 t -74.66 158.16 5.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 177.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.413 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 1.3 mp0 -42.69 140.67 1.23 Allowed 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 125.03 1.332 . . . . 0.0 111.818 177.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -58.82 -32.97 69.87 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -173.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.587 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 11.5 pt20 -81.62 -11.8 58.97 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.587 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 59.3 m -112.5 -8.23 13.87 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.891 -172.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 99.1 mt-30 -60.64 -43.37 97.63 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.776 0.798 . . . . 0.0 109.819 177.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 2.9 p -77.71 -25.24 49.2 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.144 179.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.408 ' O ' ' HG3' ' A' ' 77' ' ' GLN . 4.1 mm-40 -73.62 -29.27 62.26 Favored 'General case' 0 C--N 1.301 -1.504 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.08 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.515 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -59.03 -32.92 70.17 Favored 'General case' 0 N--CA 1.433 -1.32 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.497 176.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.567 HD11 HD22 ' A' ' 63' ' ' LEU . 22.5 mm -70.22 -32.15 49.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.926 -176.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.416 ' HE2' HD11 ' A' ' 116' ' ' ILE . 31.8 mmtp -70.16 -40.52 74.67 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 -175.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 7.2 mt-30 -64.04 -36.86 85.37 Favored 'General case' 0 CA--C 1.497 -1.071 0 CA-C-N 113.681 -1.599 . . . . 0.0 109.968 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 74' ' ' ALA . 43.7 t -56.73 -46.86 83.24 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.812 0 O-C-N 124.649 1.218 . . . . 0.0 108.569 178.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 41.2 t -64.29 -46.77 92.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.275 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 83' ' ' GLN . 44.3 mt-10 -57.91 -50.33 73.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.942 -178.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' A' ' 77' ' ' GLN . 5.0 pt20 -73.89 -28.3 61.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.94 0.4 . . . . 0.0 111.635 -178.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.48 ' O ' ' HG2' ' A' ' 85' ' ' GLN . . . -75.67 -38.54 58.67 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 120.962 0.41 . . . . 0.0 111.135 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 80' ' ' GLU . 13.9 pt20 -71.11 -38.17 72.35 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -30.72 65.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.685 -176.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 82' ' ' ALA . 3.3 pt20 -74.68 -31.19 61.83 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.24 0.543 . . . . 0.0 110.499 -178.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.583 HD12 ' HA3' ' A' ' 92' ' ' GLY . 2.7 mm? -86.4 -37.31 18.51 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.172 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.18 -35.78 76.14 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.395 -178.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -83.35 -3.24 57.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.26 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -91.51 -70.99 1.19 Allowed Glycine 0 N--CA 1.437 -1.266 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.631 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.42 -37.56 0.14 Allowed 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.483 0.658 . . . . 0.0 110.29 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.2 -93.86 0.11 Allowed Glycine 0 N--CA 1.419 -2.448 0 N-CA-C 107.101 -2.4 . . . . 0.0 107.101 -178.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.583 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 75.42 -31.35 1.18 Allowed Glycine 0 C--O 1.2 -1.999 0 CA-C-O 119.413 -0.66 . . . . 0.0 114.721 173.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -47.83 -35.38 10.12 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 124.681 1.192 . . . . 0.0 112.201 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -74.17 -42.16 60.35 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.467 ' HG2' ' HA2' ' A' ' 92' ' ' GLY . 19.4 pt20 -77.45 -44.71 28.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.48 0.657 . . . . 0.0 110.133 -178.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.471 HG13 ' HA ' ' A' ' 37' ' ' THR . 94.1 t -64.5 -22.85 32.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 C-N-CA 124.789 1.236 . . . . 0.0 110.355 177.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -45.83 -46.0 15.29 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.004 0.522 . . . . 0.0 112.407 -178.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -65.08 -18.22 65.11 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.914 0.388 . . . . 0.0 111.957 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.416 ' O ' HD22 ' A' ' 36' ' ' LEU . 7.6 tpt -101.65 -49.25 4.06 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.3 p -63.02 -23.95 34.67 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.824 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.3 -23.07 66.93 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 121.827 -0.546 . . . . 0.0 110.565 175.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 99' ' ' MET . 22.7 mtpp -67.56 -26.43 66.29 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.301 176.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.95 -32.26 73.65 Favored 'General case' 0 C--O 1.211 -0.949 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.47 ' HB3' HG21 ' A' ' 116' ' ' ILE . 14.1 mm100 -69.69 -19.98 63.56 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 122.079 0.943 . . . . 0.0 109.243 178.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . 0.475 ' HA ' HD22 ' A' ' 108' ' ' ASN . 52.9 mtp -92.15 -19.12 22.6 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.03 179.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.409 ' N ' ' HD2' ' A' ' 107' ' ' PRO . 3.3 mp -54.1 -45.52 99.05 Favored Pre-proline 0 N--CA 1.47 0.543 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -176.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 106' ' ' LEU . 17.7 Cg_endo -61.19 -22.23 74.02 Favored 'Trans proline' 0 C--N 1.366 1.471 0 CA-C-N 120.791 1.318 . . . . 0.0 112.552 176.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . 0.475 HD22 ' HA ' ' A' ' 105' ' ' MET . 32.0 m-80 -86.84 -45.19 11.1 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -69.53 -43.39 73.1 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.303 -177.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.413 ' HB3' ' HG ' ' A' ' 112' ' ' LEU . 13.9 t -86.36 -0.82 56.75 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -176.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 56.88 59.5 3.46 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 122.957 1.361 . . . . 0.0 109.973 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.439 HD21 HD11 ' A' ' 63' ' ' LEU . 57.5 mt -96.87 157.42 15.91 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 113.638 -1.619 . . . . 0.0 110.344 -178.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -78.77 43.87 0.51 Allowed 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 124.825 1.25 . . . . 0.0 112.492 -173.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 54.2 m -156.96 157.1 34.14 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 -176.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.0 m -136.83 140.88 42.75 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.47 HG21 ' HB3' ' A' ' 104' ' ' GLN . 38.4 mm . . . . . 0 N--CA 1.434 -1.253 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 175.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.431 ' HA3' ' HA ' ' A' ' 14' ' ' ASP . . . . . . . . 0 CA--C 1.49 -1.527 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -81.46 165.7 21.01 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.425 0.155 . . . . 0.0 110.78 179.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.823 ' SG ' ' HB2' ' A' ' 9' ' ' PRO . 4.1 t -152.78 153.85 34.01 Favored 'General case' 0 N--CA 1.427 -1.602 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 177.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 74.9 p -77.37 149.57 35.2 Favored 'General case' 0 C--N 1.271 -2.816 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.94 71.12 5.57 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 119.372 -0.931 . . . . 0.0 109.655 178.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.0 t -143.65 168.37 20.06 Favored 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 74.3 mt -129.7 115.35 18.07 Favored Pre-proline 0 C--N 1.308 -1.222 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.71 146.38 86.56 Favored 'Cis proline' 0 C--O 1.246 0.887 0 C-N-CA 123.863 -1.307 . . . . 0.0 111.981 0.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.823 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 91.1 Cg_endo -77.22 152.66 31.12 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 122.371 2.047 . . . . 0.0 112.802 -178.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.8 mm -109.36 111.64 37.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.0 m -104.05 149.34 25.28 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.229 -173.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -106.15 151.76 40.23 Favored Pre-proline 0 C--N 1.293 -1.867 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.972 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -51.73 -53.89 6.26 Favored 'Trans proline' 0 C--N 1.364 1.388 0 C-N-CA 123.085 2.523 . . . . 0.0 110.146 178.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.431 ' HA ' ' HA3' ' A' ' 1' ' ' GLY . 26.5 t70 -140.92 -77.41 0.29 Allowed 'General case' 0 N--CA 1.419 -1.99 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 174.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -113.62 -124.96 4.19 Favored Glycine 0 CA--C 1.471 -2.691 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 177.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER -105.38 -50.99 3.1 Favored 'General case' 0 C--N 1.284 -2.245 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.291 -175.75 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.482 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 32.6 t70 -137.95 96.46 3.22 Favored 'General case' 0 C--N 1.278 -2.532 0 CA-C-N 115.061 -0.972 . . . . 0.0 108.973 -178.18 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -105.61 94.63 8.89 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.482 ' HD3' ' O ' ' A' ' 17' ' ' ASP . 6.6 Cg_exo -74.82 -32.12 5.95 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.053 1.835 . . . . 0.0 114.098 -176.32 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.435 ' HD2' ' N ' ' A' ' 20' ' ' ARG . 1.0 OUTLIER -99.74 -54.98 2.77 Favored 'General case' 0 CA--C 1.503 -0.863 0 CA-C-O 121.896 0.855 . . . . 0.0 108.955 -176.655 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.29 46.7 0.91 Allowed Glycine 0 N--CA 1.43 -1.759 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -172.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 67.4 m -84.48 131.91 34.61 Favored 'General case' 0 N--CA 1.419 -1.977 0 CA-C-N 114.124 -1.038 . . . . 0.0 112.338 -177.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -106.95 101.83 11.23 Favored 'General case' 0 N--CA 1.42 -1.975 0 CA-C-O 122.176 0.989 . . . . 0.0 109.186 176.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -108.39 132.56 55.91 Favored 'Isoleucine or valine' 0 C--N 1.28 -2.452 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.528 ' O ' ' HG2' ' A' ' 28' ' ' GLN . 29.7 ptt-85 -67.58 114.19 6.02 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 121.832 0.825 . . . . 0.0 109.432 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.55 ' HB ' HE22 ' A' ' 81' ' ' GLN . 2.5 pp -68.0 -9.65 11.25 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 CA-C-N 115.254 -0.885 . . . . 0.0 113.203 -174.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -77.42 -20.52 54.46 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.519 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 2.3 pt20 -81.52 -20.98 38.94 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -89.27 -4.86 58.0 Favored 'General case' 0 CA--C 1.477 -1.84 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.623 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.485 ' HA ' HE21 ' A' ' 33' ' ' GLN . 7.5 t30 -55.92 -32.71 64.03 Favored 'General case' 0 C--O 1.218 -0.597 0 O-C-N 124.03 0.831 . . . . 0.0 110.808 -178.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -66.28 -56.66 10.14 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.406 ' HB3' HG11 ' A' ' 78' ' ' VAL . 0.1 OUTLIER -54.22 -51.21 65.17 Favored 'General case' 0 C--O 1.218 -0.59 0 O-C-N 123.827 0.704 . . . . 0.0 109.715 178.98 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.485 HE21 ' HA ' ' A' ' 30' ' ' ASN . 4.8 tt0 -50.68 -60.52 2.95 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 124.062 0.945 . . . . 0.0 112.422 177.152 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -67.84 -35.33 78.4 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.736 -173.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -73.99 -30.27 62.39 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.681 -177.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 99' ' ' MET . 95.9 mt -84.54 -24.64 29.21 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 179.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.463 ' HA ' HG13 ' A' ' 96' ' ' VAL . 71.3 p -84.76 -12.93 52.69 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.196 -1.402 . . . . 0.0 110.129 175.092 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 43.0 t -88.49 149.97 23.37 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.645 177.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.442 ' CZ ' ' HA ' ' A' ' 96' ' ' VAL . 50.7 m-85 -130.07 153.77 48.13 Favored 'General case' 0 N--CA 1.434 -1.264 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.513 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.42 ' HB3' ' HG ' ' A' ' 43' ' ' LEU . 6.9 t70 -108.82 174.9 5.66 Favored 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -101.32 -34.75 9.5 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -170.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.43 7.47 16.75 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 119.397 -0.921 . . . . 0.0 111.672 -175.29 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.42 ' HG ' ' HB3' ' A' ' 40' ' ' ASP . 39.6 mt -73.52 68.79 1.18 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.379 177.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 20.8 mmt180 -123.35 -5.43 8.28 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.81 0.814 . . . . 0.0 108.817 178.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.6 ppp? -148.93 16.15 0.96 Allowed 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.623 -1.171 . . . . 0.0 109.237 -179.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.5 ' HB1' HE22 ' A' ' 52' ' ' GLN . . . -130.71 135.92 48.28 Favored 'General case' 0 N--CA 1.424 -1.767 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.609 -172.695 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 41.9 t -130.01 -68.17 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.361 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -129.74 96.13 4.16 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.413 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 16.0 m120 -120.39 144.48 38.32 Favored Pre-proline 0 C--N 1.293 -1.88 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -43.95 -50.82 7.07 Favored 'Trans proline' 0 C--N 1.355 0.921 0 C-N-CA 123.978 3.119 . . . . 0.0 114.849 -174.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -76.65 -7.22 54.85 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -175.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.5 HE22 ' HB1' ' A' ' 46' ' ' ALA . 75.8 mt-30 -96.26 -28.05 14.71 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 176.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 49' ' ' ASN . 50.3 mt-30 -84.31 11.87 7.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.946 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.512 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 4.1 pt20 -61.21 -32.33 72.1 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.404 178.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -64.51 -24.61 67.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.422 178.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -73.76 -45.05 54.22 Favored 'General case' 0 CA--C 1.491 -1.294 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 178.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.2 m -56.63 -36.38 69.41 Favored 'General case' 0 C--O 1.213 -0.837 0 O-C-N 123.907 0.754 . . . . 0.0 110.333 179.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 54' ' ' GLN . 40.2 mt -79.3 -47.35 16.0 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.955 -178.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.6 t -69.28 -50.39 47.35 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.765 -175.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.423 ' HA ' ' CD2' ' A' ' 63' ' ' LEU . 7.5 t -52.36 -43.43 64.67 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 124.178 0.991 . . . . 0.0 110.048 175.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.451 ' HA ' ' CD ' ' A' ' 64' ' ' GLN . 8.1 t30 -72.06 -23.76 61.41 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.373 -176.275 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -83.83 -48.18 10.33 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.255 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.541 ' O ' ' HG2' ' A' ' 71' ' ' GLN . 3.7 pp -65.21 -34.0 77.34 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-O 121.214 0.531 . . . . 0.0 111.037 -177.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.451 ' CD ' ' HA ' ' A' ' 61' ' ' ASN . 13.4 pt20 -69.31 -15.57 63.37 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.178 0.591 . . . . 0.0 111.865 -176.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -84.58 -11.44 56.01 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.479 0.657 . . . . 0.0 110.301 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 11.6 t -82.74 163.45 3.03 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 174.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 46.0 mt-10 -47.47 144.06 3.25 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.408 0.683 . . . . 0.0 111.657 176.213 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -63.19 -28.93 70.39 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -175.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.52 ' HG3' ' SG ' ' A' ' 70' ' ' CYS . 4.0 pt20 -80.0 -14.86 58.25 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.507 0.67 . . . . 0.0 110.399 177.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.52 ' SG ' ' HG3' ' A' ' 69' ' ' GLN . 57.7 m -110.94 -7.09 14.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.156 -173.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 63' ' ' LEU . 72.0 mt-30 -62.95 -40.33 97.36 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.092 0.472 . . . . 0.0 110.347 177.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 114' ' ' CYS . 32.1 p -77.34 -23.83 50.86 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.419 176.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 14.1 mm-40 -71.0 -32.03 68.73 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.328 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.08 -27.01 68.81 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.815 177.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.491 HD11 HD22 ' A' ' 63' ' ' LEU . 31.0 mm -69.55 -32.5 53.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.734 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -70.8 -41.64 71.37 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 106.465 -1.679 . . . . 0.0 106.465 -174.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.426 HE21 ' HA ' ' A' ' 77' ' ' GLN . 0.1 OUTLIER -56.99 -44.07 82.34 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 112.492 -2.14 . . . . 0.0 110.584 -179.025 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.406 HG11 ' HB3' ' A' ' 32' ' ' CYS . 15.8 t -59.41 -45.96 93.09 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.584 0 O-C-N 124.079 0.862 . . . . 0.0 109.59 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 75' ' ' ILE . 40.1 t -65.53 -46.25 90.27 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.89 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -175.343 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -54.64 -51.85 64.12 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.196 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.55 HE22 ' HB ' ' A' ' 26' ' ' ILE . 3.6 pt20 -76.43 -34.46 58.77 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -175.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.54 -33.89 67.15 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.834 0.349 . . . . 0.0 111.098 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -76.37 -35.69 58.55 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.892 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.484 ' HG3' ' HA ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -71.1 -35.87 71.97 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.088 -176.984 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.414 ' HG3' HD22 ' A' ' 86' ' ' LEU . 2.4 pt20 -68.63 -30.04 68.67 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 121.221 0.534 . . . . 0.0 110.7 -176.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.61 HD12 ' HA3' ' A' ' 92' ' ' GLY . 4.1 mm? -86.28 -37.48 18.51 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.982 175.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -60.91 -34.81 75.24 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.983 0.913 . . . . 0.0 111.868 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -75.62 -4.83 42.32 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.507 0.67 . . . . 0.0 111.738 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -105.24 -132.52 7.38 Favored Glycine 0 N--CA 1.428 -1.837 0 N-CA-C 110.984 -0.847 . . . . 0.0 110.984 178.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -88.62 -23.78 22.98 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 120.781 0.325 . . . . 0.0 111.686 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 157.98 -94.44 0.14 Allowed Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.61 ' HA3' HD12 ' A' ' 86' ' ' LEU . . . 73.05 -36.91 0.76 Allowed Glycine 0 C--O 1.202 -1.847 0 N-CA-C 115.421 0.929 . . . . 0.0 115.421 176.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -49.32 -29.23 5.74 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 124.118 0.967 . . . . 0.0 113.462 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -77.03 -40.1 47.71 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 122.227 0.211 . . . . 0.0 111.204 178.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.403 ' O ' ' HG2' ' A' ' 98' ' ' GLN . 4.1 pt20 -79.63 -45.88 18.25 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.518 HG21 ' HG ' ' A' ' 86' ' ' LEU . 84.4 t -62.22 -23.03 30.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 C-N-CA 125.29 1.436 . . . . 0.0 111.07 177.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -42.58 -52.34 4.82 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.427 1.091 . . . . 0.0 112.732 -179.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 20.6 pt20 -60.12 -18.21 45.65 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.752 0.821 . . . . 0.0 112.778 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' A' ' 36' ' ' LEU . 5.6 tpt -106.01 -47.09 3.93 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 -177.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.1 p -64.78 -23.78 34.15 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-O 120.899 0.381 . . . . 0.0 111.527 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.516 ' O ' ' HG3' ' A' ' 105' ' ' MET . 0.0 OUTLIER -61.69 -25.31 67.33 Favored 'General case' 0 C--O 1.218 -0.599 0 O-C-N 121.791 -0.568 . . . . 0.0 110.966 173.567 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -65.47 -27.93 68.85 Favored 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 122.499 0.32 . . . . 0.0 110.207 177.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.462 ' HA ' ' HG ' ' A' ' 106' ' ' LEU . . . -63.36 -36.18 82.87 Favored 'General case' 0 C--O 1.202 -1.401 0 CA-C-O 121.948 0.88 . . . . 0.0 109.001 175.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -76.82 -16.06 59.55 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.179 -0.918 . . . . 0.0 110.3 -178.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . 0.516 ' HG3' ' O ' ' A' ' 101' ' ' LYS . 68.4 mtp -91.57 -14.7 29.83 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.057 178.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.462 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 96.9 mt -51.46 -50.09 78.61 Favored Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 123.559 0.537 . . . . 0.0 112.351 -178.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . 0.489 ' HD3' HG21 ' A' ' 75' ' ' ILE . 19.5 Cg_endo -61.38 -26.3 81.28 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.817 1.678 . . . . 0.0 112.663 177.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -83.1 -28.3 29.58 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-O 121.358 0.599 . . . . 0.0 109.616 -177.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -84.33 -47.85 10.31 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.452 0.644 . . . . 0.0 111.022 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 88.4 m -82.63 0.58 42.44 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -175.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 60.2 t30 56.87 61.68 2.53 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 122.175 0.988 . . . . 0.0 109.963 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 74.9 mt -95.09 158.52 15.43 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.735 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 15.8 mt-30 -72.55 17.65 0.11 Allowed 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.93 0.892 . . . . 0.0 113.318 -172.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 72' ' ' CYS . 83.1 m -148.31 158.01 43.83 Favored 'General case' 0 C--N 1.268 -2.949 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 -169.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 31.9 p -134.69 146.88 49.9 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.403 HG12 ' HG3' ' A' ' 107' ' ' PRO . 33.6 mm . . . . . 0 C--N 1.303 -1.431 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 177.646 . . . . . . . . 1 1 . 1 stop_ save_