data_1chl_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 1chl _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ptp . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.407 ' O ' ' C ' ' A' ' 3' ' ' MET . 1.9 t -110.1 -178.51 3.53 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.271 -0.893 . . . . 0.0 109.499 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.491 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 3.0 ptt? -44.77 155.45 0.39 Allowed Pre-proline 0 N--CA 1.488 1.455 0 O-C-N 121.228 -0.92 . . . . 0.0 109.363 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.491 ' HD2' ' HB2' ' A' ' 3' ' ' MET . 36.4 Cg_endo -57.53 -162.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.801 0 O-C-N 124.051 1.553 . . . . 0.0 110.214 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.515 ' O ' ' CD1' ' A' ' 6' ' ' PHE . 1.1 m -134.35 70.98 1.44 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.27 -0.893 . . . . 0.0 109.604 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.515 ' CD1' ' O ' ' A' ' 5' ' ' CYS . 30.1 m-85 -150.85 40.85 0.74 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.37 -0.831 . . . . 0.0 109.239 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.18 148.51 50.61 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.287 -0.883 . . . . 0.0 109.524 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.3 p 49.91 -160.91 0.06 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.316 -0.865 . . . . 0.0 109.732 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.0 -44.35 0.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.355 -0.841 . . . . 0.0 109.237 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.464 ' O ' ' NH2' ' A' ' 14' ' ' ARG . 7.3 m170 -88.99 3.83 50.29 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.403 -0.811 . . . . 0.0 109.539 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -154.96 58.06 0.67 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.225 -0.922 . . . . 0.0 109.616 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.455 ' CE ' ' HE1' ' A' ' 3' ' ' MET . 0.0 OUTLIER -111.1 -53.98 2.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.267 -0.896 . . . . 0.0 109.189 179.828 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.19 7.29 9.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.478 -0.764 . . . . 0.0 109.664 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.464 ' NH2' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER -79.96 -12.56 59.71 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.176 -0.952 . . . . 0.0 109.584 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.2 -12.89 4.53 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.118 -0.989 . . . . 0.0 110.221 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -63.19 1.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.983 -1.073 . . . . 0.0 109.077 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.584 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 13.9 t0 -49.6 -46.48 49.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.361 -0.837 . . . . 0.0 109.372 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -60.99 -37.48 82.64 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.453 -0.779 . . . . 0.0 110.034 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.2 t -51.16 -41.87 60.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.098 -1.001 . . . . 0.0 109.226 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.475 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 1.7 m -80.51 -34.55 35.56 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.47 -0.769 . . . . 0.0 110.117 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 171.3 -52.56 0.18 Allowed Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.481 ' O ' ' CD ' ' A' ' 25' ' ' ARG . . . 115.0 170.31 16.32 Favored Glycine 0 N--CA 1.483 1.791 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 10.5 tttt 71.44 28.61 2.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.304 -1.115 . . . . 0.0 109.642 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 36' ' ' ARG . . . 88.89 20.92 44.74 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.481 ' CD ' ' O ' ' A' ' 22' ' ' GLY . 0.9 OUTLIER -103.6 33.6 3.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.21 -1.171 . . . . 0.0 109.493 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.584 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . 174.64 127.17 0.99 Allowed Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -146.13 -175.7 4.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.159 -1.201 . . . . 0.0 110.006 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.4 m -92.71 98.4 11.39 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.529 -0.732 . . . . 0.0 109.738 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -95.12 99.83 11.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.637 -1.29 . . . . 0.0 109.558 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 55.68 -127.73 43.18 Favored Glycine 0 N--CA 1.488 2.113 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -97.8 40.44 0.1 OUTLIER 'Trans proline' 0 C--N 1.301 -1.952 0 O-C-N 124.221 1.643 . . . . 0.0 110.299 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -160.41 123.88 3.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.252 -0.905 . . . . 0.0 109.785 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.438 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 13.3 t -86.99 123.73 32.41 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.295 -0.878 . . . . 0.0 108.826 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.451 ' O ' ' HA2' ' A' ' 26' ' ' GLY . 2.1 mt -133.89 -178.67 5.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.004 -1.06 . . . . 0.0 110.077 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.474 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 4.3 m -88.73 176.4 7.1 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.461 -0.774 . . . . 0.0 109.365 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.471 ' HB2' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 118.006 -0.997 . . . . 0.0 109.515 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.439 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.7 t -120.72 -31.39 4.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.198 -0.939 . . . . 0.0 109.873 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.536 ' HB2' ' CD ' ' A' ' 4' ' ' PRO . 2.0 ptm -177.0 -172.3 0.15 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.206 -0.934 . . . . 0.0 109.294 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.536 ' CD ' ' HB2' ' A' ' 3' ' ' MET . 36.1 Cg_endo -85.37 -164.85 0.25 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 123.85 1.447 . . . . 0.0 110.015 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.401 ' O ' ' CD1' ' A' ' 6' ' ' PHE . 1.3 m -132.87 179.11 6.37 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.17 -0.956 . . . . 0.0 109.922 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.401 ' CD1' ' O ' ' A' ' 5' ' ' CYS . 34.5 m-85 -149.41 -168.67 3.17 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.399 -0.813 . . . . 0.0 109.419 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.458 ' O ' ' OG1' ' A' ' 8' ' ' THR . 0.0 OUTLIER -128.58 -171.78 2.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 109.72 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' A' ' 7' ' ' THR . 1.2 p 67.3 171.98 0.26 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.335 -0.853 . . . . 0.0 109.456 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -89.95 95.26 10.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.272 -0.892 . . . . 0.0 109.468 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.468 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 4.5 m170 -126.63 -4.3 6.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.226 -0.921 . . . . 0.0 109.576 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 10' ' ' HIS . 41.5 mt-30 63.18 54.54 2.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.203 -0.936 . . . . 0.0 109.513 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.467 ' O ' ' CG ' ' A' ' 15' ' ' LYS . 2.1 tmm? -120.45 -58.3 1.85 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.361 -0.837 . . . . 0.0 109.428 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.75 -11.25 11.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.362 -0.836 . . . . 0.0 110.064 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.24 -27.59 27.83 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.104 -0.998 . . . . 0.0 109.968 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.481 ' HG3' ' N ' ' A' ' 16' ' ' CYS . 4.8 ptmm? -84.68 -32.81 23.39 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 120.976 -1.078 . . . . 0.0 109.738 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.481 ' N ' ' HG3' ' A' ' 15' ' ' LYS . 39.6 t -47.39 -53.95 12.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 109.61 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.586 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 48.5 t0 -44.41 -52.78 7.48 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.172 -0.955 . . . . 0.0 109.249 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -48.86 -43.73 39.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.441 -0.787 . . . . 0.0 109.38 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -49.45 -45.83 47.08 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.532 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 54.3 m -58.2 -38.54 76.94 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.87 -0.518 . . . . 0.0 109.641 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 165.78 -44.73 0.28 Allowed Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.486 -1.445 . . . . 0.0 109.486 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.476 ' O ' ' OD1' ' A' ' 17' ' ' ASP . . . -177.8 176.74 48.18 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.96 -1.656 . . . . 0.0 108.96 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 pttm -60.3 149.42 33.55 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.881 -1.364 . . . . 0.0 109.451 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 80.76 12.48 82.73 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.532 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -148.65 37.09 0.81 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.88 -1.365 . . . . 0.0 109.835 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.586 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . 167.59 143.02 3.64 Favored Glycine 0 N--CA 1.49 2.28 0 C-N-CA 119.761 -1.209 . . . . 0.0 110.327 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.46 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 0.2 OUTLIER 171.44 -169.82 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.138 -1.213 . . . . 0.0 109.333 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.4 m -74.57 80.18 1.98 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.292 -0.88 . . . . 0.0 109.514 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -98.35 138.88 34.95 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.984 -1.073 . . . . 0.0 109.0 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 69.46 -138.21 30.19 Favored Glycine 0 N--CA 1.485 1.952 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.464 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 35.6 Cg_endo -94.63 3.2 2.71 Favored 'Trans proline' 0 C--N 1.302 -1.92 0 O-C-N 123.961 1.506 . . . . 0.0 110.315 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' A' ' 31' ' ' PRO . 8.7 mt-30 -145.24 -159.39 1.0 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.264 -0.897 . . . . 0.0 109.656 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' A' ' 27' ' ' LYS . 8.0 t -108.79 103.73 12.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.222 -0.923 . . . . 0.0 109.684 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.439 HD22 ' HB3' ' A' ' 1' ' ' MET . 6.4 mt -109.1 -172.15 1.99 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.371 -0.831 . . . . 0.0 109.531 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.506 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 66.1 m -106.61 170.7 7.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.31 -0.869 . . . . 0.0 109.47 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.459 ' O ' ' O ' ' A' ' 35' ' ' CYS . 1.6 mtp85 . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 118.05 -0.976 . . . . 0.0 109.671 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.29 0.567 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.8 t -112.23 -120.02 0.29 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.168 -0.958 . . . . 0.0 109.485 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.595 ' CB ' ' CD ' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -102.52 -154.77 0.02 OUTLIER Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 120.718 -1.239 . . . . 0.0 109.358 -179.799 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.595 ' CD ' ' CB ' ' A' ' 3' ' ' MET . 36.6 Cg_endo -109.07 -160.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.51 0 O-C-N 123.702 1.369 . . . . 0.0 110.456 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.456 ' HB2' ' HB3' ' A' ' 28' ' ' CYS . 1.4 m -158.51 178.87 9.67 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.282 -0.886 . . . . 0.0 109.647 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -112.43 -164.62 0.93 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.429 -0.794 . . . . 0.0 109.158 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -111.81 17.44 19.8 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.31 -0.869 . . . . 0.0 109.127 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.465 ' O ' ' HB2' ' A' ' 9' ' ' ASP . 1.3 p -154.94 -166.06 2.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.32 -0.863 . . . . 0.0 109.326 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' A' ' 8' ' ' THR . 0.2 OUTLIER 72.22 160.75 0.23 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.107 -0.996 . . . . 0.0 109.592 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.9 m80 -121.13 -25.89 5.21 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -0.919 . . . . 0.0 109.664 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.73 12.57 8.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.177 -0.952 . . . . 0.0 109.536 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.432 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 9.0 tpt -80.15 -67.22 0.79 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.213 -0.929 . . . . 0.0 109.277 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.35 -9.08 15.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.592 -0.692 . . . . 0.0 109.96 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -28.08 66.81 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.958 -1.089 . . . . 0.0 109.679 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.0 -41.23 9.25 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.18 -0.95 . . . . 0.0 109.256 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -51.32 70.25 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.24 -0.912 . . . . 0.0 108.962 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.553 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 58.2 t0 -50.84 -53.33 33.1 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.52 -34.8 59.46 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.3 t -49.62 -43.72 46.87 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.6 m -79.51 -32.0 42.27 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.542 -0.724 . . . . 0.0 110.128 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.66 -66.9 0.09 OUTLIER Glycine 0 N--CA 1.491 2.34 0 C-N-CA 119.653 -1.26 . . . . 0.0 110.018 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.469 ' O ' ' OD1' ' A' ' 17' ' ' ASP . . . -178.91 -171.71 42.43 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.703 -1.359 . . . . 0.0 109.703 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.2 mtmt -55.41 120.84 7.75 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.296 -1.12 . . . . 0.0 109.636 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.406 ' C ' ' HG3' ' A' ' 25' ' ' ARG . . . 97.45 11.57 51.03 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.406 ' HG3' ' C ' ' A' ' 24' ' ' GLY . 70.5 mtt180 -149.19 38.36 0.8 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.151 -1.205 . . . . 0.0 109.576 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.574 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . 170.0 134.2 1.71 Allowed Glycine 0 N--CA 1.488 2.147 0 C-N-CA 119.957 -1.116 . . . . 0.0 110.447 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.544 ' HD3' ' CE1' ' A' ' 29' ' ' TYR . 40.8 tttp -158.42 149.07 20.32 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.44 -1.035 . . . . 0.0 109.147 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.483 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 99.5 m -82.89 77.48 9.63 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.165 -0.96 . . . . 0.0 109.617 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.544 ' CE1' ' HD3' ' A' ' 27' ' ' LYS . 35.8 m-85 -64.52 113.82 3.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.04 -1.038 . . . . 0.0 109.289 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 54.74 -139.99 38.71 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -87.39 35.37 0.44 Allowed 'Trans proline' 0 C--N 1.303 -1.816 0 O-C-N 124.032 1.543 . . . . 0.0 110.251 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -148.86 138.78 22.11 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.207 -0.933 . . . . 0.0 109.601 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.483 ' HA ' ' HA ' ' A' ' 28' ' ' CYS . 6.8 t -101.71 120.4 40.29 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.283 -0.885 . . . . 0.0 109.563 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.5 mt -122.9 -164.71 1.22 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.285 -0.885 . . . . 0.0 109.757 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.574 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 34.9 m -106.52 -175.26 2.75 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.421 -0.799 . . . . 0.0 109.434 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.436 ' OXT' ' HG3' ' A' ' 36' ' ' ARG . 18.8 tpt180 . . . . . 0 C--N 1.305 -1.328 0 CA-C-O 118.083 -0.961 . . . . 0.0 109.619 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.45 ' SD ' ' HA ' ' A' ' 32' ' ' GLN . 3.7 ptt? . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.447 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 3.9 t -105.7 120.11 40.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.112 -0.993 . . . . 0.0 109.528 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.561 ' HG3' ' HD2' ' A' ' 4' ' ' PRO . 4.6 tpt 60.14 168.93 0.08 OUTLIER Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.223 -0.923 . . . . 0.0 109.726 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.561 ' HD2' ' HG3' ' A' ' 3' ' ' MET . 36.7 Cg_endo -119.61 89.09 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 O-C-N 124.111 1.585 . . . . 0.0 110.394 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.42 ' O ' ' O ' ' A' ' 4' ' ' PRO . 91.9 m -50.53 177.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.04 -1.037 . . . . 0.0 109.268 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.45 ' O ' ' HB ' ' A' ' 7' ' ' THR . 27.8 m-85 53.26 -174.24 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.155 -0.966 . . . . 0.0 109.473 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.515 ' O ' ' CG2' ' A' ' 7' ' ' THR . 52.7 m 60.63 14.29 4.86 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.221 -0.925 . . . . 0.0 109.427 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.467 ' OG1' ' N ' ' A' ' 9' ' ' ASP . 0.1 OUTLIER 178.15 175.66 0.51 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.254 -0.904 . . . . 0.0 109.544 179.969 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.567 ' O ' ' CG ' ' A' ' 10' ' ' HIS . 0.2 OUTLIER -167.26 75.39 0.15 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.493 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.567 ' CG ' ' O ' ' A' ' 9' ' ' ASP . 80.5 m80 -159.89 56.98 0.37 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.241 -0.912 . . . . 0.0 109.606 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.511 ' CB ' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER 76.28 65.25 0.05 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -0.917 . . . . 0.0 109.28 -179.991 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -127.68 -56.55 1.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.171 -0.956 . . . . 0.0 109.518 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.423 ' HA ' ' HB2' ' A' ' 16' ' ' CYS . . . -67.69 -9.27 42.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.322 -0.861 . . . . 0.0 109.896 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.461 ' HD3' ' HG2' ' A' ' 11' ' ' GLN . 4.5 mtp180 -67.83 -33.78 75.45 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.143 -0.973 . . . . 0.0 109.55 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.74 -22.13 18.9 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.193 -0.942 . . . . 0.0 109.883 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -50.02 -58.92 4.47 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.21 -0.931 . . . . 0.0 109.56 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.587 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 8.0 t0 -57.62 -52.64 64.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.915 . . . . 0.0 109.168 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.422 ' HA ' ' HA2' ' A' ' 22' ' ' GLY . 0.2 OUTLIER -48.0 -26.63 1.85 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 109.064 179.712 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.1 t -62.07 -50.06 73.48 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 1.4 m -68.96 -30.4 68.82 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.658 -0.651 . . . . 0.0 110.271 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 177.72 -69.38 0.08 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.686 -1.366 . . . . 0.0 109.686 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.456 ' O ' ' N ' ' A' ' 24' ' ' GLY . . . 176.75 178.85 46.83 Favored Glycine 0 N--CA 1.485 1.956 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 22' ' ' GLY . 29.1 mtmm -44.25 98.5 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -1.127 . . . . 0.0 109.497 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 22' ' ' GLY . . . 128.32 7.84 4.27 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 119.821 -1.18 . . . . 0.0 110.183 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.524 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 12.0 mtt180 -146.99 40.39 1.06 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.059 -1.259 . . . . 0.0 109.561 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.642 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -166.86 150.99 18.64 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -162.74 131.08 3.92 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.473 -1.016 . . . . 0.0 109.247 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 63.9 m -80.33 82.54 6.35 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -80.95 114.71 20.01 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.883 -1.135 . . . . 0.0 108.771 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 56.38 -131.04 50.62 Favored Glycine 0 N--CA 1.488 2.133 0 N-CA-C 108.978 -1.649 . . . . 0.0 108.978 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -95.69 -1.77 2.19 Favored 'Trans proline' 0 C--N 1.301 -1.965 0 O-C-N 124.14 1.6 . . . . 0.0 110.392 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.45 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 69.3 mt-30 -99.43 117.23 33.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.203 -0.935 . . . . 0.0 110.357 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.1 t -92.44 107.03 18.91 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.395 -0.816 . . . . 0.0 108.869 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.3 mt -123.25 -161.3 0.96 Allowed 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.175 -0.953 . . . . 0.0 109.816 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.642 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 10.7 m -82.72 -168.98 2.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.447 -0.783 . . . . 0.0 109.774 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.0 ttt-85 . . . . . 0 C--N 1.304 -1.389 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.405 -179.962 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.468 ' HG2' ' OE1' ' A' ' 32' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.269 0.557 . . . . 0.0 109.633 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.463 ' O ' ' CB ' ' A' ' 33' ' ' CYS . 5.3 t -121.54 118.39 29.16 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 109.811 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.578 ' HG3' ' HD2' ' A' ' 4' ' ' PRO . 1.9 tpp 56.61 163.78 0.07 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.278 -0.888 . . . . 0.0 109.624 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.578 ' HD2' ' HG3' ' A' ' 3' ' ' MET . 35.6 Cg_endo -109.98 -159.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 O-C-N 124.174 1.618 . . . . 0.0 110.136 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -147.72 132.2 17.68 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.304 -0.873 . . . . 0.0 109.493 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.471 ' O ' ' C ' ' A' ' 7' ' ' THR . 97.2 m-85 -107.42 86.26 2.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.234 -0.916 . . . . 0.0 109.605 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.484 ' O ' ' N ' ' A' ' 9' ' ' ASP . 3.1 m 37.98 -132.1 0.15 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.737 -0.602 . . . . 0.0 109.795 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.476 ' O ' ' CB ' ' A' ' 9' ' ' ASP . 2.2 p 48.87 -94.33 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.793 -1.192 . . . . 0.0 109.528 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.484 ' N ' ' O ' ' A' ' 7' ' ' THR . 0.3 OUTLIER 73.62 73.69 0.13 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.187 -0.946 . . . . 0.0 109.526 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 m80 -139.56 -54.91 0.56 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.209 -0.932 . . . . 0.0 109.436 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.14 14.7 1.48 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.302 -0.874 . . . . 0.0 109.386 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.429 ' HE2' ' HB3' ' A' ' 12' ' ' MET . 3.6 tmm? -87.36 -52.92 5.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.282 -0.886 . . . . 0.0 109.321 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.83 -13.13 9.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.484 -0.76 . . . . 0.0 109.822 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.26 -33.02 5.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.227 -0.921 . . . . 0.0 109.335 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.417 ' HE2' ' SD ' ' A' ' 12' ' ' MET . 0.0 OUTLIER -89.31 -34.34 16.61 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.349 -0.844 . . . . 0.0 110.021 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.42 -46.54 37.62 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.067 -1.021 . . . . 0.0 109.061 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.605 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 23.3 t0 -60.59 -48.92 79.65 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.479 -0.763 . . . . 0.0 109.236 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.447 ' HA ' ' HA2' ' A' ' 22' ' ' GLY . 0.4 OUTLIER -52.91 -32.32 44.7 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.533 -0.729 . . . . 0.0 110.156 -179.415 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 27.2 t -60.23 -55.59 31.83 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.139 -0.976 . . . . 0.0 109.126 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.556 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 61.5 m -54.93 -21.88 13.15 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.462 -0.774 . . . . 0.0 109.677 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.457 ' HA3' ' HD2' ' A' ' 25' ' ' ARG . . . 159.0 -57.52 0.34 Allowed Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.401 -1.479 . . . . 0.0 109.401 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.47 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . 138.86 -177.12 20.45 Favored Glycine 0 N--CA 1.483 1.792 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 22' ' ' GLY . 1.0 OUTLIER 67.98 -83.84 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.42 -1.047 . . . . 0.0 109.803 179.861 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.49 ' HA2' ' OD2' ' A' ' 17' ' ' ASP . . . -162.94 47.66 0.32 Allowed Glycine 0 N--CA 1.493 2.455 0 C-N-CA 119.642 -1.266 . . . . 0.0 110.29 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -120.63 37.29 4.32 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.916 -1.344 . . . . 0.0 110.121 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.605 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . -174.42 130.55 1.81 Allowed Glycine 0 N--CA 1.488 2.144 0 C-N-CA 119.951 -1.119 . . . . 0.0 110.418 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.451 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -151.68 -159.21 0.99 Allowed 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.539 -0.977 . . . . 0.0 109.214 -179.771 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.0 m -121.12 93.76 4.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.22 -0.925 . . . . 0.0 109.731 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -95.52 111.98 23.79 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.712 -1.243 . . . . 0.0 109.587 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 75.63 -131.48 12.09 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -106.06 30.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.303 -1.817 0 O-C-N 124.093 1.575 . . . . 0.0 110.421 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.468 ' OE1' ' HG2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -149.87 156.84 42.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.882 . . . . 0.0 109.571 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 3' ' ' MET . 8.4 t -99.42 122.72 42.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 0.0 109.318 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.9 mt -113.67 -166.84 1.13 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.233 -0.917 . . . . 0.0 109.52 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.578 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 92.7 m -117.25 -166.69 1.21 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.26 -0.9 . . . . 0.0 109.514 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.45 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.557 ' O ' ' CG ' ' A' ' 3' ' ' MET . 1.7 t -128.39 81.76 2.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.265 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.557 ' CG ' ' O ' ' A' ' 2' ' ' CYS . 1.2 ptm 84.47 178.65 0.04 OUTLIER Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.73 -0.606 . . . . 0.0 109.51 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -89.83 -180.0 1.97 Allowed 'Trans proline' 0 C--N 1.302 -1.877 0 O-C-N 124.213 1.638 . . . . 0.0 110.664 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.86 51.91 1.71 Allowed 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.316 -0.865 . . . . 0.0 109.374 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -151.64 84.12 1.29 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.221 -0.924 . . . . 0.0 109.473 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.91 -78.13 0.58 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.255 -0.903 . . . . 0.0 109.48 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.6 t -153.84 170.44 20.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.39 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.524 ' O ' ' CD2' ' A' ' 10' ' ' HIS . 0.4 OUTLIER -87.29 79.06 8.63 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.948 . . . . 0.0 109.491 -179.939 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.524 ' CD2' ' O ' ' A' ' 9' ' ' ASP . 7.2 m170 -153.76 59.46 0.74 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.334 -0.854 . . . . 0.0 109.106 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.429 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER 68.23 40.49 2.11 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.339 -0.851 . . . . 0.0 109.199 -179.586 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -50.74 72.27 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.332 -0.855 . . . . 0.0 109.253 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.489 ' HA ' ' HB3' ' A' ' 16' ' ' CYS . . . -61.84 -11.74 14.16 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.502 -0.749 . . . . 0.0 109.76 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.429 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -62.4 -24.07 67.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.103 -0.998 . . . . 0.0 109.362 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.479 ' O ' ' HB2' ' A' ' 19' ' ' CYS . 0.5 OUTLIER -107.93 -13.42 14.98 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.317 -0.864 . . . . 0.0 109.378 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.489 ' HB3' ' HA ' ' A' ' 13' ' ' ALA . 4.7 t -86.67 -21.43 26.71 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.233 -0.917 . . . . 0.0 108.722 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.601 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 34.3 t0 -88.06 -50.3 6.49 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.5 -33.43 73.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.543 -0.723 . . . . 0.0 109.528 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 15' ' ' LYS . 1.5 t -55.67 -33.43 64.11 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 71.1 m -73.38 -30.74 63.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.728 -0.607 . . . . 0.0 109.576 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.19 -42.7 0.47 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.41 162.86 27.89 Favored Glycine 0 N--CA 1.488 2.102 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.408 ' HA ' ' OD2' ' A' ' 17' ' ' ASP . 0.8 OUTLIER -52.79 110.46 0.52 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.188 -1.184 . . . . 0.0 109.361 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.95 -8.01 3.27 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.537 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -146.9 39.96 1.05 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.207 -1.173 . . . . 0.0 110.039 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.601 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . -175.09 136.48 3.44 Favored Glycine 0 N--CA 1.49 2.235 0 C-N-CA 119.752 -1.214 . . . . 0.0 110.663 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.457 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -164.02 -179.43 6.22 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.55 -0.97 . . . . 0.0 109.045 -179.79 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.1 m -90.92 123.47 34.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.024 -1.048 . . . . 0.0 109.274 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.519 ' CB ' HD13 ' A' ' 34' ' ' LEU . 18.5 m-85 -146.9 155.57 42.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.505 -1.372 . . . . 0.0 109.317 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 53.25 -133.54 42.01 Favored Glycine 0 N--CA 1.486 2.013 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -113.24 38.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 123.928 1.488 . . . . 0.0 110.596 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.41 176.52 2.82 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.172 -0.955 . . . . 0.0 110.173 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.3 t -82.48 124.02 29.69 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.486 -0.758 . . . . 0.0 109.44 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.519 HD13 ' CB ' ' A' ' 29' ' ' TYR . 13.0 mt -104.01 -175.91 2.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.142 -0.974 . . . . 0.0 109.916 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.578 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 86.8 m -138.74 -162.88 1.37 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.413 -0.805 . . . . 0.0 109.319 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.481 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 3.7 tpt180 . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.362 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.7 t -104.66 -65.95 1.0 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.327 -0.858 . . . . 0.0 109.414 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.517 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -168.02 -170.15 0.21 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.277 -0.889 . . . . 0.0 109.096 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.517 ' HD2' ' HB2' ' A' ' 3' ' ' MET . 36.6 Cg_endo -97.06 -169.26 0.13 Allowed 'Trans proline' 0 C--N 1.308 -1.602 0 O-C-N 123.703 1.37 . . . . 0.0 110.386 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.509 ' O ' ' CG ' ' A' ' 6' ' ' PHE . 37.2 m -128.52 67.5 1.38 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.288 -0.882 . . . . 0.0 109.578 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.509 ' CG ' ' O ' ' A' ' 5' ' ' CYS . 95.0 m-85 -156.8 62.19 0.52 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.103 -0.998 . . . . 0.0 109.803 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.39 -69.81 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.312 -0.867 . . . . 0.0 109.054 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.454 HG21 ' SD ' ' A' ' 12' ' ' MET . 9.9 t -100.2 170.94 8.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.395 -0.815 . . . . 0.0 109.255 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.411 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 0.9 OUTLIER -116.96 162.2 18.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.291 -0.88 . . . . 0.0 109.444 179.886 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.498 ' O ' ' CG ' ' A' ' 11' ' ' GLN . 21.5 m170 49.1 23.31 0.73 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.322 -0.861 . . . . 0.0 109.433 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.498 ' CG ' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER -169.81 42.63 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.361 -0.837 . . . . 0.0 109.242 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.514 ' HE3' ' CE ' ' A' ' 3' ' ' MET . 5.5 tpt -119.12 -57.12 2.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.345 -0.847 . . . . 0.0 109.535 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.25 -5.38 22.55 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.424 -0.798 . . . . 0.0 109.9 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.62 4.7 48.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.068 -1.02 . . . . 0.0 109.484 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.466 ' HD2' ' O ' ' A' ' 11' ' ' GLN . 12.7 mtpt -112.7 -29.48 7.42 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.181 -0.949 . . . . 0.0 109.471 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.433 ' SG ' ' C ' ' A' ' 27' ' ' LYS . 3.4 t -67.54 -52.92 33.17 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.222 -0.924 . . . . 0.0 108.601 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.559 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 26.9 t0 -61.38 -47.51 85.49 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.386 -0.821 . . . . 0.0 109.034 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.86 -31.24 69.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.41 -0.806 . . . . 0.0 109.738 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.81 -40.23 87.71 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.359 -0.838 . . . . 0.0 109.291 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.473 ' SG ' ' O ' ' A' ' 25' ' ' ARG . 27.5 m -56.9 -31.64 65.09 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.475 -0.766 . . . . 0.0 109.994 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 119.13 4.05 12.67 Favored Glycine 0 N--CA 1.493 2.434 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.394 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.509 ' HA3' ' CG ' ' A' ' 25' ' ' ARG . . . -140.49 168.41 25.2 Favored Glycine 0 N--CA 1.485 1.965 0 O-C-N 121.032 -1.275 . . . . 0.0 110.009 179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.409 ' O ' ' HG2' ' A' ' 23' ' ' LYS . 7.6 ttpm? -87.65 14.65 8.04 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.335 -1.097 . . . . 0.0 109.576 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.443 ' HA2' ' OD2' ' A' ' 17' ' ' ASP . . . -166.07 21.79 0.12 Allowed Glycine 0 N--CA 1.49 2.282 0 C-N-CA 119.544 -1.312 . . . . 0.0 110.634 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.509 ' CG ' ' HA3' ' A' ' 22' ' ' GLY . 1.2 ptp180 -117.24 39.03 3.37 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.618 -1.519 . . . . 0.0 110.083 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.559 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . -174.01 153.16 16.3 Favored Glycine 0 N--CA 1.491 2.306 0 C-N-CA 119.901 -1.142 . . . . 0.0 110.597 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.433 ' C ' ' SG ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -178.23 143.2 0.28 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.421 -1.047 . . . . 0.0 109.381 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 1.7 m -59.11 87.56 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 109.792 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.42 ' O ' ' C ' ' A' ' 30' ' ' GLY . 13.5 m-85 -97.59 164.97 12.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.859 -1.151 . . . . 0.0 109.065 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 29' ' ' TYR . . . 45.19 -129.43 8.39 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -108.34 10.92 0.13 Allowed 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 123.954 1.502 . . . . 0.0 110.426 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -147.88 159.25 44.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.141 -0.974 . . . . 0.0 110.098 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 28' ' ' CYS . 6.0 t -82.16 122.68 28.18 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.432 -0.793 . . . . 0.0 109.597 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.6 mt -127.64 -171.28 2.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.296 -0.877 . . . . 0.0 109.163 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.536 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 86.8 m -107.28 174.3 5.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -0.933 . . . . 0.0 109.609 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.476 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ptp . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.407 ' O ' ' C ' ' A' ' 3' ' ' MET . 1.9 t -110.1 -178.51 3.53 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.271 -0.893 . . . . 0.0 109.499 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.491 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 3.0 ptt? -44.77 155.45 0.39 Allowed Pre-proline 0 N--CA 1.488 1.455 0 O-C-N 121.228 -0.92 . . . . 0.0 109.363 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.491 ' HD2' ' HB2' ' A' ' 3' ' ' MET . 36.4 Cg_endo -57.53 -162.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.801 0 O-C-N 124.051 1.553 . . . . 0.0 110.214 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.515 ' O ' ' CD1' ' A' ' 6' ' ' PHE . 1.1 m -134.35 70.98 1.44 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.27 -0.893 . . . . 0.0 109.604 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.515 ' CD1' ' O ' ' A' ' 5' ' ' CYS . 30.1 m-85 -150.85 40.85 0.74 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.37 -0.831 . . . . 0.0 109.239 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.18 148.51 50.61 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.287 -0.883 . . . . 0.0 109.524 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.3 p 49.91 -160.91 0.06 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.316 -0.865 . . . . 0.0 109.732 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.0 -44.35 0.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.355 -0.841 . . . . 0.0 109.237 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.464 ' O ' ' NH2' ' A' ' 14' ' ' ARG . 7.3 m170 -88.99 3.83 50.29 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.403 -0.811 . . . . 0.0 109.539 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -154.96 58.06 0.67 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.225 -0.922 . . . . 0.0 109.616 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.455 ' CE ' ' HE1' ' A' ' 3' ' ' MET . 0.0 OUTLIER -111.1 -53.98 2.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.267 -0.896 . . . . 0.0 109.189 179.828 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.19 7.29 9.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.478 -0.764 . . . . 0.0 109.664 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.464 ' NH2' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER -79.96 -12.56 59.71 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.176 -0.952 . . . . 0.0 109.584 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.2 -12.89 4.53 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.118 -0.989 . . . . 0.0 110.221 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -63.19 1.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.983 -1.073 . . . . 0.0 109.077 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.584 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 13.9 t0 -49.6 -46.48 49.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.361 -0.837 . . . . 0.0 109.372 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -60.99 -37.48 82.64 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.453 -0.779 . . . . 0.0 110.034 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.2 t -51.16 -41.87 60.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.098 -1.001 . . . . 0.0 109.226 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.475 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 1.7 m -80.51 -34.55 35.56 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.47 -0.769 . . . . 0.0 110.117 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 171.3 -52.56 0.18 Allowed Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.481 ' O ' ' CD ' ' A' ' 25' ' ' ARG . . . 115.0 170.31 16.32 Favored Glycine 0 N--CA 1.483 1.791 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 10.5 tttt 71.44 28.61 2.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.304 -1.115 . . . . 0.0 109.642 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 36' ' ' ARG . . . 88.89 20.92 44.74 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.481 ' CD ' ' O ' ' A' ' 22' ' ' GLY . 0.9 OUTLIER -103.6 33.6 3.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.21 -1.171 . . . . 0.0 109.493 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.584 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . 174.64 127.17 0.99 Allowed Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -146.13 -175.7 4.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.159 -1.201 . . . . 0.0 110.006 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.4 m -92.71 98.4 11.39 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.529 -0.732 . . . . 0.0 109.738 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -95.12 99.83 11.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.637 -1.29 . . . . 0.0 109.558 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 55.68 -127.73 43.18 Favored Glycine 0 N--CA 1.488 2.113 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -97.8 40.44 0.1 OUTLIER 'Trans proline' 0 C--N 1.301 -1.952 0 O-C-N 124.221 1.643 . . . . 0.0 110.299 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -160.41 123.88 3.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.252 -0.905 . . . . 0.0 109.785 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.438 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 13.3 t -86.99 123.73 32.41 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.295 -0.878 . . . . 0.0 108.826 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.451 ' O ' ' HA2' ' A' ' 26' ' ' GLY . 2.1 mt -133.89 -178.67 5.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.004 -1.06 . . . . 0.0 110.077 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.474 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 4.3 m -88.73 176.4 7.1 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.461 -0.774 . . . . 0.0 109.365 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.471 ' HB2' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 118.006 -0.997 . . . . 0.0 109.515 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.439 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.7 t -120.72 -31.39 4.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.198 -0.939 . . . . 0.0 109.873 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.536 ' HB2' ' CD ' ' A' ' 4' ' ' PRO . 2.0 ptm -177.0 -172.3 0.15 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.206 -0.934 . . . . 0.0 109.294 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.536 ' CD ' ' HB2' ' A' ' 3' ' ' MET . 36.1 Cg_endo -85.37 -164.85 0.25 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 123.85 1.447 . . . . 0.0 110.015 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.401 ' O ' ' CD1' ' A' ' 6' ' ' PHE . 1.3 m -132.87 179.11 6.37 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.17 -0.956 . . . . 0.0 109.922 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.401 ' CD1' ' O ' ' A' ' 5' ' ' CYS . 34.5 m-85 -149.41 -168.67 3.17 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.399 -0.813 . . . . 0.0 109.419 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.458 ' O ' ' OG1' ' A' ' 8' ' ' THR . 0.0 OUTLIER -128.58 -171.78 2.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 109.72 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' A' ' 7' ' ' THR . 1.2 p 67.3 171.98 0.26 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.335 -0.853 . . . . 0.0 109.456 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -89.95 95.26 10.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.272 -0.892 . . . . 0.0 109.468 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.468 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 4.5 m170 -126.63 -4.3 6.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.226 -0.921 . . . . 0.0 109.576 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 10' ' ' HIS . 41.5 mt-30 63.18 54.54 2.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.203 -0.936 . . . . 0.0 109.513 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.467 ' O ' ' CG ' ' A' ' 15' ' ' LYS . 2.1 tmm? -120.45 -58.3 1.85 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.361 -0.837 . . . . 0.0 109.428 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.75 -11.25 11.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.362 -0.836 . . . . 0.0 110.064 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.24 -27.59 27.83 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.104 -0.998 . . . . 0.0 109.968 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.481 ' HG3' ' N ' ' A' ' 16' ' ' CYS . 4.8 ptmm? -84.68 -32.81 23.39 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 120.976 -1.078 . . . . 0.0 109.738 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.481 ' N ' ' HG3' ' A' ' 15' ' ' LYS . 39.6 t -47.39 -53.95 12.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 109.61 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.586 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 48.5 t0 -44.41 -52.78 7.48 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.172 -0.955 . . . . 0.0 109.249 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -48.86 -43.73 39.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.441 -0.787 . . . . 0.0 109.38 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -49.45 -45.83 47.08 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.532 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 54.3 m -58.2 -38.54 76.94 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.87 -0.518 . . . . 0.0 109.641 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 165.78 -44.73 0.28 Allowed Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.486 -1.445 . . . . 0.0 109.486 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.476 ' O ' ' OD1' ' A' ' 17' ' ' ASP . . . -177.8 176.74 48.18 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.96 -1.656 . . . . 0.0 108.96 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 pttm -60.3 149.42 33.55 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.881 -1.364 . . . . 0.0 109.451 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 80.76 12.48 82.73 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.532 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -148.65 37.09 0.81 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.88 -1.365 . . . . 0.0 109.835 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.586 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . 167.59 143.02 3.64 Favored Glycine 0 N--CA 1.49 2.28 0 C-N-CA 119.761 -1.209 . . . . 0.0 110.327 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.46 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 0.2 OUTLIER 171.44 -169.82 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.138 -1.213 . . . . 0.0 109.333 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.4 m -74.57 80.18 1.98 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.292 -0.88 . . . . 0.0 109.514 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -98.35 138.88 34.95 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.984 -1.073 . . . . 0.0 109.0 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 69.46 -138.21 30.19 Favored Glycine 0 N--CA 1.485 1.952 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.464 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 35.6 Cg_endo -94.63 3.2 2.71 Favored 'Trans proline' 0 C--N 1.302 -1.92 0 O-C-N 123.961 1.506 . . . . 0.0 110.315 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' A' ' 31' ' ' PRO . 8.7 mt-30 -145.24 -159.39 1.0 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.264 -0.897 . . . . 0.0 109.656 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' A' ' 27' ' ' LYS . 8.0 t -108.79 103.73 12.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.222 -0.923 . . . . 0.0 109.684 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.439 HD22 ' HB3' ' A' ' 1' ' ' MET . 6.4 mt -109.1 -172.15 1.99 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.371 -0.831 . . . . 0.0 109.531 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.506 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 66.1 m -106.61 170.7 7.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.31 -0.869 . . . . 0.0 109.47 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.459 ' O ' ' O ' ' A' ' 35' ' ' CYS . 1.6 mtp85 . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 118.05 -0.976 . . . . 0.0 109.671 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.29 0.567 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.8 t -112.23 -120.02 0.29 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.168 -0.958 . . . . 0.0 109.485 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.595 ' CB ' ' CD ' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -102.52 -154.77 0.02 OUTLIER Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 120.718 -1.239 . . . . 0.0 109.358 -179.799 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.595 ' CD ' ' CB ' ' A' ' 3' ' ' MET . 36.6 Cg_endo -109.07 -160.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.51 0 O-C-N 123.702 1.369 . . . . 0.0 110.456 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.456 ' HB2' ' HB3' ' A' ' 28' ' ' CYS . 1.4 m -158.51 178.87 9.67 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.282 -0.886 . . . . 0.0 109.647 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -112.43 -164.62 0.93 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.429 -0.794 . . . . 0.0 109.158 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -111.81 17.44 19.8 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.31 -0.869 . . . . 0.0 109.127 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.465 ' O ' ' HB2' ' A' ' 9' ' ' ASP . 1.3 p -154.94 -166.06 2.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.32 -0.863 . . . . 0.0 109.326 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' A' ' 8' ' ' THR . 0.2 OUTLIER 72.22 160.75 0.23 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.107 -0.996 . . . . 0.0 109.592 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.9 m80 -121.13 -25.89 5.21 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -0.919 . . . . 0.0 109.664 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.73 12.57 8.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.177 -0.952 . . . . 0.0 109.536 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.432 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 9.0 tpt -80.15 -67.22 0.79 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.213 -0.929 . . . . 0.0 109.277 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.35 -9.08 15.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.592 -0.692 . . . . 0.0 109.96 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -28.08 66.81 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.958 -1.089 . . . . 0.0 109.679 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.0 -41.23 9.25 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.18 -0.95 . . . . 0.0 109.256 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -51.32 70.25 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.24 -0.912 . . . . 0.0 108.962 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.553 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 58.2 t0 -50.84 -53.33 33.1 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.52 -34.8 59.46 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.3 t -49.62 -43.72 46.87 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.6 m -79.51 -32.0 42.27 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.542 -0.724 . . . . 0.0 110.128 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.66 -66.9 0.09 OUTLIER Glycine 0 N--CA 1.491 2.34 0 C-N-CA 119.653 -1.26 . . . . 0.0 110.018 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.469 ' O ' ' OD1' ' A' ' 17' ' ' ASP . . . -178.91 -171.71 42.43 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.703 -1.359 . . . . 0.0 109.703 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.2 mtmt -55.41 120.84 7.75 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.296 -1.12 . . . . 0.0 109.636 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.406 ' C ' ' HG3' ' A' ' 25' ' ' ARG . . . 97.45 11.57 51.03 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.406 ' HG3' ' C ' ' A' ' 24' ' ' GLY . 70.5 mtt180 -149.19 38.36 0.8 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.151 -1.205 . . . . 0.0 109.576 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.574 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . 170.0 134.2 1.71 Allowed Glycine 0 N--CA 1.488 2.147 0 C-N-CA 119.957 -1.116 . . . . 0.0 110.447 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.544 ' HD3' ' CE1' ' A' ' 29' ' ' TYR . 40.8 tttp -158.42 149.07 20.32 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.44 -1.035 . . . . 0.0 109.147 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.483 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 99.5 m -82.89 77.48 9.63 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.165 -0.96 . . . . 0.0 109.617 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.544 ' CE1' ' HD3' ' A' ' 27' ' ' LYS . 35.8 m-85 -64.52 113.82 3.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.04 -1.038 . . . . 0.0 109.289 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 54.74 -139.99 38.71 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -87.39 35.37 0.44 Allowed 'Trans proline' 0 C--N 1.303 -1.816 0 O-C-N 124.032 1.543 . . . . 0.0 110.251 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -148.86 138.78 22.11 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.207 -0.933 . . . . 0.0 109.601 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.483 ' HA ' ' HA ' ' A' ' 28' ' ' CYS . 6.8 t -101.71 120.4 40.29 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.283 -0.885 . . . . 0.0 109.563 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.5 mt -122.9 -164.71 1.22 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.285 -0.885 . . . . 0.0 109.757 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.574 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 34.9 m -106.52 -175.26 2.75 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.421 -0.799 . . . . 0.0 109.434 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.436 ' OXT' ' HG3' ' A' ' 36' ' ' ARG . 18.8 tpt180 . . . . . 0 C--N 1.305 -1.328 0 CA-C-O 118.083 -0.961 . . . . 0.0 109.619 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.45 ' SD ' ' HA ' ' A' ' 32' ' ' GLN . 3.7 ptt? . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.447 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 3.9 t -105.7 120.11 40.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.112 -0.993 . . . . 0.0 109.528 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.561 ' HG3' ' HD2' ' A' ' 4' ' ' PRO . 4.6 tpt 60.14 168.93 0.08 OUTLIER Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.223 -0.923 . . . . 0.0 109.726 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.561 ' HD2' ' HG3' ' A' ' 3' ' ' MET . 36.7 Cg_endo -119.61 89.09 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 O-C-N 124.111 1.585 . . . . 0.0 110.394 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.42 ' O ' ' O ' ' A' ' 4' ' ' PRO . 91.9 m -50.53 177.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.04 -1.037 . . . . 0.0 109.268 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.45 ' O ' ' HB ' ' A' ' 7' ' ' THR . 27.8 m-85 53.26 -174.24 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.155 -0.966 . . . . 0.0 109.473 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.515 ' O ' ' CG2' ' A' ' 7' ' ' THR . 52.7 m 60.63 14.29 4.86 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.221 -0.925 . . . . 0.0 109.427 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.467 ' OG1' ' N ' ' A' ' 9' ' ' ASP . 0.1 OUTLIER 178.15 175.66 0.51 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.254 -0.904 . . . . 0.0 109.544 179.969 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.567 ' O ' ' CG ' ' A' ' 10' ' ' HIS . 0.2 OUTLIER -167.26 75.39 0.15 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.493 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.567 ' CG ' ' O ' ' A' ' 9' ' ' ASP . 80.5 m80 -159.89 56.98 0.37 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.241 -0.912 . . . . 0.0 109.606 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.511 ' CB ' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER 76.28 65.25 0.05 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -0.917 . . . . 0.0 109.28 -179.991 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -127.68 -56.55 1.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.171 -0.956 . . . . 0.0 109.518 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.423 ' HA ' ' HB2' ' A' ' 16' ' ' CYS . . . -67.69 -9.27 42.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.322 -0.861 . . . . 0.0 109.896 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.461 ' HD3' ' HG2' ' A' ' 11' ' ' GLN . 4.5 mtp180 -67.83 -33.78 75.45 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.143 -0.973 . . . . 0.0 109.55 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.74 -22.13 18.9 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.193 -0.942 . . . . 0.0 109.883 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -50.02 -58.92 4.47 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.21 -0.931 . . . . 0.0 109.56 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.587 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 8.0 t0 -57.62 -52.64 64.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.915 . . . . 0.0 109.168 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.422 ' HA ' ' HA2' ' A' ' 22' ' ' GLY . 0.2 OUTLIER -48.0 -26.63 1.85 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 109.064 179.712 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.1 t -62.07 -50.06 73.48 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 1.4 m -68.96 -30.4 68.82 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.658 -0.651 . . . . 0.0 110.271 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 177.72 -69.38 0.08 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.686 -1.366 . . . . 0.0 109.686 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.456 ' O ' ' N ' ' A' ' 24' ' ' GLY . . . 176.75 178.85 46.83 Favored Glycine 0 N--CA 1.485 1.956 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 22' ' ' GLY . 29.1 mtmm -44.25 98.5 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -1.127 . . . . 0.0 109.497 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 22' ' ' GLY . . . 128.32 7.84 4.27 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 119.821 -1.18 . . . . 0.0 110.183 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.524 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 12.0 mtt180 -146.99 40.39 1.06 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.059 -1.259 . . . . 0.0 109.561 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.642 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -166.86 150.99 18.64 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -162.74 131.08 3.92 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.473 -1.016 . . . . 0.0 109.247 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 63.9 m -80.33 82.54 6.35 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -80.95 114.71 20.01 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.883 -1.135 . . . . 0.0 108.771 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 56.38 -131.04 50.62 Favored Glycine 0 N--CA 1.488 2.133 0 N-CA-C 108.978 -1.649 . . . . 0.0 108.978 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -95.69 -1.77 2.19 Favored 'Trans proline' 0 C--N 1.301 -1.965 0 O-C-N 124.14 1.6 . . . . 0.0 110.392 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.45 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 69.3 mt-30 -99.43 117.23 33.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.203 -0.935 . . . . 0.0 110.357 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.1 t -92.44 107.03 18.91 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.395 -0.816 . . . . 0.0 108.869 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.3 mt -123.25 -161.3 0.96 Allowed 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.175 -0.953 . . . . 0.0 109.816 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.642 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 10.7 m -82.72 -168.98 2.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.447 -0.783 . . . . 0.0 109.774 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.0 ttt-85 . . . . . 0 C--N 1.304 -1.389 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.405 -179.962 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.468 ' HG2' ' OE1' ' A' ' 32' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.269 0.557 . . . . 0.0 109.633 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.463 ' O ' ' CB ' ' A' ' 33' ' ' CYS . 5.3 t -121.54 118.39 29.16 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 109.811 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.578 ' HG3' ' HD2' ' A' ' 4' ' ' PRO . 1.9 tpp 56.61 163.78 0.07 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.278 -0.888 . . . . 0.0 109.624 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.578 ' HD2' ' HG3' ' A' ' 3' ' ' MET . 35.6 Cg_endo -109.98 -159.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 O-C-N 124.174 1.618 . . . . 0.0 110.136 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -147.72 132.2 17.68 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.304 -0.873 . . . . 0.0 109.493 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.471 ' O ' ' C ' ' A' ' 7' ' ' THR . 97.2 m-85 -107.42 86.26 2.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.234 -0.916 . . . . 0.0 109.605 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.484 ' O ' ' N ' ' A' ' 9' ' ' ASP . 3.1 m 37.98 -132.1 0.15 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.737 -0.602 . . . . 0.0 109.795 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.476 ' O ' ' CB ' ' A' ' 9' ' ' ASP . 2.2 p 48.87 -94.33 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.793 -1.192 . . . . 0.0 109.528 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.484 ' N ' ' O ' ' A' ' 7' ' ' THR . 0.3 OUTLIER 73.62 73.69 0.13 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.187 -0.946 . . . . 0.0 109.526 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 m80 -139.56 -54.91 0.56 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.209 -0.932 . . . . 0.0 109.436 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.14 14.7 1.48 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.302 -0.874 . . . . 0.0 109.386 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.429 ' HE2' ' HB3' ' A' ' 12' ' ' MET . 3.6 tmm? -87.36 -52.92 5.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.282 -0.886 . . . . 0.0 109.321 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.83 -13.13 9.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.484 -0.76 . . . . 0.0 109.822 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.26 -33.02 5.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.227 -0.921 . . . . 0.0 109.335 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.417 ' HE2' ' SD ' ' A' ' 12' ' ' MET . 0.0 OUTLIER -89.31 -34.34 16.61 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.349 -0.844 . . . . 0.0 110.021 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.42 -46.54 37.62 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.067 -1.021 . . . . 0.0 109.061 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.605 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 23.3 t0 -60.59 -48.92 79.65 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.479 -0.763 . . . . 0.0 109.236 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.447 ' HA ' ' HA2' ' A' ' 22' ' ' GLY . 0.4 OUTLIER -52.91 -32.32 44.7 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.533 -0.729 . . . . 0.0 110.156 -179.415 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 27.2 t -60.23 -55.59 31.83 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.139 -0.976 . . . . 0.0 109.126 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.556 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 61.5 m -54.93 -21.88 13.15 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.462 -0.774 . . . . 0.0 109.677 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.457 ' HA3' ' HD2' ' A' ' 25' ' ' ARG . . . 159.0 -57.52 0.34 Allowed Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.401 -1.479 . . . . 0.0 109.401 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.47 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . 138.86 -177.12 20.45 Favored Glycine 0 N--CA 1.483 1.792 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 22' ' ' GLY . 1.0 OUTLIER 67.98 -83.84 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.42 -1.047 . . . . 0.0 109.803 179.861 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.49 ' HA2' ' OD2' ' A' ' 17' ' ' ASP . . . -162.94 47.66 0.32 Allowed Glycine 0 N--CA 1.493 2.455 0 C-N-CA 119.642 -1.266 . . . . 0.0 110.29 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -120.63 37.29 4.32 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.916 -1.344 . . . . 0.0 110.121 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.605 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . -174.42 130.55 1.81 Allowed Glycine 0 N--CA 1.488 2.144 0 C-N-CA 119.951 -1.119 . . . . 0.0 110.418 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.451 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -151.68 -159.21 0.99 Allowed 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.539 -0.977 . . . . 0.0 109.214 -179.771 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.0 m -121.12 93.76 4.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.22 -0.925 . . . . 0.0 109.731 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -95.52 111.98 23.79 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.712 -1.243 . . . . 0.0 109.587 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 75.63 -131.48 12.09 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -106.06 30.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.303 -1.817 0 O-C-N 124.093 1.575 . . . . 0.0 110.421 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.468 ' OE1' ' HG2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -149.87 156.84 42.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.882 . . . . 0.0 109.571 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 3' ' ' MET . 8.4 t -99.42 122.72 42.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 0.0 109.318 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.9 mt -113.67 -166.84 1.13 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.233 -0.917 . . . . 0.0 109.52 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.578 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 92.7 m -117.25 -166.69 1.21 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.26 -0.9 . . . . 0.0 109.514 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.45 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.557 ' O ' ' CG ' ' A' ' 3' ' ' MET . 1.7 t -128.39 81.76 2.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.265 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.557 ' CG ' ' O ' ' A' ' 2' ' ' CYS . 1.2 ptm 84.47 178.65 0.04 OUTLIER Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.73 -0.606 . . . . 0.0 109.51 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -89.83 -180.0 1.97 Allowed 'Trans proline' 0 C--N 1.302 -1.877 0 O-C-N 124.213 1.638 . . . . 0.0 110.664 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.86 51.91 1.71 Allowed 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.316 -0.865 . . . . 0.0 109.374 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -151.64 84.12 1.29 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.221 -0.924 . . . . 0.0 109.473 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.91 -78.13 0.58 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.255 -0.903 . . . . 0.0 109.48 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.6 t -153.84 170.44 20.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.39 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.524 ' O ' ' CD2' ' A' ' 10' ' ' HIS . 0.4 OUTLIER -87.29 79.06 8.63 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.948 . . . . 0.0 109.491 -179.939 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.524 ' CD2' ' O ' ' A' ' 9' ' ' ASP . 7.2 m170 -153.76 59.46 0.74 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.334 -0.854 . . . . 0.0 109.106 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.429 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER 68.23 40.49 2.11 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.339 -0.851 . . . . 0.0 109.199 -179.586 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -50.74 72.27 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.332 -0.855 . . . . 0.0 109.253 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.489 ' HA ' ' HB3' ' A' ' 16' ' ' CYS . . . -61.84 -11.74 14.16 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.502 -0.749 . . . . 0.0 109.76 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.429 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -62.4 -24.07 67.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.103 -0.998 . . . . 0.0 109.362 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.479 ' O ' ' HB2' ' A' ' 19' ' ' CYS . 0.5 OUTLIER -107.93 -13.42 14.98 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.317 -0.864 . . . . 0.0 109.378 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.489 ' HB3' ' HA ' ' A' ' 13' ' ' ALA . 4.7 t -86.67 -21.43 26.71 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.233 -0.917 . . . . 0.0 108.722 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.601 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 34.3 t0 -88.06 -50.3 6.49 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.5 -33.43 73.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.543 -0.723 . . . . 0.0 109.528 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 15' ' ' LYS . 1.5 t -55.67 -33.43 64.11 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 71.1 m -73.38 -30.74 63.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.728 -0.607 . . . . 0.0 109.576 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.19 -42.7 0.47 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.41 162.86 27.89 Favored Glycine 0 N--CA 1.488 2.102 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.408 ' HA ' ' OD2' ' A' ' 17' ' ' ASP . 0.8 OUTLIER -52.79 110.46 0.52 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.188 -1.184 . . . . 0.0 109.361 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.95 -8.01 3.27 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.537 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -146.9 39.96 1.05 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.207 -1.173 . . . . 0.0 110.039 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.601 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . -175.09 136.48 3.44 Favored Glycine 0 N--CA 1.49 2.235 0 C-N-CA 119.752 -1.214 . . . . 0.0 110.663 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.457 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -164.02 -179.43 6.22 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.55 -0.97 . . . . 0.0 109.045 -179.79 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.1 m -90.92 123.47 34.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.024 -1.048 . . . . 0.0 109.274 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.519 ' CB ' HD13 ' A' ' 34' ' ' LEU . 18.5 m-85 -146.9 155.57 42.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.505 -1.372 . . . . 0.0 109.317 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 53.25 -133.54 42.01 Favored Glycine 0 N--CA 1.486 2.013 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -113.24 38.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 123.928 1.488 . . . . 0.0 110.596 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.41 176.52 2.82 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.172 -0.955 . . . . 0.0 110.173 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.3 t -82.48 124.02 29.69 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.486 -0.758 . . . . 0.0 109.44 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.519 HD13 ' CB ' ' A' ' 29' ' ' TYR . 13.0 mt -104.01 -175.91 2.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.142 -0.974 . . . . 0.0 109.916 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.578 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 86.8 m -138.74 -162.88 1.37 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.413 -0.805 . . . . 0.0 109.319 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.481 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 3.7 tpt180 . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.362 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.7 t -104.66 -65.95 1.0 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.327 -0.858 . . . . 0.0 109.414 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.517 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -168.02 -170.15 0.21 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.277 -0.889 . . . . 0.0 109.096 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.517 ' HD2' ' HB2' ' A' ' 3' ' ' MET . 36.6 Cg_endo -97.06 -169.26 0.13 Allowed 'Trans proline' 0 C--N 1.308 -1.602 0 O-C-N 123.703 1.37 . . . . 0.0 110.386 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.509 ' O ' ' CG ' ' A' ' 6' ' ' PHE . 37.2 m -128.52 67.5 1.38 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.288 -0.882 . . . . 0.0 109.578 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.509 ' CG ' ' O ' ' A' ' 5' ' ' CYS . 95.0 m-85 -156.8 62.19 0.52 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.103 -0.998 . . . . 0.0 109.803 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.39 -69.81 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.312 -0.867 . . . . 0.0 109.054 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.454 HG21 ' SD ' ' A' ' 12' ' ' MET . 9.9 t -100.2 170.94 8.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.395 -0.815 . . . . 0.0 109.255 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.411 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 0.9 OUTLIER -116.96 162.2 18.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.291 -0.88 . . . . 0.0 109.444 179.886 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.498 ' O ' ' CG ' ' A' ' 11' ' ' GLN . 21.5 m170 49.1 23.31 0.73 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.322 -0.861 . . . . 0.0 109.433 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.498 ' CG ' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER -169.81 42.63 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.361 -0.837 . . . . 0.0 109.242 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.514 ' HE3' ' CE ' ' A' ' 3' ' ' MET . 5.5 tpt -119.12 -57.12 2.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.345 -0.847 . . . . 0.0 109.535 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.25 -5.38 22.55 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.424 -0.798 . . . . 0.0 109.9 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.62 4.7 48.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.068 -1.02 . . . . 0.0 109.484 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.466 ' HD2' ' O ' ' A' ' 11' ' ' GLN . 12.7 mtpt -112.7 -29.48 7.42 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.181 -0.949 . . . . 0.0 109.471 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.433 ' SG ' ' C ' ' A' ' 27' ' ' LYS . 3.4 t -67.54 -52.92 33.17 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.222 -0.924 . . . . 0.0 108.601 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.559 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 26.9 t0 -61.38 -47.51 85.49 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.386 -0.821 . . . . 0.0 109.034 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.86 -31.24 69.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.41 -0.806 . . . . 0.0 109.738 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.81 -40.23 87.71 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.359 -0.838 . . . . 0.0 109.291 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.473 ' SG ' ' O ' ' A' ' 25' ' ' ARG . 27.5 m -56.9 -31.64 65.09 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.475 -0.766 . . . . 0.0 109.994 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 119.13 4.05 12.67 Favored Glycine 0 N--CA 1.493 2.434 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.394 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.509 ' HA3' ' CG ' ' A' ' 25' ' ' ARG . . . -140.49 168.41 25.2 Favored Glycine 0 N--CA 1.485 1.965 0 O-C-N 121.032 -1.275 . . . . 0.0 110.009 179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.409 ' O ' ' HG2' ' A' ' 23' ' ' LYS . 7.6 ttpm? -87.65 14.65 8.04 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.335 -1.097 . . . . 0.0 109.576 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.443 ' HA2' ' OD2' ' A' ' 17' ' ' ASP . . . -166.07 21.79 0.12 Allowed Glycine 0 N--CA 1.49 2.282 0 C-N-CA 119.544 -1.312 . . . . 0.0 110.634 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.509 ' CG ' ' HA3' ' A' ' 22' ' ' GLY . 1.2 ptp180 -117.24 39.03 3.37 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.618 -1.519 . . . . 0.0 110.083 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.559 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . -174.01 153.16 16.3 Favored Glycine 0 N--CA 1.491 2.306 0 C-N-CA 119.901 -1.142 . . . . 0.0 110.597 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.433 ' C ' ' SG ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -178.23 143.2 0.28 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.421 -1.047 . . . . 0.0 109.381 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 1.7 m -59.11 87.56 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 109.792 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.42 ' O ' ' C ' ' A' ' 30' ' ' GLY . 13.5 m-85 -97.59 164.97 12.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.859 -1.151 . . . . 0.0 109.065 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 29' ' ' TYR . . . 45.19 -129.43 8.39 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -108.34 10.92 0.13 Allowed 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 123.954 1.502 . . . . 0.0 110.426 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -147.88 159.25 44.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.141 -0.974 . . . . 0.0 110.098 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 28' ' ' CYS . 6.0 t -82.16 122.68 28.18 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.432 -0.793 . . . . 0.0 109.597 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.6 mt -127.64 -171.28 2.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.296 -0.877 . . . . 0.0 109.163 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.536 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 86.8 m -107.28 174.3 5.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -0.933 . . . . 0.0 109.609 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.476 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ptp . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.407 ' O ' ' C ' ' A' ' 3' ' ' MET . 1.9 t -110.1 -178.51 3.53 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.271 -0.893 . . . . 0.0 109.499 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.54 ' HE1' ' HE2' ' A' ' 12' ' ' MET . 3.0 ptt? -44.77 155.45 0.39 Allowed Pre-proline 0 N--CA 1.488 1.455 0 O-C-N 121.228 -0.92 . . . . 0.0 109.363 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.505 ' HD2' ' HB2' ' A' ' 3' ' ' MET . 36.4 Cg_endo -57.53 -162.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.801 0 O-C-N 124.051 1.553 . . . . 0.0 110.214 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.515 ' O ' ' CD1' ' A' ' 6' ' ' PHE . 1.1 m -134.35 70.98 1.44 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.27 -0.893 . . . . 0.0 109.604 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.515 ' CD1' ' O ' ' A' ' 5' ' ' CYS . 30.1 m-85 -150.85 40.85 0.74 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.37 -0.831 . . . . 0.0 109.239 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.18 148.51 50.61 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.287 -0.883 . . . . 0.0 109.524 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.3 p 49.91 -160.91 0.06 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.316 -0.865 . . . . 0.0 109.732 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.0 -44.35 0.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.355 -0.841 . . . . 0.0 109.237 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.464 ' O ' ' NH2' ' A' ' 14' ' ' ARG . 2.7 m-70 -88.99 3.83 50.29 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.403 -0.811 . . . . 0.0 109.539 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -154.96 58.06 0.67 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.225 -0.922 . . . . 0.0 109.616 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.54 ' HE2' ' HE1' ' A' ' 3' ' ' MET . 0.0 OUTLIER -111.1 -53.98 2.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.267 -0.896 . . . . 0.0 109.189 179.828 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.19 7.29 9.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.478 -0.764 . . . . 0.0 109.664 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.464 ' NH2' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER -79.96 -12.56 59.71 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.176 -0.952 . . . . 0.0 109.584 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.2 -12.89 4.53 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.118 -0.989 . . . . 0.0 110.221 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -63.19 1.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.983 -1.073 . . . . 0.0 109.077 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.58 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 13.9 t0 -49.6 -46.48 49.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.361 -0.837 . . . . 0.0 109.372 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -60.99 -37.48 82.64 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.453 -0.779 . . . . 0.0 110.034 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.2 t -51.16 -41.87 60.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.098 -1.001 . . . . 0.0 109.226 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.499 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 1.7 m -80.51 -34.55 35.56 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.47 -0.769 . . . . 0.0 110.117 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 171.3 -52.56 0.18 Allowed Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.481 ' O ' ' CD ' ' A' ' 25' ' ' ARG . . . 115.0 170.31 16.32 Favored Glycine 0 N--CA 1.483 1.791 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 10.5 tttt 71.44 28.61 2.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.304 -1.115 . . . . 0.0 109.642 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.474 ' O ' ' HB2' ' A' ' 36' ' ' ARG . . . 88.89 20.92 44.74 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.505 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 0.9 OUTLIER -103.6 33.6 3.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.21 -1.171 . . . . 0.0 109.493 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.58 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . 174.64 127.17 0.99 Allowed Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -146.13 -175.7 4.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.159 -1.201 . . . . 0.0 110.006 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.4 m -92.71 98.4 11.39 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.529 -0.732 . . . . 0.0 109.738 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -95.12 99.83 11.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.637 -1.29 . . . . 0.0 109.558 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 55.68 -127.73 43.18 Favored Glycine 0 N--CA 1.488 2.113 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -97.8 40.44 0.1 OUTLIER 'Trans proline' 0 C--N 1.301 -1.952 0 O-C-N 124.221 1.643 . . . . 0.0 110.299 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -160.41 123.88 3.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.252 -0.905 . . . . 0.0 109.785 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.449 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 13.3 t -86.99 123.73 32.41 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.295 -0.878 . . . . 0.0 108.826 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.469 ' O ' ' HA2' ' A' ' 26' ' ' GLY . 2.1 mt -133.89 -178.67 5.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.004 -1.06 . . . . 0.0 110.077 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.506 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 4.3 m -88.73 176.4 7.1 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.461 -0.774 . . . . 0.0 109.365 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.505 ' HB2' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 118.006 -0.997 . . . . 0.0 109.515 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.62 ' HB3' HD23 ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.7 t -120.72 -31.39 4.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.198 -0.939 . . . . 0.0 109.873 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.534 ' CB ' ' CD ' ' A' ' 4' ' ' PRO . 2.0 ptm -177.0 -172.3 0.15 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.206 -0.934 . . . . 0.0 109.294 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' A' ' 3' ' ' MET . 36.1 Cg_endo -85.37 -164.85 0.25 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 123.85 1.447 . . . . 0.0 110.015 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.401 ' O ' ' CD1' ' A' ' 6' ' ' PHE . 1.3 m -132.87 179.11 6.37 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.17 -0.956 . . . . 0.0 109.922 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.401 ' CD1' ' O ' ' A' ' 5' ' ' CYS . 34.5 m-85 -149.41 -168.67 3.17 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.399 -0.813 . . . . 0.0 109.419 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.662 ' C ' HG23 ' A' ' 8' ' ' THR . 0.0 OUTLIER -128.58 -171.78 2.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 109.72 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.662 HG23 ' C ' ' A' ' 7' ' ' THR . 1.2 p 67.3 171.98 0.26 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.335 -0.853 . . . . 0.0 109.456 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -89.95 95.26 10.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.272 -0.892 . . . . 0.0 109.468 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 4.5 m170 -126.63 -4.3 6.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.226 -0.921 . . . . 0.0 109.576 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.469 ' HB2' ' O ' ' A' ' 10' ' ' HIS . 41.5 mt-30 63.18 54.54 2.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.203 -0.936 . . . . 0.0 109.513 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.47 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 2.1 tmm? -120.45 -58.3 1.85 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.361 -0.837 . . . . 0.0 109.428 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.75 -11.25 11.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.362 -0.836 . . . . 0.0 110.064 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.24 -27.59 27.83 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.104 -0.998 . . . . 0.0 109.968 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.486 ' HG3' ' N ' ' A' ' 16' ' ' CYS . 4.8 ptmm? -84.68 -32.81 23.39 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 120.976 -1.078 . . . . 0.0 109.738 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.486 ' N ' ' HG3' ' A' ' 15' ' ' LYS . 39.6 t -47.39 -53.95 12.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 109.61 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.59 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 48.5 t0 -44.41 -52.78 7.48 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.172 -0.955 . . . . 0.0 109.249 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -48.86 -43.73 39.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.441 -0.787 . . . . 0.0 109.38 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -49.45 -45.83 47.08 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.532 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 54.3 m -58.2 -38.54 76.94 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.87 -0.518 . . . . 0.0 109.641 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 165.78 -44.73 0.28 Allowed Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.486 -1.445 . . . . 0.0 109.486 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.476 ' O ' ' OD1' ' A' ' 17' ' ' ASP . . . -177.8 176.74 48.18 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.96 -1.656 . . . . 0.0 108.96 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 pttm -60.3 149.42 33.55 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.881 -1.364 . . . . 0.0 109.451 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 80.76 12.48 82.73 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.532 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -148.65 37.09 0.81 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.88 -1.365 . . . . 0.0 109.835 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.59 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . 167.59 143.02 3.64 Favored Glycine 0 N--CA 1.49 2.28 0 C-N-CA 119.761 -1.209 . . . . 0.0 110.327 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.46 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 0.2 OUTLIER 171.44 -169.82 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.138 -1.213 . . . . 0.0 109.333 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.4 m -74.57 80.18 1.98 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.292 -0.88 . . . . 0.0 109.514 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -98.35 138.88 34.95 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.984 -1.073 . . . . 0.0 109.0 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 69.46 -138.21 30.19 Favored Glycine 0 N--CA 1.485 1.952 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.477 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 35.6 Cg_endo -94.63 3.2 2.71 Favored 'Trans proline' 0 C--N 1.302 -1.92 0 O-C-N 123.961 1.506 . . . . 0.0 110.315 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 31' ' ' PRO . 8.7 mt-30 -145.24 -159.39 1.0 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.264 -0.897 . . . . 0.0 109.656 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 3' ' ' MET . 8.0 t -108.79 103.73 12.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.222 -0.923 . . . . 0.0 109.684 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.62 HD23 ' HB3' ' A' ' 1' ' ' MET . 6.4 mt -109.1 -172.15 1.99 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.371 -0.831 . . . . 0.0 109.531 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.542 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 66.1 m -106.61 170.7 7.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.31 -0.869 . . . . 0.0 109.47 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.459 ' O ' ' O ' ' A' ' 35' ' ' CYS . 1.6 mtp85 . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 118.05 -0.976 . . . . 0.0 109.671 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.29 0.567 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.8 t -112.23 -120.02 0.29 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.168 -0.958 . . . . 0.0 109.485 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.595 ' CB ' ' CD ' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -102.52 -154.77 0.02 OUTLIER Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 120.718 -1.239 . . . . 0.0 109.358 -179.799 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.595 ' CD ' ' CB ' ' A' ' 3' ' ' MET . 36.6 Cg_endo -109.07 -160.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.51 0 O-C-N 123.702 1.369 . . . . 0.0 110.456 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.479 ' HB2' ' HB3' ' A' ' 28' ' ' CYS . 1.4 m -158.51 178.87 9.67 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.282 -0.886 . . . . 0.0 109.647 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -112.43 -164.62 0.93 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.429 -0.794 . . . . 0.0 109.158 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.467 ' O ' HG23 ' A' ' 8' ' ' THR . 0.9 OUTLIER -111.81 17.44 19.8 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.31 -0.869 . . . . 0.0 109.127 179.6 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.474 ' O ' ' HB2' ' A' ' 9' ' ' ASP . 1.3 p -154.94 -166.06 2.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.32 -0.863 . . . . 0.0 109.326 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 8' ' ' THR . 0.2 OUTLIER 72.22 160.75 0.23 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.107 -0.996 . . . . 0.0 109.592 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.9 m80 -121.13 -25.89 5.21 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -0.919 . . . . 0.0 109.664 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.73 12.57 8.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.177 -0.952 . . . . 0.0 109.536 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.451 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 9.0 tpt -80.15 -67.22 0.79 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.213 -0.929 . . . . 0.0 109.277 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.35 -9.08 15.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.592 -0.692 . . . . 0.0 109.96 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -28.08 66.81 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.958 -1.089 . . . . 0.0 109.679 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.0 -41.23 9.25 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.18 -0.95 . . . . 0.0 109.256 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -51.32 70.25 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.24 -0.912 . . . . 0.0 108.962 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.557 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 58.2 t0 -50.84 -53.33 33.1 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.52 -34.8 59.46 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.3 t -49.62 -43.72 46.87 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 1.6 m -79.51 -32.0 42.27 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.542 -0.724 . . . . 0.0 110.128 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.66 -66.9 0.09 OUTLIER Glycine 0 N--CA 1.491 2.34 0 C-N-CA 119.653 -1.26 . . . . 0.0 110.018 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.469 ' O ' ' OD1' ' A' ' 17' ' ' ASP . . . -178.91 -171.71 42.43 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.703 -1.359 . . . . 0.0 109.703 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.2 mtmt -55.41 120.84 7.75 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.296 -1.12 . . . . 0.0 109.636 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.415 ' C ' ' HG3' ' A' ' 25' ' ' ARG . . . 97.45 11.57 51.03 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.415 ' HG3' ' C ' ' A' ' 24' ' ' GLY . 70.5 mtt180 -149.19 38.36 0.8 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.151 -1.205 . . . . 0.0 109.576 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.611 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . 170.0 134.2 1.71 Allowed Glycine 0 N--CA 1.488 2.147 0 C-N-CA 119.957 -1.116 . . . . 0.0 110.447 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.543 ' HD3' ' CE1' ' A' ' 29' ' ' TYR . 40.8 tttp -158.42 149.07 20.32 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.44 -1.035 . . . . 0.0 109.147 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 99.5 m -82.89 77.48 9.63 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.165 -0.96 . . . . 0.0 109.617 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.543 ' CE1' ' HD3' ' A' ' 27' ' ' LYS . 35.8 m-85 -64.52 113.82 3.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.04 -1.038 . . . . 0.0 109.289 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 54.74 -139.99 38.71 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -87.39 35.37 0.44 Allowed 'Trans proline' 0 C--N 1.303 -1.816 0 O-C-N 124.032 1.543 . . . . 0.0 110.251 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -148.86 138.78 22.11 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.207 -0.933 . . . . 0.0 109.601 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 28' ' ' CYS . 6.8 t -101.71 120.4 40.29 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.283 -0.885 . . . . 0.0 109.563 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.422 HD12 ' HD2' ' A' ' 29' ' ' TYR . 48.5 mt -122.9 -164.71 1.22 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.285 -0.885 . . . . 0.0 109.757 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.611 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 34.9 m -106.52 -175.26 2.75 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.421 -0.799 . . . . 0.0 109.434 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.417 ' OXT' ' HG3' ' A' ' 36' ' ' ARG . 18.8 tpt180 . . . . . 0 C--N 1.305 -1.328 0 CA-C-O 118.083 -0.961 . . . . 0.0 109.619 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.461 ' SD ' ' HA ' ' A' ' 32' ' ' GLN . 3.7 ptt? . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.447 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 3.9 t -105.7 120.11 40.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.112 -0.993 . . . . 0.0 109.528 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.549 ' HG3' ' HD2' ' A' ' 4' ' ' PRO . 4.6 tpt 60.14 168.93 0.08 OUTLIER Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.223 -0.923 . . . . 0.0 109.726 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.549 ' HD2' ' HG3' ' A' ' 3' ' ' MET . 36.7 Cg_endo -119.61 89.09 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 O-C-N 124.111 1.585 . . . . 0.0 110.394 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.42 ' O ' ' O ' ' A' ' 4' ' ' PRO . 91.9 m -50.53 177.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.04 -1.037 . . . . 0.0 109.268 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.455 ' O ' ' HB ' ' A' ' 7' ' ' THR . 27.8 m-85 53.26 -174.24 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.155 -0.966 . . . . 0.0 109.473 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.73 HG22 ' O ' ' A' ' 7' ' ' THR . 52.7 m 60.63 14.29 4.86 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.221 -0.925 . . . . 0.0 109.427 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.631 HG22 ' C ' ' A' ' 7' ' ' THR . 0.1 OUTLIER 178.15 175.66 0.51 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.254 -0.904 . . . . 0.0 109.544 179.969 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.567 ' O ' ' CG ' ' A' ' 10' ' ' HIS . 0.2 OUTLIER -167.26 75.39 0.15 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.493 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.567 ' CG ' ' O ' ' A' ' 9' ' ' ASP . 80.5 m80 -159.89 56.98 0.37 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.241 -0.912 . . . . 0.0 109.606 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.511 ' CB ' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER 76.28 65.25 0.05 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -0.917 . . . . 0.0 109.28 -179.991 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.416 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 0.5 OUTLIER -127.68 -56.55 1.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.171 -0.956 . . . . 0.0 109.518 -179.848 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.445 ' HA ' ' HB2' ' A' ' 16' ' ' CYS . . . -67.69 -9.27 42.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.322 -0.861 . . . . 0.0 109.896 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.483 ' HD3' ' HG2' ' A' ' 11' ' ' GLN . 4.5 mtp180 -67.83 -33.78 75.45 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.143 -0.973 . . . . 0.0 109.55 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 12' ' ' MET . 0.1 OUTLIER -93.74 -22.13 18.9 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.193 -0.942 . . . . 0.0 109.883 -179.69 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -50.02 -58.92 4.47 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.21 -0.931 . . . . 0.0 109.56 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.621 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 8.0 t0 -57.62 -52.64 64.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.915 . . . . 0.0 109.168 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.425 ' HA ' ' HA2' ' A' ' 22' ' ' GLY . 0.2 OUTLIER -48.0 -26.63 1.85 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 109.064 179.712 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.1 t -62.07 -50.06 73.48 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 1.4 m -68.96 -30.4 68.82 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.658 -0.651 . . . . 0.0 110.271 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 177.72 -69.38 0.08 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.686 -1.366 . . . . 0.0 109.686 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.456 ' O ' ' N ' ' A' ' 24' ' ' GLY . . . 176.75 178.85 46.83 Favored Glycine 0 N--CA 1.485 1.956 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 22' ' ' GLY . 29.1 mtmm -44.25 98.5 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -1.127 . . . . 0.0 109.497 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 22' ' ' GLY . . . 128.32 7.84 4.27 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 119.821 -1.18 . . . . 0.0 110.183 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.524 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 12.0 mtt180 -146.99 40.39 1.06 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.059 -1.259 . . . . 0.0 109.561 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.679 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -166.86 150.99 18.64 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -162.74 131.08 3.92 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.473 -1.016 . . . . 0.0 109.247 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 63.9 m -80.33 82.54 6.35 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -80.95 114.71 20.01 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.883 -1.135 . . . . 0.0 108.771 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 56.38 -131.04 50.62 Favored Glycine 0 N--CA 1.488 2.133 0 N-CA-C 108.978 -1.649 . . . . 0.0 108.978 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -95.69 -1.77 2.19 Favored 'Trans proline' 0 C--N 1.301 -1.965 0 O-C-N 124.14 1.6 . . . . 0.0 110.392 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.461 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 69.3 mt-30 -99.43 117.23 33.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.203 -0.935 . . . . 0.0 110.357 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.1 t -92.44 107.03 18.91 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.395 -0.816 . . . . 0.0 108.869 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.3 mt -123.25 -161.3 0.96 Allowed 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.175 -0.953 . . . . 0.0 109.816 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.679 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 10.7 m -82.72 -168.98 2.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.447 -0.783 . . . . 0.0 109.774 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.0 ttt-85 . . . . . 0 C--N 1.304 -1.389 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.405 -179.962 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.461 ' HG2' ' OE1' ' A' ' 32' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.269 0.557 . . . . 0.0 109.633 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.463 ' O ' ' CB ' ' A' ' 33' ' ' CYS . 5.3 t -121.54 118.39 29.16 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 109.811 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.57 ' HG3' ' HD2' ' A' ' 4' ' ' PRO . 1.9 tpp 56.61 163.78 0.07 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.278 -0.888 . . . . 0.0 109.624 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.57 ' HD2' ' HG3' ' A' ' 3' ' ' MET . 35.6 Cg_endo -109.98 -159.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 O-C-N 124.174 1.618 . . . . 0.0 110.136 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -147.72 132.2 17.68 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.304 -0.873 . . . . 0.0 109.493 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.471 ' O ' ' C ' ' A' ' 7' ' ' THR . 97.2 m-85 -107.42 86.26 2.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.234 -0.916 . . . . 0.0 109.605 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.484 ' O ' ' N ' ' A' ' 9' ' ' ASP . 3.1 m 37.98 -132.1 0.15 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.737 -0.602 . . . . 0.0 109.795 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.476 ' O ' ' CB ' ' A' ' 9' ' ' ASP . 2.2 p 48.87 -94.33 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.793 -1.192 . . . . 0.0 109.528 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.484 ' N ' ' O ' ' A' ' 7' ' ' THR . 0.3 OUTLIER 73.62 73.69 0.13 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.187 -0.946 . . . . 0.0 109.526 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 m80 -139.56 -54.91 0.56 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.209 -0.932 . . . . 0.0 109.436 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.14 14.7 1.48 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.302 -0.874 . . . . 0.0 109.386 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.442 ' SD ' ' HE2' ' A' ' 15' ' ' LYS . 3.6 tmm? -87.36 -52.92 5.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.282 -0.886 . . . . 0.0 109.321 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.83 -13.13 9.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.484 -0.76 . . . . 0.0 109.822 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.26 -33.02 5.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.227 -0.921 . . . . 0.0 109.335 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.442 ' HE2' ' SD ' ' A' ' 12' ' ' MET . 0.0 OUTLIER -89.31 -34.34 16.61 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.349 -0.844 . . . . 0.0 110.021 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.42 -46.54 37.62 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.067 -1.021 . . . . 0.0 109.061 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.618 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 23.3 t0 -60.59 -48.92 79.65 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.479 -0.763 . . . . 0.0 109.236 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.468 ' HA ' ' HA2' ' A' ' 22' ' ' GLY . 0.4 OUTLIER -52.91 -32.32 44.7 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.533 -0.729 . . . . 0.0 110.156 -179.415 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 27.2 t -60.23 -55.59 31.83 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.139 -0.976 . . . . 0.0 109.126 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.556 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 61.5 m -54.93 -21.88 13.15 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.462 -0.774 . . . . 0.0 109.677 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.442 ' HA3' ' HD2' ' A' ' 25' ' ' ARG . . . 159.0 -57.52 0.34 Allowed Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.401 -1.479 . . . . 0.0 109.401 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.491 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . 138.86 -177.12 20.45 Favored Glycine 0 N--CA 1.483 1.792 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.481 ' HB3' ' O ' ' A' ' 22' ' ' GLY . 1.0 OUTLIER 67.98 -83.84 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.42 -1.047 . . . . 0.0 109.803 179.861 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.491 ' HA2' ' OD2' ' A' ' 17' ' ' ASP . . . -162.94 47.66 0.32 Allowed Glycine 0 N--CA 1.493 2.455 0 C-N-CA 119.642 -1.266 . . . . 0.0 110.29 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -120.63 37.29 4.32 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.916 -1.344 . . . . 0.0 110.121 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.625 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -174.42 130.55 1.81 Allowed Glycine 0 N--CA 1.488 2.144 0 C-N-CA 119.951 -1.119 . . . . 0.0 110.418 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.451 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -151.68 -159.21 0.99 Allowed 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.539 -0.977 . . . . 0.0 109.214 -179.771 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.0 m -121.12 93.76 4.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.22 -0.925 . . . . 0.0 109.731 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -95.52 111.98 23.79 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.712 -1.243 . . . . 0.0 109.587 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 75.63 -131.48 12.09 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -106.06 30.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.303 -1.817 0 O-C-N 124.093 1.575 . . . . 0.0 110.421 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.461 ' OE1' ' HG2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -149.87 156.84 42.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.882 . . . . 0.0 109.571 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 3' ' ' MET . 8.4 t -99.42 122.72 42.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 0.0 109.318 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.9 mt -113.67 -166.84 1.13 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.233 -0.917 . . . . 0.0 109.52 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.625 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 92.7 m -117.25 -166.69 1.21 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.26 -0.9 . . . . 0.0 109.514 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.45 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.557 ' O ' ' CG ' ' A' ' 3' ' ' MET . 1.7 t -128.39 81.76 2.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.265 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.557 ' CG ' ' O ' ' A' ' 2' ' ' CYS . 1.2 ptm 84.47 178.65 0.04 OUTLIER Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.73 -0.606 . . . . 0.0 109.51 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -89.83 -180.0 1.97 Allowed 'Trans proline' 0 C--N 1.302 -1.877 0 O-C-N 124.213 1.638 . . . . 0.0 110.664 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.86 51.91 1.71 Allowed 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.316 -0.865 . . . . 0.0 109.374 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -151.64 84.12 1.29 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.221 -0.924 . . . . 0.0 109.473 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.404 ' OG1' ' HG3' ' A' ' 12' ' ' MET . 0.0 OUTLIER -126.91 -78.13 0.58 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.255 -0.903 . . . . 0.0 109.48 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.6 t -153.84 170.44 20.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.39 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.29 79.06 8.63 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.948 . . . . 0.0 109.491 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -153.76 59.46 0.74 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.334 -0.854 . . . . 0.0 109.106 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.447 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER 68.23 40.49 2.11 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.339 -0.851 . . . . 0.0 109.199 -179.586 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.404 ' HG3' ' OG1' ' A' ' 7' ' ' THR . 0.0 OUTLIER -60.67 -50.74 72.27 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.332 -0.855 . . . . 0.0 109.253 179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 16' ' ' CYS . . . -61.84 -11.74 14.16 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.502 -0.749 . . . . 0.0 109.76 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -62.4 -24.07 67.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.103 -0.998 . . . . 0.0 109.362 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 19' ' ' CYS . 0.5 OUTLIER -107.93 -13.42 14.98 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.317 -0.864 . . . . 0.0 109.378 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 13' ' ' ALA . 4.7 t -86.67 -21.43 26.71 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.233 -0.917 . . . . 0.0 108.722 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.613 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 34.3 t0 -88.06 -50.3 6.49 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.5 -33.43 73.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.543 -0.723 . . . . 0.0 109.528 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 15' ' ' LYS . 1.5 t -55.67 -33.43 64.11 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 71.1 m -73.38 -30.74 63.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.728 -0.607 . . . . 0.0 109.576 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.19 -42.7 0.47 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.41 162.86 27.89 Favored Glycine 0 N--CA 1.488 2.102 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.417 ' HA ' ' OD2' ' A' ' 17' ' ' ASP . 0.8 OUTLIER -52.79 110.46 0.52 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.188 -1.184 . . . . 0.0 109.361 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.95 -8.01 3.27 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.537 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -146.9 39.96 1.05 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.207 -1.173 . . . . 0.0 110.039 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.614 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -175.09 136.48 3.44 Favored Glycine 0 N--CA 1.49 2.235 0 C-N-CA 119.752 -1.214 . . . . 0.0 110.663 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.457 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -164.02 -179.43 6.22 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.55 -0.97 . . . . 0.0 109.045 -179.79 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.1 m -90.92 123.47 34.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.024 -1.048 . . . . 0.0 109.274 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.412 ' CB ' HD12 ' A' ' 34' ' ' LEU . 18.5 m-85 -146.9 155.57 42.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.505 -1.372 . . . . 0.0 109.317 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 53.25 -133.54 42.01 Favored Glycine 0 N--CA 1.486 2.013 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -113.24 38.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 123.928 1.488 . . . . 0.0 110.596 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.41 176.52 2.82 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.172 -0.955 . . . . 0.0 110.173 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.3 t -82.48 124.02 29.69 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.486 -0.758 . . . . 0.0 109.44 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.412 HD12 ' CB ' ' A' ' 29' ' ' TYR . 13.0 mt -104.01 -175.91 2.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.142 -0.974 . . . . 0.0 109.916 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.614 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 86.8 m -138.74 -162.88 1.37 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.413 -0.805 . . . . 0.0 109.319 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.517 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 3.7 tpt180 . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.362 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.7 t -104.66 -65.95 1.0 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.327 -0.858 . . . . 0.0 109.414 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.541 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -168.02 -170.15 0.21 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.277 -0.889 . . . . 0.0 109.096 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 3' ' ' MET . 36.6 Cg_endo -97.06 -169.26 0.13 Allowed 'Trans proline' 0 C--N 1.308 -1.602 0 O-C-N 123.703 1.37 . . . . 0.0 110.386 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.509 ' O ' ' CG ' ' A' ' 6' ' ' PHE . 37.2 m -128.52 67.5 1.38 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.288 -0.882 . . . . 0.0 109.578 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.509 ' CG ' ' O ' ' A' ' 5' ' ' CYS . 95.0 m-85 -156.8 62.19 0.52 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.103 -0.998 . . . . 0.0 109.803 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.39 -69.81 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.312 -0.867 . . . . 0.0 109.054 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.558 HG22 ' SD ' ' A' ' 12' ' ' MET . 9.9 t -100.2 170.94 8.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.395 -0.815 . . . . 0.0 109.255 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.411 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 0.9 OUTLIER -116.96 162.2 18.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.291 -0.88 . . . . 0.0 109.444 179.886 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.498 ' O ' ' CG ' ' A' ' 11' ' ' GLN . 21.5 m170 49.1 23.31 0.73 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.322 -0.861 . . . . 0.0 109.433 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.498 ' CG ' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER -169.81 42.63 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.361 -0.837 . . . . 0.0 109.242 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.558 ' SD ' HG22 ' A' ' 8' ' ' THR . 5.5 tpt -119.12 -57.12 2.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.345 -0.847 . . . . 0.0 109.535 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.25 -5.38 22.55 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.424 -0.798 . . . . 0.0 109.9 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.62 4.7 48.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.068 -1.02 . . . . 0.0 109.484 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.487 ' HD2' ' O ' ' A' ' 11' ' ' GLN . 12.7 mtpt -112.7 -29.48 7.42 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.181 -0.949 . . . . 0.0 109.471 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.433 ' SG ' ' C ' ' A' ' 27' ' ' LYS . 3.4 t -67.54 -52.92 33.17 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.222 -0.924 . . . . 0.0 108.601 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.565 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 26.9 t0 -61.38 -47.51 85.49 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.386 -0.821 . . . . 0.0 109.034 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.86 -31.24 69.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.41 -0.806 . . . . 0.0 109.738 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.81 -40.23 87.71 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.359 -0.838 . . . . 0.0 109.291 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.473 ' SG ' ' O ' ' A' ' 25' ' ' ARG . 27.5 m -56.9 -31.64 65.09 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.475 -0.766 . . . . 0.0 109.994 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 119.13 4.05 12.67 Favored Glycine 0 N--CA 1.493 2.434 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.394 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.506 ' HA3' ' CG ' ' A' ' 25' ' ' ARG . . . -140.49 168.41 25.2 Favored Glycine 0 N--CA 1.485 1.965 0 O-C-N 121.032 -1.275 . . . . 0.0 110.009 179.796 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.419 ' O ' ' HG2' ' A' ' 23' ' ' LYS . 7.6 ttpm? -87.65 14.65 8.04 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.335 -1.097 . . . . 0.0 109.576 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.436 ' HA2' ' OD2' ' A' ' 17' ' ' ASP . . . -166.07 21.79 0.12 Allowed Glycine 0 N--CA 1.49 2.282 0 C-N-CA 119.544 -1.312 . . . . 0.0 110.634 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.506 ' CG ' ' HA3' ' A' ' 22' ' ' GLY . 1.2 ptp180 -117.24 39.03 3.37 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.618 -1.519 . . . . 0.0 110.083 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.579 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -174.01 153.16 16.3 Favored Glycine 0 N--CA 1.491 2.306 0 C-N-CA 119.901 -1.142 . . . . 0.0 110.597 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.433 ' C ' ' SG ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -178.23 143.2 0.28 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.421 -1.047 . . . . 0.0 109.381 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 1.7 m -59.11 87.56 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 109.792 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.42 ' O ' ' C ' ' A' ' 30' ' ' GLY . 13.5 m-85 -97.59 164.97 12.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.859 -1.151 . . . . 0.0 109.065 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 29' ' ' TYR . . . 45.19 -129.43 8.39 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.408 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 36.0 Cg_endo -108.34 10.92 0.13 Allowed 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 123.954 1.502 . . . . 0.0 110.426 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 31' ' ' PRO . 34.5 mt-30 -147.88 159.25 44.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.141 -0.974 . . . . 0.0 110.098 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 28' ' ' CYS . 6.0 t -82.16 122.68 28.18 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.432 -0.793 . . . . 0.0 109.597 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.6 mt -127.64 -171.28 2.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.296 -0.877 . . . . 0.0 109.163 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.579 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 86.8 m -107.28 174.3 5.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -0.933 . . . . 0.0 109.609 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.476 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ptp . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.407 ' O ' ' C ' ' A' ' 3' ' ' MET . 1.9 t -110.1 -178.51 3.53 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.271 -0.893 . . . . 0.0 109.499 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.54 ' HE1' ' HE2' ' A' ' 12' ' ' MET . 3.0 ptt? -44.77 155.45 0.39 Allowed Pre-proline 0 N--CA 1.488 1.455 0 O-C-N 121.228 -0.92 . . . . 0.0 109.363 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.505 ' HD2' ' HB2' ' A' ' 3' ' ' MET . 36.4 Cg_endo -57.53 -162.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.801 0 O-C-N 124.051 1.553 . . . . 0.0 110.214 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.515 ' O ' ' CD1' ' A' ' 6' ' ' PHE . 1.1 m -134.35 70.98 1.44 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.27 -0.893 . . . . 0.0 109.604 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.515 ' CD1' ' O ' ' A' ' 5' ' ' CYS . 30.1 m-85 -150.85 40.85 0.74 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.37 -0.831 . . . . 0.0 109.239 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.18 148.51 50.61 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.287 -0.883 . . . . 0.0 109.524 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.3 p 49.91 -160.91 0.06 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.316 -0.865 . . . . 0.0 109.732 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.0 -44.35 0.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.355 -0.841 . . . . 0.0 109.237 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.464 ' O ' ' NH2' ' A' ' 14' ' ' ARG . 2.7 m-70 -88.99 3.83 50.29 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.403 -0.811 . . . . 0.0 109.539 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -154.96 58.06 0.67 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.225 -0.922 . . . . 0.0 109.616 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.54 ' HE2' ' HE1' ' A' ' 3' ' ' MET . 0.0 OUTLIER -111.1 -53.98 2.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.267 -0.896 . . . . 0.0 109.189 179.828 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.19 7.29 9.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.478 -0.764 . . . . 0.0 109.664 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.464 ' NH2' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER -79.96 -12.56 59.71 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.176 -0.952 . . . . 0.0 109.584 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.2 -12.89 4.53 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.118 -0.989 . . . . 0.0 110.221 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -63.19 1.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.983 -1.073 . . . . 0.0 109.077 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.58 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 13.9 t0 -49.6 -46.48 49.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.361 -0.837 . . . . 0.0 109.372 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -60.99 -37.48 82.64 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.453 -0.779 . . . . 0.0 110.034 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.2 t -51.16 -41.87 60.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.098 -1.001 . . . . 0.0 109.226 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.499 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 1.7 m -80.51 -34.55 35.56 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.47 -0.769 . . . . 0.0 110.117 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 171.3 -52.56 0.18 Allowed Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.481 ' O ' ' CD ' ' A' ' 25' ' ' ARG . . . 115.0 170.31 16.32 Favored Glycine 0 N--CA 1.483 1.791 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 10.5 tttt 71.44 28.61 2.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.304 -1.115 . . . . 0.0 109.642 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.474 ' O ' ' HB2' ' A' ' 36' ' ' ARG . . . 88.89 20.92 44.74 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.505 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 0.9 OUTLIER -103.6 33.6 3.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.21 -1.171 . . . . 0.0 109.493 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.58 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . 174.64 127.17 0.99 Allowed Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -146.13 -175.7 4.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.159 -1.201 . . . . 0.0 110.006 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.4 m -92.71 98.4 11.39 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.529 -0.732 . . . . 0.0 109.738 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -95.12 99.83 11.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.637 -1.29 . . . . 0.0 109.558 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 55.68 -127.73 43.18 Favored Glycine 0 N--CA 1.488 2.113 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -97.8 40.44 0.1 OUTLIER 'Trans proline' 0 C--N 1.301 -1.952 0 O-C-N 124.221 1.643 . . . . 0.0 110.299 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -160.41 123.88 3.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.252 -0.905 . . . . 0.0 109.785 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.449 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 13.3 t -86.99 123.73 32.41 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.295 -0.878 . . . . 0.0 108.826 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.469 ' O ' ' HA2' ' A' ' 26' ' ' GLY . 2.1 mt -133.89 -178.67 5.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.004 -1.06 . . . . 0.0 110.077 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.506 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 4.3 m -88.73 176.4 7.1 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.461 -0.774 . . . . 0.0 109.365 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.505 ' HB2' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 118.006 -0.997 . . . . 0.0 109.515 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.62 ' HB3' HD23 ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.7 t -120.72 -31.39 4.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.198 -0.939 . . . . 0.0 109.873 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.534 ' CB ' ' CD ' ' A' ' 4' ' ' PRO . 2.0 ptm -177.0 -172.3 0.15 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.206 -0.934 . . . . 0.0 109.294 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' A' ' 3' ' ' MET . 36.1 Cg_endo -85.37 -164.85 0.25 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 123.85 1.447 . . . . 0.0 110.015 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.401 ' O ' ' CD1' ' A' ' 6' ' ' PHE . 1.3 m -132.87 179.11 6.37 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.17 -0.956 . . . . 0.0 109.922 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.401 ' CD1' ' O ' ' A' ' 5' ' ' CYS . 34.5 m-85 -149.41 -168.67 3.17 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.399 -0.813 . . . . 0.0 109.419 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.662 ' C ' HG23 ' A' ' 8' ' ' THR . 0.0 OUTLIER -128.58 -171.78 2.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 109.72 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.662 HG23 ' C ' ' A' ' 7' ' ' THR . 1.2 p 67.3 171.98 0.26 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.335 -0.853 . . . . 0.0 109.456 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -89.95 95.26 10.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.272 -0.892 . . . . 0.0 109.468 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 4.5 m170 -126.63 -4.3 6.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.226 -0.921 . . . . 0.0 109.576 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.469 ' HB2' ' O ' ' A' ' 10' ' ' HIS . 41.5 mt-30 63.18 54.54 2.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.203 -0.936 . . . . 0.0 109.513 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.47 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 2.1 tmm? -120.45 -58.3 1.85 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.361 -0.837 . . . . 0.0 109.428 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.75 -11.25 11.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.362 -0.836 . . . . 0.0 110.064 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.24 -27.59 27.83 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.104 -0.998 . . . . 0.0 109.968 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.486 ' HG3' ' N ' ' A' ' 16' ' ' CYS . 4.8 ptmm? -84.68 -32.81 23.39 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 120.976 -1.078 . . . . 0.0 109.738 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.486 ' N ' ' HG3' ' A' ' 15' ' ' LYS . 39.6 t -47.39 -53.95 12.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 109.61 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.59 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 48.5 t0 -44.41 -52.78 7.48 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.172 -0.955 . . . . 0.0 109.249 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -48.86 -43.73 39.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.441 -0.787 . . . . 0.0 109.38 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -49.45 -45.83 47.08 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.532 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 54.3 m -58.2 -38.54 76.94 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.87 -0.518 . . . . 0.0 109.641 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 165.78 -44.73 0.28 Allowed Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.486 -1.445 . . . . 0.0 109.486 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.476 ' O ' ' OD1' ' A' ' 17' ' ' ASP . . . -177.8 176.74 48.18 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.96 -1.656 . . . . 0.0 108.96 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 pttm -60.3 149.42 33.55 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.881 -1.364 . . . . 0.0 109.451 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 80.76 12.48 82.73 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.532 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -148.65 37.09 0.81 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.88 -1.365 . . . . 0.0 109.835 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.59 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . 167.59 143.02 3.64 Favored Glycine 0 N--CA 1.49 2.28 0 C-N-CA 119.761 -1.209 . . . . 0.0 110.327 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.46 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 0.2 OUTLIER 171.44 -169.82 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.138 -1.213 . . . . 0.0 109.333 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.4 m -74.57 80.18 1.98 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.292 -0.88 . . . . 0.0 109.514 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -98.35 138.88 34.95 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.984 -1.073 . . . . 0.0 109.0 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 69.46 -138.21 30.19 Favored Glycine 0 N--CA 1.485 1.952 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.477 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 35.6 Cg_endo -94.63 3.2 2.71 Favored 'Trans proline' 0 C--N 1.302 -1.92 0 O-C-N 123.961 1.506 . . . . 0.0 110.315 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 31' ' ' PRO . 8.7 mt-30 -145.24 -159.39 1.0 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.264 -0.897 . . . . 0.0 109.656 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 3' ' ' MET . 8.0 t -108.79 103.73 12.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.222 -0.923 . . . . 0.0 109.684 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.62 HD23 ' HB3' ' A' ' 1' ' ' MET . 6.4 mt -109.1 -172.15 1.99 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.371 -0.831 . . . . 0.0 109.531 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.542 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 66.1 m -106.61 170.7 7.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.31 -0.869 . . . . 0.0 109.47 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.459 ' O ' ' O ' ' A' ' 35' ' ' CYS . 1.6 mtp85 . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 118.05 -0.976 . . . . 0.0 109.671 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.29 0.567 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.8 t -112.23 -120.02 0.29 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.168 -0.958 . . . . 0.0 109.485 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.595 ' CB ' ' CD ' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -102.52 -154.77 0.02 OUTLIER Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 120.718 -1.239 . . . . 0.0 109.358 -179.799 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.595 ' CD ' ' CB ' ' A' ' 3' ' ' MET . 36.6 Cg_endo -109.07 -160.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.51 0 O-C-N 123.702 1.369 . . . . 0.0 110.456 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.479 ' HB2' ' HB3' ' A' ' 28' ' ' CYS . 1.4 m -158.51 178.87 9.67 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.282 -0.886 . . . . 0.0 109.647 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -112.43 -164.62 0.93 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.429 -0.794 . . . . 0.0 109.158 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.467 ' O ' HG23 ' A' ' 8' ' ' THR . 0.9 OUTLIER -111.81 17.44 19.8 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.31 -0.869 . . . . 0.0 109.127 179.6 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.474 ' O ' ' HB2' ' A' ' 9' ' ' ASP . 1.3 p -154.94 -166.06 2.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.32 -0.863 . . . . 0.0 109.326 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 8' ' ' THR . 0.2 OUTLIER 72.22 160.75 0.23 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.107 -0.996 . . . . 0.0 109.592 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.9 m80 -121.13 -25.89 5.21 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -0.919 . . . . 0.0 109.664 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.73 12.57 8.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.177 -0.952 . . . . 0.0 109.536 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.451 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 9.0 tpt -80.15 -67.22 0.79 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.213 -0.929 . . . . 0.0 109.277 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.35 -9.08 15.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.592 -0.692 . . . . 0.0 109.96 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -28.08 66.81 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.958 -1.089 . . . . 0.0 109.679 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.0 -41.23 9.25 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.18 -0.95 . . . . 0.0 109.256 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -51.32 70.25 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.24 -0.912 . . . . 0.0 108.962 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.557 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 58.2 t0 -50.84 -53.33 33.1 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.52 -34.8 59.46 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.3 t -49.62 -43.72 46.87 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 1.6 m -79.51 -32.0 42.27 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.542 -0.724 . . . . 0.0 110.128 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.66 -66.9 0.09 OUTLIER Glycine 0 N--CA 1.491 2.34 0 C-N-CA 119.653 -1.26 . . . . 0.0 110.018 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.469 ' O ' ' OD1' ' A' ' 17' ' ' ASP . . . -178.91 -171.71 42.43 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.703 -1.359 . . . . 0.0 109.703 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.2 mtmt -55.41 120.84 7.75 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.296 -1.12 . . . . 0.0 109.636 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.415 ' C ' ' HG3' ' A' ' 25' ' ' ARG . . . 97.45 11.57 51.03 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.415 ' HG3' ' C ' ' A' ' 24' ' ' GLY . 70.5 mtt180 -149.19 38.36 0.8 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.151 -1.205 . . . . 0.0 109.576 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.611 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . 170.0 134.2 1.71 Allowed Glycine 0 N--CA 1.488 2.147 0 C-N-CA 119.957 -1.116 . . . . 0.0 110.447 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.543 ' HD3' ' CE1' ' A' ' 29' ' ' TYR . 40.8 tttp -158.42 149.07 20.32 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.44 -1.035 . . . . 0.0 109.147 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 99.5 m -82.89 77.48 9.63 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.165 -0.96 . . . . 0.0 109.617 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.543 ' CE1' ' HD3' ' A' ' 27' ' ' LYS . 35.8 m-85 -64.52 113.82 3.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.04 -1.038 . . . . 0.0 109.289 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 54.74 -139.99 38.71 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -87.39 35.37 0.44 Allowed 'Trans proline' 0 C--N 1.303 -1.816 0 O-C-N 124.032 1.543 . . . . 0.0 110.251 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -148.86 138.78 22.11 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.207 -0.933 . . . . 0.0 109.601 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 28' ' ' CYS . 6.8 t -101.71 120.4 40.29 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.283 -0.885 . . . . 0.0 109.563 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.422 HD12 ' HD2' ' A' ' 29' ' ' TYR . 48.5 mt -122.9 -164.71 1.22 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.285 -0.885 . . . . 0.0 109.757 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.611 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 34.9 m -106.52 -175.26 2.75 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.421 -0.799 . . . . 0.0 109.434 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.417 ' OXT' ' HG3' ' A' ' 36' ' ' ARG . 18.8 tpt180 . . . . . 0 C--N 1.305 -1.328 0 CA-C-O 118.083 -0.961 . . . . 0.0 109.619 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.461 ' SD ' ' HA ' ' A' ' 32' ' ' GLN . 3.7 ptt? . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.447 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 3.9 t -105.7 120.11 40.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.112 -0.993 . . . . 0.0 109.528 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.549 ' HG3' ' HD2' ' A' ' 4' ' ' PRO . 4.6 tpt 60.14 168.93 0.08 OUTLIER Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.223 -0.923 . . . . 0.0 109.726 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.549 ' HD2' ' HG3' ' A' ' 3' ' ' MET . 36.7 Cg_endo -119.61 89.09 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 O-C-N 124.111 1.585 . . . . 0.0 110.394 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.42 ' O ' ' O ' ' A' ' 4' ' ' PRO . 91.9 m -50.53 177.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.04 -1.037 . . . . 0.0 109.268 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.455 ' O ' ' HB ' ' A' ' 7' ' ' THR . 27.8 m-85 53.26 -174.24 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.155 -0.966 . . . . 0.0 109.473 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.73 HG22 ' O ' ' A' ' 7' ' ' THR . 52.7 m 60.63 14.29 4.86 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.221 -0.925 . . . . 0.0 109.427 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.631 HG22 ' C ' ' A' ' 7' ' ' THR . 0.1 OUTLIER 178.15 175.66 0.51 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.254 -0.904 . . . . 0.0 109.544 179.969 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.567 ' O ' ' CG ' ' A' ' 10' ' ' HIS . 0.2 OUTLIER -167.26 75.39 0.15 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.493 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.567 ' CG ' ' O ' ' A' ' 9' ' ' ASP . 80.5 m80 -159.89 56.98 0.37 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.241 -0.912 . . . . 0.0 109.606 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.511 ' CB ' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER 76.28 65.25 0.05 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -0.917 . . . . 0.0 109.28 -179.991 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.416 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 0.5 OUTLIER -127.68 -56.55 1.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.171 -0.956 . . . . 0.0 109.518 -179.848 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.445 ' HA ' ' HB2' ' A' ' 16' ' ' CYS . . . -67.69 -9.27 42.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.322 -0.861 . . . . 0.0 109.896 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.483 ' HD3' ' HG2' ' A' ' 11' ' ' GLN . 4.5 mtp180 -67.83 -33.78 75.45 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.143 -0.973 . . . . 0.0 109.55 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 12' ' ' MET . 0.1 OUTLIER -93.74 -22.13 18.9 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.193 -0.942 . . . . 0.0 109.883 -179.69 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -50.02 -58.92 4.47 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.21 -0.931 . . . . 0.0 109.56 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.621 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 8.0 t0 -57.62 -52.64 64.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.915 . . . . 0.0 109.168 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.425 ' HA ' ' HA2' ' A' ' 22' ' ' GLY . 0.2 OUTLIER -48.0 -26.63 1.85 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 109.064 179.712 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.1 t -62.07 -50.06 73.48 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 1.4 m -68.96 -30.4 68.82 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.658 -0.651 . . . . 0.0 110.271 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 177.72 -69.38 0.08 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.686 -1.366 . . . . 0.0 109.686 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.456 ' O ' ' N ' ' A' ' 24' ' ' GLY . . . 176.75 178.85 46.83 Favored Glycine 0 N--CA 1.485 1.956 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 22' ' ' GLY . 29.1 mtmm -44.25 98.5 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -1.127 . . . . 0.0 109.497 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 22' ' ' GLY . . . 128.32 7.84 4.27 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 119.821 -1.18 . . . . 0.0 110.183 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.524 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 12.0 mtt180 -146.99 40.39 1.06 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.059 -1.259 . . . . 0.0 109.561 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.679 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -166.86 150.99 18.64 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -162.74 131.08 3.92 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.473 -1.016 . . . . 0.0 109.247 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 63.9 m -80.33 82.54 6.35 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -80.95 114.71 20.01 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.883 -1.135 . . . . 0.0 108.771 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 56.38 -131.04 50.62 Favored Glycine 0 N--CA 1.488 2.133 0 N-CA-C 108.978 -1.649 . . . . 0.0 108.978 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -95.69 -1.77 2.19 Favored 'Trans proline' 0 C--N 1.301 -1.965 0 O-C-N 124.14 1.6 . . . . 0.0 110.392 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.461 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 69.3 mt-30 -99.43 117.23 33.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.203 -0.935 . . . . 0.0 110.357 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.1 t -92.44 107.03 18.91 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.395 -0.816 . . . . 0.0 108.869 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.3 mt -123.25 -161.3 0.96 Allowed 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.175 -0.953 . . . . 0.0 109.816 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.679 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 10.7 m -82.72 -168.98 2.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.447 -0.783 . . . . 0.0 109.774 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.0 ttt-85 . . . . . 0 C--N 1.304 -1.389 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.405 -179.962 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.461 ' HG2' ' OE1' ' A' ' 32' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.269 0.557 . . . . 0.0 109.633 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.463 ' O ' ' CB ' ' A' ' 33' ' ' CYS . 5.3 t -121.54 118.39 29.16 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 109.811 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.57 ' HG3' ' HD2' ' A' ' 4' ' ' PRO . 1.9 tpp 56.61 163.78 0.07 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.278 -0.888 . . . . 0.0 109.624 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.57 ' HD2' ' HG3' ' A' ' 3' ' ' MET . 35.6 Cg_endo -109.98 -159.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 O-C-N 124.174 1.618 . . . . 0.0 110.136 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -147.72 132.2 17.68 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.304 -0.873 . . . . 0.0 109.493 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.471 ' O ' ' C ' ' A' ' 7' ' ' THR . 97.2 m-85 -107.42 86.26 2.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.234 -0.916 . . . . 0.0 109.605 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.484 ' O ' ' N ' ' A' ' 9' ' ' ASP . 3.1 m 37.98 -132.1 0.15 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.737 -0.602 . . . . 0.0 109.795 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.476 ' O ' ' CB ' ' A' ' 9' ' ' ASP . 2.2 p 48.87 -94.33 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.793 -1.192 . . . . 0.0 109.528 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.484 ' N ' ' O ' ' A' ' 7' ' ' THR . 0.3 OUTLIER 73.62 73.69 0.13 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.187 -0.946 . . . . 0.0 109.526 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 m80 -139.56 -54.91 0.56 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.209 -0.932 . . . . 0.0 109.436 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.14 14.7 1.48 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.302 -0.874 . . . . 0.0 109.386 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.442 ' SD ' ' HE2' ' A' ' 15' ' ' LYS . 3.6 tmm? -87.36 -52.92 5.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.282 -0.886 . . . . 0.0 109.321 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.83 -13.13 9.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.484 -0.76 . . . . 0.0 109.822 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.26 -33.02 5.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.227 -0.921 . . . . 0.0 109.335 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.442 ' HE2' ' SD ' ' A' ' 12' ' ' MET . 0.0 OUTLIER -89.31 -34.34 16.61 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.349 -0.844 . . . . 0.0 110.021 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.42 -46.54 37.62 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.067 -1.021 . . . . 0.0 109.061 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.618 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 23.3 t0 -60.59 -48.92 79.65 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.479 -0.763 . . . . 0.0 109.236 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.468 ' HA ' ' HA2' ' A' ' 22' ' ' GLY . 0.4 OUTLIER -52.91 -32.32 44.7 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.533 -0.729 . . . . 0.0 110.156 -179.415 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 27.2 t -60.23 -55.59 31.83 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.139 -0.976 . . . . 0.0 109.126 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.556 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 61.5 m -54.93 -21.88 13.15 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.462 -0.774 . . . . 0.0 109.677 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.442 ' HA3' ' HD2' ' A' ' 25' ' ' ARG . . . 159.0 -57.52 0.34 Allowed Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.401 -1.479 . . . . 0.0 109.401 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.491 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . 138.86 -177.12 20.45 Favored Glycine 0 N--CA 1.483 1.792 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.481 ' HB3' ' O ' ' A' ' 22' ' ' GLY . 1.0 OUTLIER 67.98 -83.84 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.42 -1.047 . . . . 0.0 109.803 179.861 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.491 ' HA2' ' OD2' ' A' ' 17' ' ' ASP . . . -162.94 47.66 0.32 Allowed Glycine 0 N--CA 1.493 2.455 0 C-N-CA 119.642 -1.266 . . . . 0.0 110.29 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -120.63 37.29 4.32 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.916 -1.344 . . . . 0.0 110.121 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.625 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -174.42 130.55 1.81 Allowed Glycine 0 N--CA 1.488 2.144 0 C-N-CA 119.951 -1.119 . . . . 0.0 110.418 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.451 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -151.68 -159.21 0.99 Allowed 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.539 -0.977 . . . . 0.0 109.214 -179.771 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.0 m -121.12 93.76 4.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.22 -0.925 . . . . 0.0 109.731 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -95.52 111.98 23.79 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.712 -1.243 . . . . 0.0 109.587 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 75.63 -131.48 12.09 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -106.06 30.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.303 -1.817 0 O-C-N 124.093 1.575 . . . . 0.0 110.421 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.461 ' OE1' ' HG2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -149.87 156.84 42.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.882 . . . . 0.0 109.571 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 3' ' ' MET . 8.4 t -99.42 122.72 42.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 0.0 109.318 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.9 mt -113.67 -166.84 1.13 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.233 -0.917 . . . . 0.0 109.52 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.625 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 92.7 m -117.25 -166.69 1.21 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.26 -0.9 . . . . 0.0 109.514 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.45 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.557 ' O ' ' CG ' ' A' ' 3' ' ' MET . 1.7 t -128.39 81.76 2.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.265 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.557 ' CG ' ' O ' ' A' ' 2' ' ' CYS . 1.2 ptm 84.47 178.65 0.04 OUTLIER Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.73 -0.606 . . . . 0.0 109.51 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -89.83 -180.0 1.97 Allowed 'Trans proline' 0 C--N 1.302 -1.877 0 O-C-N 124.213 1.638 . . . . 0.0 110.664 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.86 51.91 1.71 Allowed 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.316 -0.865 . . . . 0.0 109.374 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -151.64 84.12 1.29 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.221 -0.924 . . . . 0.0 109.473 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.404 ' OG1' ' HG3' ' A' ' 12' ' ' MET . 0.0 OUTLIER -126.91 -78.13 0.58 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.255 -0.903 . . . . 0.0 109.48 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.6 t -153.84 170.44 20.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.39 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.29 79.06 8.63 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.948 . . . . 0.0 109.491 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -153.76 59.46 0.74 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.334 -0.854 . . . . 0.0 109.106 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.447 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER 68.23 40.49 2.11 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.339 -0.851 . . . . 0.0 109.199 -179.586 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.404 ' HG3' ' OG1' ' A' ' 7' ' ' THR . 0.0 OUTLIER -60.67 -50.74 72.27 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.332 -0.855 . . . . 0.0 109.253 179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 16' ' ' CYS . . . -61.84 -11.74 14.16 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.502 -0.749 . . . . 0.0 109.76 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -62.4 -24.07 67.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.103 -0.998 . . . . 0.0 109.362 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 19' ' ' CYS . 0.5 OUTLIER -107.93 -13.42 14.98 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.317 -0.864 . . . . 0.0 109.378 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 13' ' ' ALA . 4.7 t -86.67 -21.43 26.71 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.233 -0.917 . . . . 0.0 108.722 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.613 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 34.3 t0 -88.06 -50.3 6.49 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.5 -33.43 73.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.543 -0.723 . . . . 0.0 109.528 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 15' ' ' LYS . 1.5 t -55.67 -33.43 64.11 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 71.1 m -73.38 -30.74 63.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.728 -0.607 . . . . 0.0 109.576 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.19 -42.7 0.47 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.41 162.86 27.89 Favored Glycine 0 N--CA 1.488 2.102 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.417 ' HA ' ' OD2' ' A' ' 17' ' ' ASP . 0.8 OUTLIER -52.79 110.46 0.52 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.188 -1.184 . . . . 0.0 109.361 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.95 -8.01 3.27 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.537 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -146.9 39.96 1.05 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.207 -1.173 . . . . 0.0 110.039 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.614 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -175.09 136.48 3.44 Favored Glycine 0 N--CA 1.49 2.235 0 C-N-CA 119.752 -1.214 . . . . 0.0 110.663 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.457 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -164.02 -179.43 6.22 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.55 -0.97 . . . . 0.0 109.045 -179.79 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.1 m -90.92 123.47 34.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.024 -1.048 . . . . 0.0 109.274 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.412 ' CB ' HD12 ' A' ' 34' ' ' LEU . 18.5 m-85 -146.9 155.57 42.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.505 -1.372 . . . . 0.0 109.317 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 53.25 -133.54 42.01 Favored Glycine 0 N--CA 1.486 2.013 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -113.24 38.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 123.928 1.488 . . . . 0.0 110.596 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.41 176.52 2.82 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.172 -0.955 . . . . 0.0 110.173 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.3 t -82.48 124.02 29.69 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.486 -0.758 . . . . 0.0 109.44 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.412 HD12 ' CB ' ' A' ' 29' ' ' TYR . 13.0 mt -104.01 -175.91 2.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.142 -0.974 . . . . 0.0 109.916 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.614 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 86.8 m -138.74 -162.88 1.37 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.413 -0.805 . . . . 0.0 109.319 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.517 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 3.7 tpt180 . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.362 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.7 t -104.66 -65.95 1.0 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.327 -0.858 . . . . 0.0 109.414 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.541 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -168.02 -170.15 0.21 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.277 -0.889 . . . . 0.0 109.096 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 3' ' ' MET . 36.6 Cg_endo -97.06 -169.26 0.13 Allowed 'Trans proline' 0 C--N 1.308 -1.602 0 O-C-N 123.703 1.37 . . . . 0.0 110.386 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.509 ' O ' ' CG ' ' A' ' 6' ' ' PHE . 37.2 m -128.52 67.5 1.38 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.288 -0.882 . . . . 0.0 109.578 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.509 ' CG ' ' O ' ' A' ' 5' ' ' CYS . 95.0 m-85 -156.8 62.19 0.52 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.103 -0.998 . . . . 0.0 109.803 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.39 -69.81 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.312 -0.867 . . . . 0.0 109.054 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.558 HG22 ' SD ' ' A' ' 12' ' ' MET . 9.9 t -100.2 170.94 8.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.395 -0.815 . . . . 0.0 109.255 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.411 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 0.9 OUTLIER -116.96 162.2 18.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.291 -0.88 . . . . 0.0 109.444 179.886 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.498 ' O ' ' CG ' ' A' ' 11' ' ' GLN . 21.5 m170 49.1 23.31 0.73 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.322 -0.861 . . . . 0.0 109.433 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.498 ' CG ' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER -169.81 42.63 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.361 -0.837 . . . . 0.0 109.242 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.558 ' SD ' HG22 ' A' ' 8' ' ' THR . 5.5 tpt -119.12 -57.12 2.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.345 -0.847 . . . . 0.0 109.535 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.25 -5.38 22.55 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.424 -0.798 . . . . 0.0 109.9 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.62 4.7 48.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.068 -1.02 . . . . 0.0 109.484 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.487 ' HD2' ' O ' ' A' ' 11' ' ' GLN . 12.7 mtpt -112.7 -29.48 7.42 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.181 -0.949 . . . . 0.0 109.471 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.433 ' SG ' ' C ' ' A' ' 27' ' ' LYS . 3.4 t -67.54 -52.92 33.17 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.222 -0.924 . . . . 0.0 108.601 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.565 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 26.9 t0 -61.38 -47.51 85.49 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.386 -0.821 . . . . 0.0 109.034 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.86 -31.24 69.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.41 -0.806 . . . . 0.0 109.738 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.81 -40.23 87.71 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.359 -0.838 . . . . 0.0 109.291 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.473 ' SG ' ' O ' ' A' ' 25' ' ' ARG . 27.5 m -56.9 -31.64 65.09 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.475 -0.766 . . . . 0.0 109.994 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 119.13 4.05 12.67 Favored Glycine 0 N--CA 1.493 2.434 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.394 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.506 ' HA3' ' CG ' ' A' ' 25' ' ' ARG . . . -140.49 168.41 25.2 Favored Glycine 0 N--CA 1.485 1.965 0 O-C-N 121.032 -1.275 . . . . 0.0 110.009 179.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.419 ' O ' ' HG2' ' A' ' 23' ' ' LYS . 7.6 ttpm? -87.65 14.65 8.04 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.335 -1.097 . . . . 0.0 109.576 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.436 ' HA2' ' OD2' ' A' ' 17' ' ' ASP . . . -166.07 21.79 0.12 Allowed Glycine 0 N--CA 1.49 2.282 0 C-N-CA 119.544 -1.312 . . . . 0.0 110.634 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.506 ' CG ' ' HA3' ' A' ' 22' ' ' GLY . 1.2 ptp180 -117.24 39.03 3.37 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.618 -1.519 . . . . 0.0 110.083 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.579 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -174.01 153.16 16.3 Favored Glycine 0 N--CA 1.491 2.306 0 C-N-CA 119.901 -1.142 . . . . 0.0 110.597 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.433 ' C ' ' SG ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -178.23 143.2 0.28 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.421 -1.047 . . . . 0.0 109.381 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 1.7 m -59.11 87.56 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 109.792 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.42 ' O ' ' C ' ' A' ' 30' ' ' GLY . 13.5 m-85 -97.59 164.97 12.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.859 -1.151 . . . . 0.0 109.065 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 29' ' ' TYR . . . 45.19 -129.43 8.39 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.408 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 36.0 Cg_endo -108.34 10.92 0.13 Allowed 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 123.954 1.502 . . . . 0.0 110.426 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 31' ' ' PRO . 34.5 mt-30 -147.88 159.25 44.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.141 -0.974 . . . . 0.0 110.098 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 28' ' ' CYS . 6.0 t -82.16 122.68 28.18 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.432 -0.793 . . . . 0.0 109.597 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.6 mt -127.64 -171.28 2.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.296 -0.877 . . . . 0.0 109.163 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.579 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 86.8 m -107.28 174.3 5.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -0.933 . . . . 0.0 109.609 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.476 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ptp . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.407 ' O ' ' C ' ' A' ' 3' ' ' MET . 1.9 t -110.1 -178.51 3.53 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.271 -0.893 . . . . 0.0 109.499 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.54 ' HE1' ' HE2' ' A' ' 12' ' ' MET . 3.0 ptt? -44.77 155.45 0.39 Allowed Pre-proline 0 N--CA 1.488 1.455 0 O-C-N 121.228 -0.92 . . . . 0.0 109.363 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.505 ' HD2' ' HB2' ' A' ' 3' ' ' MET . 36.4 Cg_endo -57.53 -162.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.801 0 O-C-N 124.051 1.553 . . . . 0.0 110.214 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.515 ' O ' ' CD1' ' A' ' 6' ' ' PHE . 1.1 m -134.35 70.98 1.44 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.27 -0.893 . . . . 0.0 109.604 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.515 ' CD1' ' O ' ' A' ' 5' ' ' CYS . 30.1 m-85 -150.85 40.85 0.74 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.37 -0.831 . . . . 0.0 109.239 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.18 148.51 50.61 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.287 -0.883 . . . . 0.0 109.524 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.3 p 49.91 -160.91 0.06 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.316 -0.865 . . . . 0.0 109.732 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.0 -44.35 0.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.355 -0.841 . . . . 0.0 109.237 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.464 ' O ' ' NH2' ' A' ' 14' ' ' ARG . 7.3 m170 -88.99 3.83 50.29 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.403 -0.811 . . . . 0.0 109.539 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -154.96 58.06 0.67 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.225 -0.922 . . . . 0.0 109.616 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.54 ' HE2' ' HE1' ' A' ' 3' ' ' MET . 0.0 OUTLIER -111.1 -53.98 2.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.267 -0.896 . . . . 0.0 109.189 179.828 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.19 7.29 9.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.478 -0.764 . . . . 0.0 109.664 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.464 ' NH2' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER -79.96 -12.56 59.71 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.176 -0.952 . . . . 0.0 109.584 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.2 -12.89 4.53 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.118 -0.989 . . . . 0.0 110.221 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -63.19 1.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.983 -1.073 . . . . 0.0 109.077 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.58 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 13.9 t0 -49.6 -46.48 49.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.361 -0.837 . . . . 0.0 109.372 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -60.99 -37.48 82.64 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.453 -0.779 . . . . 0.0 110.034 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.2 t -51.16 -41.87 60.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.098 -1.001 . . . . 0.0 109.226 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.499 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 1.7 m -80.51 -34.55 35.56 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.47 -0.769 . . . . 0.0 110.117 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 171.3 -52.56 0.18 Allowed Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.481 ' O ' ' CD ' ' A' ' 25' ' ' ARG . . . 115.0 170.31 16.32 Favored Glycine 0 N--CA 1.483 1.791 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 10.5 tttt 71.44 28.61 2.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.304 -1.115 . . . . 0.0 109.642 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.474 ' O ' ' HB2' ' A' ' 36' ' ' ARG . . . 88.89 20.92 44.74 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.505 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 0.9 OUTLIER -103.6 33.6 3.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.21 -1.171 . . . . 0.0 109.493 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.58 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . 174.64 127.17 0.99 Allowed Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -146.13 -175.7 4.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.159 -1.201 . . . . 0.0 110.006 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.4 m -92.71 98.4 11.39 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.529 -0.732 . . . . 0.0 109.738 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -95.12 99.83 11.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.637 -1.29 . . . . 0.0 109.558 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 55.68 -127.73 43.18 Favored Glycine 0 N--CA 1.488 2.113 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -97.8 40.44 0.1 OUTLIER 'Trans proline' 0 C--N 1.301 -1.952 0 O-C-N 124.221 1.643 . . . . 0.0 110.299 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -160.41 123.88 3.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.252 -0.905 . . . . 0.0 109.785 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.449 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 13.3 t -86.99 123.73 32.41 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.295 -0.878 . . . . 0.0 108.826 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.469 ' O ' ' HA2' ' A' ' 26' ' ' GLY . 2.1 mt -133.89 -178.67 5.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.004 -1.06 . . . . 0.0 110.077 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.506 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 4.3 m -88.73 176.4 7.1 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.461 -0.774 . . . . 0.0 109.365 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.505 ' HB2' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 118.006 -0.997 . . . . 0.0 109.515 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.62 ' HB3' HD23 ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.7 t -120.72 -31.39 4.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.198 -0.939 . . . . 0.0 109.873 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.534 ' CB ' ' CD ' ' A' ' 4' ' ' PRO . 2.0 ptm -177.0 -172.3 0.15 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.206 -0.934 . . . . 0.0 109.294 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' A' ' 3' ' ' MET . 36.1 Cg_endo -85.37 -164.85 0.25 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 123.85 1.447 . . . . 0.0 110.015 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.401 ' O ' ' CD1' ' A' ' 6' ' ' PHE . 1.3 m -132.87 179.11 6.37 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.17 -0.956 . . . . 0.0 109.922 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.401 ' CD1' ' O ' ' A' ' 5' ' ' CYS . 34.5 m-85 -149.41 -168.67 3.17 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.399 -0.813 . . . . 0.0 109.419 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.662 ' C ' HG23 ' A' ' 8' ' ' THR . 0.0 OUTLIER -128.58 -171.78 2.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 109.72 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.662 HG23 ' C ' ' A' ' 7' ' ' THR . 1.2 p 67.3 171.98 0.26 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.335 -0.853 . . . . 0.0 109.456 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -89.95 95.26 10.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.272 -0.892 . . . . 0.0 109.468 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 4.5 m170 -126.63 -4.3 6.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.226 -0.921 . . . . 0.0 109.576 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.469 ' HB2' ' O ' ' A' ' 10' ' ' HIS . 41.5 mt-30 63.18 54.54 2.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.203 -0.936 . . . . 0.0 109.513 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.47 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 2.1 tmm? -120.45 -58.3 1.85 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.361 -0.837 . . . . 0.0 109.428 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.75 -11.25 11.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.362 -0.836 . . . . 0.0 110.064 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.24 -27.59 27.83 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.104 -0.998 . . . . 0.0 109.968 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.486 ' HG3' ' N ' ' A' ' 16' ' ' CYS . 4.8 ptmm? -84.68 -32.81 23.39 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 120.976 -1.078 . . . . 0.0 109.738 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.486 ' N ' ' HG3' ' A' ' 15' ' ' LYS . 39.6 t -47.39 -53.95 12.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 109.61 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.59 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 48.5 t0 -44.41 -52.78 7.48 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.172 -0.955 . . . . 0.0 109.249 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -48.86 -43.73 39.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.441 -0.787 . . . . 0.0 109.38 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -49.45 -45.83 47.08 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.532 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 54.3 m -58.2 -38.54 76.94 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.87 -0.518 . . . . 0.0 109.641 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 165.78 -44.73 0.28 Allowed Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.486 -1.445 . . . . 0.0 109.486 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.476 ' O ' ' OD1' ' A' ' 17' ' ' ASP . . . -177.8 176.74 48.18 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.96 -1.656 . . . . 0.0 108.96 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 pttm -60.3 149.42 33.55 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.881 -1.364 . . . . 0.0 109.451 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 80.76 12.48 82.73 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.532 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -148.65 37.09 0.81 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.88 -1.365 . . . . 0.0 109.835 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.59 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . 167.59 143.02 3.64 Favored Glycine 0 N--CA 1.49 2.28 0 C-N-CA 119.761 -1.209 . . . . 0.0 110.327 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.46 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 0.2 OUTLIER 171.44 -169.82 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.138 -1.213 . . . . 0.0 109.333 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.4 m -74.57 80.18 1.98 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.292 -0.88 . . . . 0.0 109.514 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -98.35 138.88 34.95 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.984 -1.073 . . . . 0.0 109.0 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 69.46 -138.21 30.19 Favored Glycine 0 N--CA 1.485 1.952 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.477 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 35.6 Cg_endo -94.63 3.2 2.71 Favored 'Trans proline' 0 C--N 1.302 -1.92 0 O-C-N 123.961 1.506 . . . . 0.0 110.315 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 31' ' ' PRO . 8.7 mt-30 -145.24 -159.39 1.0 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.264 -0.897 . . . . 0.0 109.656 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 3' ' ' MET . 8.0 t -108.79 103.73 12.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.222 -0.923 . . . . 0.0 109.684 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.62 HD23 ' HB3' ' A' ' 1' ' ' MET . 6.4 mt -109.1 -172.15 1.99 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.371 -0.831 . . . . 0.0 109.531 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.542 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 66.1 m -106.61 170.7 7.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.31 -0.869 . . . . 0.0 109.47 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.459 ' O ' ' O ' ' A' ' 35' ' ' CYS . 1.6 mtp85 . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 118.05 -0.976 . . . . 0.0 109.671 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.29 0.567 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.8 t -112.23 -120.02 0.29 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.168 -0.958 . . . . 0.0 109.485 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.595 ' CB ' ' CD ' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -102.52 -154.77 0.02 OUTLIER Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 120.718 -1.239 . . . . 0.0 109.358 -179.799 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.595 ' CD ' ' CB ' ' A' ' 3' ' ' MET . 36.6 Cg_endo -109.07 -160.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.51 0 O-C-N 123.702 1.369 . . . . 0.0 110.456 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.479 ' HB2' ' HB3' ' A' ' 28' ' ' CYS . 1.4 m -158.51 178.87 9.67 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.282 -0.886 . . . . 0.0 109.647 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -112.43 -164.62 0.93 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.429 -0.794 . . . . 0.0 109.158 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.467 ' O ' HG23 ' A' ' 8' ' ' THR . 0.9 OUTLIER -111.81 17.44 19.8 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.31 -0.869 . . . . 0.0 109.127 179.6 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.474 ' O ' ' HB2' ' A' ' 9' ' ' ASP . 1.3 p -154.94 -166.06 2.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.32 -0.863 . . . . 0.0 109.326 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 8' ' ' THR . 0.2 OUTLIER 72.22 160.75 0.23 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.107 -0.996 . . . . 0.0 109.592 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.9 m80 -121.13 -25.89 5.21 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -0.919 . . . . 0.0 109.664 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.73 12.57 8.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.177 -0.952 . . . . 0.0 109.536 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.451 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 9.0 tpt -80.15 -67.22 0.79 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.213 -0.929 . . . . 0.0 109.277 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.35 -9.08 15.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.592 -0.692 . . . . 0.0 109.96 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -28.08 66.81 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.958 -1.089 . . . . 0.0 109.679 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.0 -41.23 9.25 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.18 -0.95 . . . . 0.0 109.256 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -51.32 70.25 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.24 -0.912 . . . . 0.0 108.962 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.557 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 58.2 t0 -50.84 -53.33 33.1 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.52 -34.8 59.46 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.3 t -49.62 -43.72 46.87 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 1.6 m -79.51 -32.0 42.27 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.542 -0.724 . . . . 0.0 110.128 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.66 -66.9 0.09 OUTLIER Glycine 0 N--CA 1.491 2.34 0 C-N-CA 119.653 -1.26 . . . . 0.0 110.018 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.469 ' O ' ' OD1' ' A' ' 17' ' ' ASP . . . -178.91 -171.71 42.43 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.703 -1.359 . . . . 0.0 109.703 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.2 mtmt -55.41 120.84 7.75 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.296 -1.12 . . . . 0.0 109.636 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.415 ' C ' ' HG3' ' A' ' 25' ' ' ARG . . . 97.45 11.57 51.03 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.415 ' HG3' ' C ' ' A' ' 24' ' ' GLY . 70.5 mtt180 -149.19 38.36 0.8 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.151 -1.205 . . . . 0.0 109.576 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.611 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . 170.0 134.2 1.71 Allowed Glycine 0 N--CA 1.488 2.147 0 C-N-CA 119.957 -1.116 . . . . 0.0 110.447 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.543 ' HD3' ' CE1' ' A' ' 29' ' ' TYR . 40.8 tttp -158.42 149.07 20.32 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.44 -1.035 . . . . 0.0 109.147 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 99.5 m -82.89 77.48 9.63 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.165 -0.96 . . . . 0.0 109.617 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.543 ' CE1' ' HD3' ' A' ' 27' ' ' LYS . 35.8 m-85 -64.52 113.82 3.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.04 -1.038 . . . . 0.0 109.289 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 54.74 -139.99 38.71 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -87.39 35.37 0.44 Allowed 'Trans proline' 0 C--N 1.303 -1.816 0 O-C-N 124.032 1.543 . . . . 0.0 110.251 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -148.86 138.78 22.11 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.207 -0.933 . . . . 0.0 109.601 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 28' ' ' CYS . 6.8 t -101.71 120.4 40.29 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.283 -0.885 . . . . 0.0 109.563 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.422 HD12 ' HD2' ' A' ' 29' ' ' TYR . 48.5 mt -122.9 -164.71 1.22 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.285 -0.885 . . . . 0.0 109.757 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.611 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 34.9 m -106.52 -175.26 2.75 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.421 -0.799 . . . . 0.0 109.434 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.417 ' HG3' ' OXT' ' A' ' 36' ' ' ARG . 18.8 tpt180 . . . . . 0 C--N 1.305 -1.328 0 CA-C-O 118.083 -0.961 . . . . 0.0 109.619 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.461 ' SD ' ' HA ' ' A' ' 32' ' ' GLN . 3.7 ptt? . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.447 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 3.9 t -105.7 120.11 40.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.112 -0.993 . . . . 0.0 109.528 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.549 ' HG3' ' HD2' ' A' ' 4' ' ' PRO . 4.6 tpt 60.14 168.93 0.08 OUTLIER Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.223 -0.923 . . . . 0.0 109.726 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.549 ' HD2' ' HG3' ' A' ' 3' ' ' MET . 36.7 Cg_endo -119.61 89.09 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 O-C-N 124.111 1.585 . . . . 0.0 110.394 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.42 ' O ' ' O ' ' A' ' 4' ' ' PRO . 91.9 m -50.53 177.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.04 -1.037 . . . . 0.0 109.268 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.455 ' O ' ' HB ' ' A' ' 7' ' ' THR . 27.8 m-85 53.26 -174.24 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.155 -0.966 . . . . 0.0 109.473 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.73 HG22 ' O ' ' A' ' 7' ' ' THR . 52.7 m 60.63 14.29 4.86 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.221 -0.925 . . . . 0.0 109.427 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.631 HG22 ' C ' ' A' ' 7' ' ' THR . 0.1 OUTLIER 178.15 175.66 0.51 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.254 -0.904 . . . . 0.0 109.544 179.969 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.567 ' O ' ' CG ' ' A' ' 10' ' ' HIS . 0.2 OUTLIER -167.26 75.39 0.15 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.493 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.567 ' CG ' ' O ' ' A' ' 9' ' ' ASP . 80.5 m80 -159.89 56.98 0.37 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.241 -0.912 . . . . 0.0 109.606 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.511 ' CB ' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER 76.28 65.25 0.05 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -0.917 . . . . 0.0 109.28 -179.991 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.416 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 0.5 OUTLIER -127.68 -56.55 1.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.171 -0.956 . . . . 0.0 109.518 -179.848 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.445 ' HA ' ' HB2' ' A' ' 16' ' ' CYS . . . -67.69 -9.27 42.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.322 -0.861 . . . . 0.0 109.896 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.483 ' HD3' ' HG2' ' A' ' 11' ' ' GLN . 4.5 mtp180 -67.83 -33.78 75.45 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.143 -0.973 . . . . 0.0 109.55 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 12' ' ' MET . 0.1 OUTLIER -93.74 -22.13 18.9 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.193 -0.942 . . . . 0.0 109.883 -179.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -50.02 -58.92 4.47 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.21 -0.931 . . . . 0.0 109.56 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.621 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 8.0 t0 -57.62 -52.64 64.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.915 . . . . 0.0 109.168 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.425 ' HA ' ' HA2' ' A' ' 22' ' ' GLY . 0.2 OUTLIER -48.0 -26.63 1.85 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 109.064 179.712 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.1 t -62.07 -50.06 73.48 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 1.4 m -68.96 -30.4 68.82 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.658 -0.651 . . . . 0.0 110.271 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 177.72 -69.38 0.08 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.686 -1.366 . . . . 0.0 109.686 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.456 ' O ' ' N ' ' A' ' 24' ' ' GLY . . . 176.75 178.85 46.83 Favored Glycine 0 N--CA 1.485 1.956 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 22' ' ' GLY . 29.1 mtmm -44.25 98.5 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -1.127 . . . . 0.0 109.497 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 22' ' ' GLY . . . 128.32 7.84 4.27 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 119.821 -1.18 . . . . 0.0 110.183 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.524 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 12.0 mtt180 -146.99 40.39 1.06 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.059 -1.259 . . . . 0.0 109.561 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.679 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -166.86 150.99 18.64 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -162.74 131.08 3.92 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.473 -1.016 . . . . 0.0 109.247 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 63.9 m -80.33 82.54 6.35 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -80.95 114.71 20.01 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.883 -1.135 . . . . 0.0 108.771 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 56.38 -131.04 50.62 Favored Glycine 0 N--CA 1.488 2.133 0 N-CA-C 108.978 -1.649 . . . . 0.0 108.978 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -95.69 -1.77 2.19 Favored 'Trans proline' 0 C--N 1.301 -1.965 0 O-C-N 124.14 1.6 . . . . 0.0 110.392 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.461 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 69.3 mt-30 -99.43 117.23 33.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.203 -0.935 . . . . 0.0 110.357 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.1 t -92.44 107.03 18.91 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.395 -0.816 . . . . 0.0 108.869 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.3 mt -123.25 -161.3 0.96 Allowed 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.175 -0.953 . . . . 0.0 109.816 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.679 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 10.7 m -82.72 -168.98 2.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.447 -0.783 . . . . 0.0 109.774 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.0 ttt-85 . . . . . 0 C--N 1.304 -1.389 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.405 -179.962 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.461 ' HG2' ' OE1' ' A' ' 32' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.269 0.557 . . . . 0.0 109.633 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.463 ' O ' ' CB ' ' A' ' 33' ' ' CYS . 5.3 t -121.54 118.39 29.16 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 109.811 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.57 ' HG3' ' HD2' ' A' ' 4' ' ' PRO . 1.9 tpp 56.61 163.78 0.07 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.278 -0.888 . . . . 0.0 109.624 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.57 ' HD2' ' HG3' ' A' ' 3' ' ' MET . 35.6 Cg_endo -109.98 -159.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 O-C-N 124.174 1.618 . . . . 0.0 110.136 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -147.72 132.2 17.68 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.304 -0.873 . . . . 0.0 109.493 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.471 ' O ' ' C ' ' A' ' 7' ' ' THR . 97.2 m-85 -107.42 86.26 2.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.234 -0.916 . . . . 0.0 109.605 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.484 ' O ' ' N ' ' A' ' 9' ' ' ASP . 3.1 m 37.98 -132.1 0.15 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.737 -0.602 . . . . 0.0 109.795 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.476 ' O ' ' CB ' ' A' ' 9' ' ' ASP . 2.2 p 48.87 -94.33 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.793 -1.192 . . . . 0.0 109.528 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.484 ' N ' ' O ' ' A' ' 7' ' ' THR . 0.3 OUTLIER 73.62 73.69 0.13 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.187 -0.946 . . . . 0.0 109.526 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 m80 -139.56 -54.91 0.56 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.209 -0.932 . . . . 0.0 109.436 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.14 14.7 1.48 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.302 -0.874 . . . . 0.0 109.386 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.442 ' SD ' ' HE2' ' A' ' 15' ' ' LYS . 3.6 tmm? -87.36 -52.92 5.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.282 -0.886 . . . . 0.0 109.321 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.83 -13.13 9.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.484 -0.76 . . . . 0.0 109.822 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.26 -33.02 5.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.227 -0.921 . . . . 0.0 109.335 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.442 ' HE2' ' SD ' ' A' ' 12' ' ' MET . 0.0 OUTLIER -89.31 -34.34 16.61 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.349 -0.844 . . . . 0.0 110.021 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.42 -46.54 37.62 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.067 -1.021 . . . . 0.0 109.061 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.618 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 23.3 t0 -60.59 -48.92 79.65 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.479 -0.763 . . . . 0.0 109.236 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.468 ' HA ' ' HA2' ' A' ' 22' ' ' GLY . 0.4 OUTLIER -52.91 -32.32 44.7 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.533 -0.729 . . . . 0.0 110.156 -179.415 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 27.2 t -60.23 -55.59 31.83 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.139 -0.976 . . . . 0.0 109.126 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.556 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 61.5 m -54.93 -21.88 13.15 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.462 -0.774 . . . . 0.0 109.677 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.442 ' HA3' ' HD2' ' A' ' 25' ' ' ARG . . . 159.0 -57.52 0.34 Allowed Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.401 -1.479 . . . . 0.0 109.401 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.491 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . 138.86 -177.12 20.45 Favored Glycine 0 N--CA 1.483 1.792 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.481 ' HB3' ' O ' ' A' ' 22' ' ' GLY . 1.0 OUTLIER 67.98 -83.84 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.42 -1.047 . . . . 0.0 109.803 179.861 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.491 ' HA2' ' OD2' ' A' ' 17' ' ' ASP . . . -162.94 47.66 0.32 Allowed Glycine 0 N--CA 1.493 2.455 0 C-N-CA 119.642 -1.266 . . . . 0.0 110.29 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -120.63 37.29 4.32 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.916 -1.344 . . . . 0.0 110.121 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.625 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -174.42 130.55 1.81 Allowed Glycine 0 N--CA 1.488 2.144 0 C-N-CA 119.951 -1.119 . . . . 0.0 110.418 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.451 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -151.68 -159.21 0.99 Allowed 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.539 -0.977 . . . . 0.0 109.214 -179.771 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.0 m -121.12 93.76 4.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.22 -0.925 . . . . 0.0 109.731 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -95.52 111.98 23.79 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.712 -1.243 . . . . 0.0 109.587 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 75.63 -131.48 12.09 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -106.06 30.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.303 -1.817 0 O-C-N 124.093 1.575 . . . . 0.0 110.421 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.461 ' OE1' ' HG2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -149.87 156.84 42.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.882 . . . . 0.0 109.571 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 3' ' ' MET . 8.4 t -99.42 122.72 42.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 0.0 109.318 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.9 mt -113.67 -166.84 1.13 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.233 -0.917 . . . . 0.0 109.52 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.625 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 92.7 m -117.25 -166.69 1.21 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.26 -0.9 . . . . 0.0 109.514 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.45 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.557 ' O ' ' CG ' ' A' ' 3' ' ' MET . 1.7 t -128.39 81.76 2.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.265 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.557 ' CG ' ' O ' ' A' ' 2' ' ' CYS . 1.2 ptm 84.47 178.65 0.04 OUTLIER Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.73 -0.606 . . . . 0.0 109.51 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -89.83 -180.0 1.97 Allowed 'Trans proline' 0 C--N 1.302 -1.877 0 O-C-N 124.213 1.638 . . . . 0.0 110.664 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.86 51.91 1.71 Allowed 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.316 -0.865 . . . . 0.0 109.374 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -151.64 84.12 1.29 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.221 -0.924 . . . . 0.0 109.473 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.404 ' OG1' ' HG3' ' A' ' 12' ' ' MET . 0.0 OUTLIER -126.91 -78.13 0.58 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.255 -0.903 . . . . 0.0 109.48 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.6 t -153.84 170.44 20.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.39 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.524 ' O ' ' CD2' ' A' ' 10' ' ' HIS . 0.4 OUTLIER -87.29 79.06 8.63 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.948 . . . . 0.0 109.491 -179.939 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.524 ' CD2' ' O ' ' A' ' 9' ' ' ASP . 7.2 m170 -153.76 59.46 0.74 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.334 -0.854 . . . . 0.0 109.106 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.447 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER 68.23 40.49 2.11 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.339 -0.851 . . . . 0.0 109.199 -179.586 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.404 ' HG3' ' OG1' ' A' ' 7' ' ' THR . 0.0 OUTLIER -60.67 -50.74 72.27 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.332 -0.855 . . . . 0.0 109.253 179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 16' ' ' CYS . . . -61.84 -11.74 14.16 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.502 -0.749 . . . . 0.0 109.76 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -62.4 -24.07 67.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.103 -0.998 . . . . 0.0 109.362 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 19' ' ' CYS . 0.5 OUTLIER -107.93 -13.42 14.98 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.317 -0.864 . . . . 0.0 109.378 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 13' ' ' ALA . 4.7 t -86.67 -21.43 26.71 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.233 -0.917 . . . . 0.0 108.722 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.613 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 34.3 t0 -88.06 -50.3 6.49 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.5 -33.43 73.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.543 -0.723 . . . . 0.0 109.528 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 15' ' ' LYS . 1.5 t -55.67 -33.43 64.11 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 71.1 m -73.38 -30.74 63.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.728 -0.607 . . . . 0.0 109.576 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.19 -42.7 0.47 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.41 162.86 27.89 Favored Glycine 0 N--CA 1.488 2.102 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.417 ' HA ' ' OD2' ' A' ' 17' ' ' ASP . 0.8 OUTLIER -52.79 110.46 0.52 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.188 -1.184 . . . . 0.0 109.361 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.95 -8.01 3.27 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.537 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -146.9 39.96 1.05 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.207 -1.173 . . . . 0.0 110.039 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.614 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -175.09 136.48 3.44 Favored Glycine 0 N--CA 1.49 2.235 0 C-N-CA 119.752 -1.214 . . . . 0.0 110.663 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.457 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -164.02 -179.43 6.22 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.55 -0.97 . . . . 0.0 109.045 -179.79 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.1 m -90.92 123.47 34.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.024 -1.048 . . . . 0.0 109.274 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.412 ' CB ' HD12 ' A' ' 34' ' ' LEU . 18.5 m-85 -146.9 155.57 42.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.505 -1.372 . . . . 0.0 109.317 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 53.25 -133.54 42.01 Favored Glycine 0 N--CA 1.486 2.013 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -113.24 38.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 123.928 1.488 . . . . 0.0 110.596 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.41 176.52 2.82 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.172 -0.955 . . . . 0.0 110.173 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.3 t -82.48 124.02 29.69 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.486 -0.758 . . . . 0.0 109.44 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.412 HD12 ' CB ' ' A' ' 29' ' ' TYR . 13.0 mt -104.01 -175.91 2.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.142 -0.974 . . . . 0.0 109.916 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.614 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 86.8 m -138.74 -162.88 1.37 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.413 -0.805 . . . . 0.0 109.319 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.517 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 3.7 tpt180 . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.362 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.7 t -104.66 -65.95 1.0 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.327 -0.858 . . . . 0.0 109.414 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.541 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -168.02 -170.15 0.21 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.277 -0.889 . . . . 0.0 109.096 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 3' ' ' MET . 36.6 Cg_endo -97.06 -169.26 0.13 Allowed 'Trans proline' 0 C--N 1.308 -1.602 0 O-C-N 123.703 1.37 . . . . 0.0 110.386 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.509 ' O ' ' CG ' ' A' ' 6' ' ' PHE . 37.2 m -128.52 67.5 1.38 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.288 -0.882 . . . . 0.0 109.578 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.509 ' CG ' ' O ' ' A' ' 5' ' ' CYS . 95.0 m-85 -156.8 62.19 0.52 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.103 -0.998 . . . . 0.0 109.803 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.39 -69.81 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.312 -0.867 . . . . 0.0 109.054 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.558 HG22 ' SD ' ' A' ' 12' ' ' MET . 9.9 t -100.2 170.94 8.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.395 -0.815 . . . . 0.0 109.255 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.411 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 0.9 OUTLIER -116.96 162.2 18.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.291 -0.88 . . . . 0.0 109.444 179.886 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.498 ' O ' ' CG ' ' A' ' 11' ' ' GLN . 21.5 m170 49.1 23.31 0.73 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.322 -0.861 . . . . 0.0 109.433 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.498 ' CG ' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER -169.81 42.63 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.361 -0.837 . . . . 0.0 109.242 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.558 ' SD ' HG22 ' A' ' 8' ' ' THR . 5.5 tpt -119.12 -57.12 2.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.345 -0.847 . . . . 0.0 109.535 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.25 -5.38 22.55 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.424 -0.798 . . . . 0.0 109.9 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.62 4.7 48.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.068 -1.02 . . . . 0.0 109.484 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.487 ' HD2' ' O ' ' A' ' 11' ' ' GLN . 12.7 mtpt -112.7 -29.48 7.42 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.181 -0.949 . . . . 0.0 109.471 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.433 ' SG ' ' C ' ' A' ' 27' ' ' LYS . 3.4 t -67.54 -52.92 33.17 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.222 -0.924 . . . . 0.0 108.601 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.565 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 26.9 t0 -61.38 -47.51 85.49 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.386 -0.821 . . . . 0.0 109.034 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.86 -31.24 69.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.41 -0.806 . . . . 0.0 109.738 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.81 -40.23 87.71 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.359 -0.838 . . . . 0.0 109.291 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.473 ' SG ' ' O ' ' A' ' 25' ' ' ARG . 27.5 m -56.9 -31.64 65.09 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.475 -0.766 . . . . 0.0 109.994 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 119.13 4.05 12.67 Favored Glycine 0 N--CA 1.493 2.434 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.394 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.506 ' HA3' ' CG ' ' A' ' 25' ' ' ARG . . . -140.49 168.41 25.2 Favored Glycine 0 N--CA 1.485 1.965 0 O-C-N 121.032 -1.275 . . . . 0.0 110.009 179.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.419 ' O ' ' HG2' ' A' ' 23' ' ' LYS . 7.6 ttpm? -87.65 14.65 8.04 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.335 -1.097 . . . . 0.0 109.576 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.436 ' HA2' ' OD2' ' A' ' 17' ' ' ASP . . . -166.07 21.79 0.12 Allowed Glycine 0 N--CA 1.49 2.282 0 C-N-CA 119.544 -1.312 . . . . 0.0 110.634 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.506 ' CG ' ' HA3' ' A' ' 22' ' ' GLY . 1.2 ptp180 -117.24 39.03 3.37 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.618 -1.519 . . . . 0.0 110.083 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.579 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -174.01 153.16 16.3 Favored Glycine 0 N--CA 1.491 2.306 0 C-N-CA 119.901 -1.142 . . . . 0.0 110.597 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.433 ' C ' ' SG ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -178.23 143.2 0.28 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.421 -1.047 . . . . 0.0 109.381 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 1.7 m -59.11 87.56 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 109.792 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.42 ' O ' ' C ' ' A' ' 30' ' ' GLY . 13.5 m-85 -97.59 164.97 12.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.859 -1.151 . . . . 0.0 109.065 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 29' ' ' TYR . . . 45.19 -129.43 8.39 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.408 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 36.0 Cg_endo -108.34 10.92 0.13 Allowed 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 123.954 1.502 . . . . 0.0 110.426 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 31' ' ' PRO . 34.5 mt-30 -147.88 159.25 44.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.141 -0.974 . . . . 0.0 110.098 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 28' ' ' CYS . 6.0 t -82.16 122.68 28.18 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.432 -0.793 . . . . 0.0 109.597 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.6 mt -127.64 -171.28 2.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.296 -0.877 . . . . 0.0 109.163 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.579 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 86.8 m -107.28 174.3 5.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -0.933 . . . . 0.0 109.609 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.476 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ptp . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.407 ' O ' ' C ' ' A' ' 3' ' ' MET . 1.9 t -110.1 -178.51 3.53 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.271 -0.893 . . . . 0.0 109.499 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.54 ' HE1' ' HE2' ' A' ' 12' ' ' MET . 3.0 ptt? -44.77 155.45 0.39 Allowed Pre-proline 0 N--CA 1.488 1.455 0 O-C-N 121.228 -0.92 . . . . 0.0 109.363 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.505 ' HD2' ' HB2' ' A' ' 3' ' ' MET . 36.4 Cg_endo -57.53 -162.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.801 0 O-C-N 124.051 1.553 . . . . 0.0 110.214 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.515 ' O ' ' CD1' ' A' ' 6' ' ' PHE . 1.1 m -134.35 70.98 1.44 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.27 -0.893 . . . . 0.0 109.604 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.515 ' CD1' ' O ' ' A' ' 5' ' ' CYS . 30.1 m-85 -150.85 40.85 0.74 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.37 -0.831 . . . . 0.0 109.239 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.18 148.51 50.61 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.287 -0.883 . . . . 0.0 109.524 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.3 p 49.91 -160.91 0.06 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.316 -0.865 . . . . 0.0 109.732 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.0 -44.35 0.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.355 -0.841 . . . . 0.0 109.237 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.464 ' O ' ' NH2' ' A' ' 14' ' ' ARG . 7.3 m170 -88.99 3.83 50.29 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.403 -0.811 . . . . 0.0 109.539 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -154.96 58.06 0.67 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.225 -0.922 . . . . 0.0 109.616 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.54 ' HE2' ' HE1' ' A' ' 3' ' ' MET . 0.0 OUTLIER -111.1 -53.98 2.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.267 -0.896 . . . . 0.0 109.189 179.828 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.19 7.29 9.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.478 -0.764 . . . . 0.0 109.664 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.464 ' NH2' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER -79.96 -12.56 59.71 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.176 -0.952 . . . . 0.0 109.584 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.2 -12.89 4.53 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.118 -0.989 . . . . 0.0 110.221 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -63.19 1.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.983 -1.073 . . . . 0.0 109.077 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.58 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 13.9 t0 -49.6 -46.48 49.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.361 -0.837 . . . . 0.0 109.372 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -60.99 -37.48 82.64 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.453 -0.779 . . . . 0.0 110.034 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.2 t -51.16 -41.87 60.42 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.098 -1.001 . . . . 0.0 109.226 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.499 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 1.7 m -80.51 -34.55 35.56 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.47 -0.769 . . . . 0.0 110.117 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 171.3 -52.56 0.18 Allowed Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.481 ' O ' ' CD ' ' A' ' 25' ' ' ARG . . . 115.0 170.31 16.32 Favored Glycine 0 N--CA 1.483 1.791 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 22' ' ' GLY . 10.5 tttt 71.44 28.61 2.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.304 -1.115 . . . . 0.0 109.642 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.474 ' O ' ' HB2' ' A' ' 36' ' ' ARG . . . 88.89 20.92 44.74 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.505 ' HA ' ' HB2' ' A' ' 36' ' ' ARG . 0.9 OUTLIER -103.6 33.6 3.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.21 -1.171 . . . . 0.0 109.493 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.58 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . 174.64 127.17 0.99 Allowed Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -146.13 -175.7 4.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.159 -1.201 . . . . 0.0 110.006 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.4 m -92.71 98.4 11.39 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.529 -0.732 . . . . 0.0 109.738 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -95.12 99.83 11.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.637 -1.29 . . . . 0.0 109.558 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 55.68 -127.73 43.18 Favored Glycine 0 N--CA 1.488 2.113 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -97.8 40.44 0.1 OUTLIER 'Trans proline' 0 C--N 1.301 -1.952 0 O-C-N 124.221 1.643 . . . . 0.0 110.299 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -160.41 123.88 3.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.252 -0.905 . . . . 0.0 109.785 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.449 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 13.3 t -86.99 123.73 32.41 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.295 -0.878 . . . . 0.0 108.826 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.469 ' O ' ' HA2' ' A' ' 26' ' ' GLY . 2.1 mt -133.89 -178.67 5.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.004 -1.06 . . . . 0.0 110.077 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.506 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 4.3 m -88.73 176.4 7.1 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.461 -0.774 . . . . 0.0 109.365 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.505 ' HB2' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 118.006 -0.997 . . . . 0.0 109.515 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.62 ' HB3' HD23 ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.7 t -120.72 -31.39 4.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.198 -0.939 . . . . 0.0 109.873 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.534 ' CB ' ' CD ' ' A' ' 4' ' ' PRO . 2.0 ptm -177.0 -172.3 0.15 Allowed Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.206 -0.934 . . . . 0.0 109.294 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.534 ' CD ' ' CB ' ' A' ' 3' ' ' MET . 36.1 Cg_endo -85.37 -164.85 0.25 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 123.85 1.447 . . . . 0.0 110.015 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.401 ' O ' ' CD1' ' A' ' 6' ' ' PHE . 1.3 m -132.87 179.11 6.37 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.17 -0.956 . . . . 0.0 109.922 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.401 ' CD1' ' O ' ' A' ' 5' ' ' CYS . 34.5 m-85 -149.41 -168.67 3.17 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.399 -0.813 . . . . 0.0 109.419 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.662 ' C ' HG23 ' A' ' 8' ' ' THR . 0.0 OUTLIER -128.58 -171.78 2.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 109.72 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.662 HG23 ' C ' ' A' ' 7' ' ' THR . 1.2 p 67.3 171.98 0.26 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.335 -0.853 . . . . 0.0 109.456 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -89.95 95.26 10.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.272 -0.892 . . . . 0.0 109.468 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 11' ' ' GLN . 4.5 m170 -126.63 -4.3 6.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.226 -0.921 . . . . 0.0 109.576 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.469 ' HB2' ' O ' ' A' ' 10' ' ' HIS . 41.5 mt-30 63.18 54.54 2.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.203 -0.936 . . . . 0.0 109.513 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.47 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 2.1 tmm? -120.45 -58.3 1.85 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.361 -0.837 . . . . 0.0 109.428 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.75 -11.25 11.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.362 -0.836 . . . . 0.0 110.064 -179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.24 -27.59 27.83 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.104 -0.998 . . . . 0.0 109.968 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.486 ' HG3' ' N ' ' A' ' 16' ' ' CYS . 4.8 ptmm? -84.68 -32.81 23.39 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 120.976 -1.078 . . . . 0.0 109.738 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.486 ' N ' ' HG3' ' A' ' 15' ' ' LYS . 39.6 t -47.39 -53.95 12.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 109.61 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.59 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 48.5 t0 -44.41 -52.78 7.48 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.172 -0.955 . . . . 0.0 109.249 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -48.86 -43.73 39.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.441 -0.787 . . . . 0.0 109.38 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -49.45 -45.83 47.08 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.532 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 54.3 m -58.2 -38.54 76.94 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.87 -0.518 . . . . 0.0 109.641 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 165.78 -44.73 0.28 Allowed Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.486 -1.445 . . . . 0.0 109.486 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.476 ' O ' ' OD1' ' A' ' 17' ' ' ASP . . . -177.8 176.74 48.18 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.96 -1.656 . . . . 0.0 108.96 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 pttm -60.3 149.42 33.55 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.881 -1.364 . . . . 0.0 109.451 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 80.76 12.48 82.73 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.532 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -148.65 37.09 0.81 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.88 -1.365 . . . . 0.0 109.835 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.59 ' HA3' ' HA ' ' A' ' 17' ' ' ASP . . . 167.59 143.02 3.64 Favored Glycine 0 N--CA 1.49 2.28 0 C-N-CA 119.761 -1.209 . . . . 0.0 110.327 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.46 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 0.2 OUTLIER 171.44 -169.82 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.138 -1.213 . . . . 0.0 109.333 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.4 m -74.57 80.18 1.98 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.292 -0.88 . . . . 0.0 109.514 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -98.35 138.88 34.95 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 120.984 -1.073 . . . . 0.0 109.0 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 69.46 -138.21 30.19 Favored Glycine 0 N--CA 1.485 1.952 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.477 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 35.6 Cg_endo -94.63 3.2 2.71 Favored 'Trans proline' 0 C--N 1.302 -1.92 0 O-C-N 123.961 1.506 . . . . 0.0 110.315 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 31' ' ' PRO . 8.7 mt-30 -145.24 -159.39 1.0 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.264 -0.897 . . . . 0.0 109.656 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 3' ' ' MET . 8.0 t -108.79 103.73 12.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.222 -0.923 . . . . 0.0 109.684 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.62 HD23 ' HB3' ' A' ' 1' ' ' MET . 6.4 mt -109.1 -172.15 1.99 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.371 -0.831 . . . . 0.0 109.531 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.542 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 66.1 m -106.61 170.7 7.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.31 -0.869 . . . . 0.0 109.47 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.459 ' O ' ' O ' ' A' ' 35' ' ' CYS . 1.6 mtp85 . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 118.05 -0.976 . . . . 0.0 109.671 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.29 0.567 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.8 t -112.23 -120.02 0.29 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.168 -0.958 . . . . 0.0 109.485 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.595 ' CB ' ' CD ' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -102.52 -154.77 0.02 OUTLIER Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 120.718 -1.239 . . . . 0.0 109.358 -179.799 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.595 ' CD ' ' CB ' ' A' ' 3' ' ' MET . 36.6 Cg_endo -109.07 -160.72 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.51 0 O-C-N 123.702 1.369 . . . . 0.0 110.456 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.479 ' HB2' ' HB3' ' A' ' 28' ' ' CYS . 1.4 m -158.51 178.87 9.67 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.282 -0.886 . . . . 0.0 109.647 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -112.43 -164.62 0.93 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.429 -0.794 . . . . 0.0 109.158 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.467 ' O ' HG23 ' A' ' 8' ' ' THR . 0.9 OUTLIER -111.81 17.44 19.8 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.31 -0.869 . . . . 0.0 109.127 179.6 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.474 ' O ' ' HB2' ' A' ' 9' ' ' ASP . 1.3 p -154.94 -166.06 2.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.32 -0.863 . . . . 0.0 109.326 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 8' ' ' THR . 0.2 OUTLIER 72.22 160.75 0.23 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.107 -0.996 . . . . 0.0 109.592 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.9 m80 -121.13 -25.89 5.21 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -0.919 . . . . 0.0 109.664 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.73 12.57 8.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.177 -0.952 . . . . 0.0 109.536 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.451 ' HG3' ' SG ' ' A' ' 5' ' ' CYS . 9.0 tpt -80.15 -67.22 0.79 Allowed 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.213 -0.929 . . . . 0.0 109.277 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.35 -9.08 15.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.592 -0.692 . . . . 0.0 109.96 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -28.08 66.81 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.958 -1.089 . . . . 0.0 109.679 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.0 -41.23 9.25 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.18 -0.95 . . . . 0.0 109.256 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -51.32 70.25 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.24 -0.912 . . . . 0.0 108.962 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.557 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 58.2 t0 -50.84 -53.33 33.1 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.52 -34.8 59.46 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.3 t -49.62 -43.72 46.87 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 1.6 m -79.51 -32.0 42.27 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.542 -0.724 . . . . 0.0 110.128 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.66 -66.9 0.09 OUTLIER Glycine 0 N--CA 1.491 2.34 0 C-N-CA 119.653 -1.26 . . . . 0.0 110.018 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.469 ' O ' ' OD1' ' A' ' 17' ' ' ASP . . . -178.91 -171.71 42.43 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.703 -1.359 . . . . 0.0 109.703 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.2 mtmt -55.41 120.84 7.75 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.296 -1.12 . . . . 0.0 109.636 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.415 ' C ' ' HG3' ' A' ' 25' ' ' ARG . . . 97.45 11.57 51.03 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.415 ' HG3' ' C ' ' A' ' 24' ' ' GLY . 70.5 mtt180 -149.19 38.36 0.8 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.151 -1.205 . . . . 0.0 109.576 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.611 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . 170.0 134.2 1.71 Allowed Glycine 0 N--CA 1.488 2.147 0 C-N-CA 119.957 -1.116 . . . . 0.0 110.447 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.543 ' HD3' ' CE1' ' A' ' 29' ' ' TYR . 40.8 tttp -158.42 149.07 20.32 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.44 -1.035 . . . . 0.0 109.147 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 99.5 m -82.89 77.48 9.63 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.165 -0.96 . . . . 0.0 109.617 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.543 ' CE1' ' HD3' ' A' ' 27' ' ' LYS . 35.8 m-85 -64.52 113.82 3.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.04 -1.038 . . . . 0.0 109.289 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 54.74 -139.99 38.71 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -87.39 35.37 0.44 Allowed 'Trans proline' 0 C--N 1.303 -1.816 0 O-C-N 124.032 1.543 . . . . 0.0 110.251 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -148.86 138.78 22.11 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.207 -0.933 . . . . 0.0 109.601 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 28' ' ' CYS . 6.8 t -101.71 120.4 40.29 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.283 -0.885 . . . . 0.0 109.563 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.422 HD12 ' HD2' ' A' ' 29' ' ' TYR . 48.5 mt -122.9 -164.71 1.22 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.285 -0.885 . . . . 0.0 109.757 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.611 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 34.9 m -106.52 -175.26 2.75 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.421 -0.799 . . . . 0.0 109.434 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.417 ' HG3' ' OXT' ' A' ' 36' ' ' ARG . 18.8 tpt180 . . . . . 0 C--N 1.305 -1.328 0 CA-C-O 118.083 -0.961 . . . . 0.0 109.619 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.461 ' SD ' ' HA ' ' A' ' 32' ' ' GLN . 3.7 ptt? . . . . . 0 N--CA 1.492 1.647 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.447 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 3.9 t -105.7 120.11 40.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.112 -0.993 . . . . 0.0 109.528 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.549 ' HG3' ' HD2' ' A' ' 4' ' ' PRO . 4.6 tpt 60.14 168.93 0.08 OUTLIER Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.223 -0.923 . . . . 0.0 109.726 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.549 ' HD2' ' HG3' ' A' ' 3' ' ' MET . 36.7 Cg_endo -119.61 89.09 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 O-C-N 124.111 1.585 . . . . 0.0 110.394 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.42 ' O ' ' O ' ' A' ' 4' ' ' PRO . 91.9 m -50.53 177.82 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.04 -1.037 . . . . 0.0 109.268 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.455 ' O ' ' HB ' ' A' ' 7' ' ' THR . 27.8 m-85 53.26 -174.24 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.155 -0.966 . . . . 0.0 109.473 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.73 HG22 ' O ' ' A' ' 7' ' ' THR . 52.7 m 60.63 14.29 4.86 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.221 -0.925 . . . . 0.0 109.427 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.631 HG22 ' C ' ' A' ' 7' ' ' THR . 0.1 OUTLIER 178.15 175.66 0.51 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.254 -0.904 . . . . 0.0 109.544 179.969 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.567 ' O ' ' CG ' ' A' ' 10' ' ' HIS . 0.2 OUTLIER -167.26 75.39 0.15 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.493 -179.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.567 ' CG ' ' O ' ' A' ' 9' ' ' ASP . 80.5 m80 -159.89 56.98 0.37 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.241 -0.912 . . . . 0.0 109.606 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.511 ' CB ' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER 76.28 65.25 0.05 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -0.917 . . . . 0.0 109.28 -179.991 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.416 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 0.5 OUTLIER -127.68 -56.55 1.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.171 -0.956 . . . . 0.0 109.518 -179.848 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.445 ' HA ' ' HB2' ' A' ' 16' ' ' CYS . . . -67.69 -9.27 42.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.322 -0.861 . . . . 0.0 109.896 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.483 ' HD3' ' HG2' ' A' ' 11' ' ' GLN . 4.5 mtp180 -67.83 -33.78 75.45 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.143 -0.973 . . . . 0.0 109.55 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 12' ' ' MET . 0.1 OUTLIER -93.74 -22.13 18.9 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.193 -0.942 . . . . 0.0 109.883 -179.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -50.02 -58.92 4.47 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.21 -0.931 . . . . 0.0 109.56 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.621 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 8.0 t0 -57.62 -52.64 64.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.235 -0.915 . . . . 0.0 109.168 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.425 ' HA ' ' HA2' ' A' ' 22' ' ' GLY . 0.2 OUTLIER -48.0 -26.63 1.85 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 109.064 179.712 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.1 t -62.07 -50.06 73.48 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 1.4 m -68.96 -30.4 68.82 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.658 -0.651 . . . . 0.0 110.271 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 177.72 -69.38 0.08 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.686 -1.366 . . . . 0.0 109.686 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.456 ' O ' ' N ' ' A' ' 24' ' ' GLY . . . 176.75 178.85 46.83 Favored Glycine 0 N--CA 1.485 1.956 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 22' ' ' GLY . 29.1 mtmm -44.25 98.5 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -1.127 . . . . 0.0 109.497 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 22' ' ' GLY . . . 128.32 7.84 4.27 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 119.821 -1.18 . . . . 0.0 110.183 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.524 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 12.0 mtt180 -146.99 40.39 1.06 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.059 -1.259 . . . . 0.0 109.561 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.679 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -166.86 150.99 18.64 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -162.74 131.08 3.92 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.473 -1.016 . . . . 0.0 109.247 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 63.9 m -80.33 82.54 6.35 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -80.95 114.71 20.01 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.883 -1.135 . . . . 0.0 108.771 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 56.38 -131.04 50.62 Favored Glycine 0 N--CA 1.488 2.133 0 N-CA-C 108.978 -1.649 . . . . 0.0 108.978 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -95.69 -1.77 2.19 Favored 'Trans proline' 0 C--N 1.301 -1.965 0 O-C-N 124.14 1.6 . . . . 0.0 110.392 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.461 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 69.3 mt-30 -99.43 117.23 33.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.203 -0.935 . . . . 0.0 110.357 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.1 t -92.44 107.03 18.91 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.395 -0.816 . . . . 0.0 108.869 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.3 mt -123.25 -161.3 0.96 Allowed 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.175 -0.953 . . . . 0.0 109.816 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.679 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 10.7 m -82.72 -168.98 2.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.447 -0.783 . . . . 0.0 109.774 -179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.0 ttt-85 . . . . . 0 C--N 1.304 -1.389 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.405 -179.962 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.461 ' HG2' ' OE1' ' A' ' 32' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.269 0.557 . . . . 0.0 109.633 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.463 ' O ' ' CB ' ' A' ' 33' ' ' CYS . 5.3 t -121.54 118.39 29.16 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 109.811 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.57 ' HG3' ' HD2' ' A' ' 4' ' ' PRO . 1.9 tpp 56.61 163.78 0.07 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.278 -0.888 . . . . 0.0 109.624 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.57 ' HD2' ' HG3' ' A' ' 3' ' ' MET . 35.6 Cg_endo -109.98 -159.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 O-C-N 124.174 1.618 . . . . 0.0 110.136 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -147.72 132.2 17.68 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.304 -0.873 . . . . 0.0 109.493 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.471 ' O ' ' C ' ' A' ' 7' ' ' THR . 97.2 m-85 -107.42 86.26 2.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.234 -0.916 . . . . 0.0 109.605 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.484 ' O ' ' N ' ' A' ' 9' ' ' ASP . 3.1 m 37.98 -132.1 0.15 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.737 -0.602 . . . . 0.0 109.795 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.476 ' O ' ' CB ' ' A' ' 9' ' ' ASP . 2.2 p 48.87 -94.33 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.793 -1.192 . . . . 0.0 109.528 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.484 ' N ' ' O ' ' A' ' 7' ' ' THR . 0.3 OUTLIER 73.62 73.69 0.13 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.187 -0.946 . . . . 0.0 109.526 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 m80 -139.56 -54.91 0.56 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.209 -0.932 . . . . 0.0 109.436 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.14 14.7 1.48 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.302 -0.874 . . . . 0.0 109.386 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.442 ' SD ' ' HE2' ' A' ' 15' ' ' LYS . 3.6 tmm? -87.36 -52.92 5.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.282 -0.886 . . . . 0.0 109.321 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.83 -13.13 9.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.484 -0.76 . . . . 0.0 109.822 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.26 -33.02 5.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.227 -0.921 . . . . 0.0 109.335 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.442 ' HE2' ' SD ' ' A' ' 12' ' ' MET . 0.0 OUTLIER -89.31 -34.34 16.61 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.349 -0.844 . . . . 0.0 110.021 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -48.42 -46.54 37.62 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.067 -1.021 . . . . 0.0 109.061 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.618 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 23.3 t0 -60.59 -48.92 79.65 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.479 -0.763 . . . . 0.0 109.236 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.468 ' HA ' ' HA2' ' A' ' 22' ' ' GLY . 0.4 OUTLIER -52.91 -32.32 44.7 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.533 -0.729 . . . . 0.0 110.156 -179.415 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 27.2 t -60.23 -55.59 31.83 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.139 -0.976 . . . . 0.0 109.126 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.556 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 61.5 m -54.93 -21.88 13.15 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.462 -0.774 . . . . 0.0 109.677 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.442 ' HA3' ' HD2' ' A' ' 25' ' ' ARG . . . 159.0 -57.52 0.34 Allowed Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.401 -1.479 . . . . 0.0 109.401 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.491 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . 138.86 -177.12 20.45 Favored Glycine 0 N--CA 1.483 1.792 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.481 ' HB3' ' O ' ' A' ' 22' ' ' GLY . 1.0 OUTLIER 67.98 -83.84 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.42 -1.047 . . . . 0.0 109.803 179.861 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.491 ' HA2' ' OD2' ' A' ' 17' ' ' ASP . . . -162.94 47.66 0.32 Allowed Glycine 0 N--CA 1.493 2.455 0 C-N-CA 119.642 -1.266 . . . . 0.0 110.29 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -120.63 37.29 4.32 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.916 -1.344 . . . . 0.0 110.121 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.625 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -174.42 130.55 1.81 Allowed Glycine 0 N--CA 1.488 2.144 0 C-N-CA 119.951 -1.119 . . . . 0.0 110.418 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.451 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -151.68 -159.21 0.99 Allowed 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.539 -0.977 . . . . 0.0 109.214 -179.771 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.0 m -121.12 93.76 4.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.22 -0.925 . . . . 0.0 109.731 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -95.52 111.98 23.79 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.712 -1.243 . . . . 0.0 109.587 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 75.63 -131.48 12.09 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -106.06 30.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.303 -1.817 0 O-C-N 124.093 1.575 . . . . 0.0 110.421 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.461 ' OE1' ' HG2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -149.87 156.84 42.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.882 . . . . 0.0 109.571 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 3' ' ' MET . 8.4 t -99.42 122.72 42.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 0.0 109.318 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.9 mt -113.67 -166.84 1.13 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.233 -0.917 . . . . 0.0 109.52 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.625 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 92.7 m -117.25 -166.69 1.21 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.26 -0.9 . . . . 0.0 109.514 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.45 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.557 ' O ' ' CG ' ' A' ' 3' ' ' MET . 1.7 t -128.39 81.76 2.04 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.265 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.557 ' CG ' ' O ' ' A' ' 2' ' ' CYS . 1.2 ptm 84.47 178.65 0.04 OUTLIER Pre-proline 0 N--CA 1.494 1.739 0 O-C-N 121.73 -0.606 . . . . 0.0 109.51 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -89.83 -180.0 1.97 Allowed 'Trans proline' 0 C--N 1.302 -1.877 0 O-C-N 124.213 1.638 . . . . 0.0 110.664 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.86 51.91 1.71 Allowed 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.316 -0.865 . . . . 0.0 109.374 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -151.64 84.12 1.29 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.221 -0.924 . . . . 0.0 109.473 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.404 ' OG1' ' HG3' ' A' ' 12' ' ' MET . 0.0 OUTLIER -126.91 -78.13 0.58 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.255 -0.903 . . . . 0.0 109.48 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.6 t -153.84 170.44 20.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.39 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.524 ' O ' ' CD2' ' A' ' 10' ' ' HIS . 0.4 OUTLIER -87.29 79.06 8.63 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.948 . . . . 0.0 109.491 -179.939 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.524 ' CD2' ' O ' ' A' ' 9' ' ' ASP . 7.2 m170 -153.76 59.46 0.74 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.334 -0.854 . . . . 0.0 109.106 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.447 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER 68.23 40.49 2.11 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.339 -0.851 . . . . 0.0 109.199 -179.586 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.404 ' HG3' ' OG1' ' A' ' 7' ' ' THR . 0.0 OUTLIER -60.67 -50.74 72.27 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.332 -0.855 . . . . 0.0 109.253 179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 16' ' ' CYS . . . -61.84 -11.74 14.16 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.502 -0.749 . . . . 0.0 109.76 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -62.4 -24.07 67.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.103 -0.998 . . . . 0.0 109.362 179.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 19' ' ' CYS . 0.5 OUTLIER -107.93 -13.42 14.98 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.317 -0.864 . . . . 0.0 109.378 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 13' ' ' ALA . 4.7 t -86.67 -21.43 26.71 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.233 -0.917 . . . . 0.0 108.722 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.613 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 34.3 t0 -88.06 -50.3 6.49 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.5 -33.43 73.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.543 -0.723 . . . . 0.0 109.528 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 15' ' ' LYS . 1.5 t -55.67 -33.43 64.11 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 25' ' ' ARG . 71.1 m -73.38 -30.74 63.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.728 -0.607 . . . . 0.0 109.576 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 159.19 -42.7 0.47 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.41 162.86 27.89 Favored Glycine 0 N--CA 1.488 2.102 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.417 ' HA ' ' OD2' ' A' ' 17' ' ' ASP . 0.8 OUTLIER -52.79 110.46 0.52 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.188 -1.184 . . . . 0.0 109.361 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.95 -8.01 3.27 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.537 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -146.9 39.96 1.05 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.207 -1.173 . . . . 0.0 110.039 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.614 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -175.09 136.48 3.44 Favored Glycine 0 N--CA 1.49 2.235 0 C-N-CA 119.752 -1.214 . . . . 0.0 110.663 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.457 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -164.02 -179.43 6.22 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.55 -0.97 . . . . 0.0 109.045 -179.79 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.1 m -90.92 123.47 34.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.024 -1.048 . . . . 0.0 109.274 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.412 ' CB ' HD12 ' A' ' 34' ' ' LEU . 18.5 m-85 -146.9 155.57 42.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.505 -1.372 . . . . 0.0 109.317 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 53.25 -133.54 42.01 Favored Glycine 0 N--CA 1.486 2.013 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -113.24 38.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 123.928 1.488 . . . . 0.0 110.596 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.41 176.52 2.82 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.172 -0.955 . . . . 0.0 110.173 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.3 t -82.48 124.02 29.69 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.486 -0.758 . . . . 0.0 109.44 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.412 HD12 ' CB ' ' A' ' 29' ' ' TYR . 13.0 mt -104.01 -175.91 2.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.142 -0.974 . . . . 0.0 109.916 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.614 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 86.8 m -138.74 -162.88 1.37 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.413 -0.805 . . . . 0.0 109.319 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.517 ' HB3' ' HA ' ' A' ' 25' ' ' ARG . 3.7 tpt180 . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.362 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.7 t -104.66 -65.95 1.0 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.327 -0.858 . . . . 0.0 109.414 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.541 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -168.02 -170.15 0.21 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.277 -0.889 . . . . 0.0 109.096 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 3' ' ' MET . 36.6 Cg_endo -97.06 -169.26 0.13 Allowed 'Trans proline' 0 C--N 1.308 -1.602 0 O-C-N 123.703 1.37 . . . . 0.0 110.386 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.509 ' O ' ' CG ' ' A' ' 6' ' ' PHE . 37.2 m -128.52 67.5 1.38 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.288 -0.882 . . . . 0.0 109.578 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.509 ' CG ' ' O ' ' A' ' 5' ' ' CYS . 95.0 m-85 -156.8 62.19 0.52 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.103 -0.998 . . . . 0.0 109.803 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.39 -69.81 0.39 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.312 -0.867 . . . . 0.0 109.054 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.558 HG22 ' SD ' ' A' ' 12' ' ' MET . 9.9 t -100.2 170.94 8.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.395 -0.815 . . . . 0.0 109.255 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.411 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 0.9 OUTLIER -116.96 162.2 18.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.291 -0.88 . . . . 0.0 109.444 179.886 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.498 ' O ' ' CG ' ' A' ' 11' ' ' GLN . 21.5 m170 49.1 23.31 0.73 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.322 -0.861 . . . . 0.0 109.433 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.498 ' CG ' ' O ' ' A' ' 10' ' ' HIS . 0.0 OUTLIER -169.81 42.63 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.361 -0.837 . . . . 0.0 109.242 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.558 ' SD ' HG22 ' A' ' 8' ' ' THR . 5.5 tpt -119.12 -57.12 2.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.345 -0.847 . . . . 0.0 109.535 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.25 -5.38 22.55 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.424 -0.798 . . . . 0.0 109.9 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.62 4.7 48.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.068 -1.02 . . . . 0.0 109.484 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.487 ' HD2' ' O ' ' A' ' 11' ' ' GLN . 12.7 mtpt -112.7 -29.48 7.42 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.181 -0.949 . . . . 0.0 109.471 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.433 ' SG ' ' C ' ' A' ' 27' ' ' LYS . 3.4 t -67.54 -52.92 33.17 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.222 -0.924 . . . . 0.0 108.601 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.565 ' HA ' ' HA3' ' A' ' 26' ' ' GLY . 26.9 t0 -61.38 -47.51 85.49 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.386 -0.821 . . . . 0.0 109.034 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.86 -31.24 69.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.41 -0.806 . . . . 0.0 109.738 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.81 -40.23 87.71 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.359 -0.838 . . . . 0.0 109.291 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.473 ' SG ' ' O ' ' A' ' 25' ' ' ARG . 27.5 m -56.9 -31.64 65.09 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.475 -0.766 . . . . 0.0 109.994 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 119.13 4.05 12.67 Favored Glycine 0 N--CA 1.493 2.434 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.394 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.506 ' HA3' ' CG ' ' A' ' 25' ' ' ARG . . . -140.49 168.41 25.2 Favored Glycine 0 N--CA 1.485 1.965 0 O-C-N 121.032 -1.275 . . . . 0.0 110.009 179.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.419 ' O ' ' HG2' ' A' ' 23' ' ' LYS . 7.6 ttpm? -87.65 14.65 8.04 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.335 -1.097 . . . . 0.0 109.576 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.436 ' HA2' ' OD2' ' A' ' 17' ' ' ASP . . . -166.07 21.79 0.12 Allowed Glycine 0 N--CA 1.49 2.282 0 C-N-CA 119.544 -1.312 . . . . 0.0 110.634 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.506 ' CG ' ' HA3' ' A' ' 22' ' ' GLY . 1.2 ptp180 -117.24 39.03 3.37 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.618 -1.519 . . . . 0.0 110.083 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.579 ' HA2' ' HA ' ' A' ' 35' ' ' CYS . . . -174.01 153.16 16.3 Favored Glycine 0 N--CA 1.491 2.306 0 C-N-CA 119.901 -1.142 . . . . 0.0 110.597 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.433 ' C ' ' SG ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -178.23 143.2 0.28 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.421 -1.047 . . . . 0.0 109.381 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 1.7 m -59.11 87.56 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 109.792 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.42 ' O ' ' C ' ' A' ' 30' ' ' GLY . 13.5 m-85 -97.59 164.97 12.2 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.859 -1.151 . . . . 0.0 109.065 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 29' ' ' TYR . . . 45.19 -129.43 8.39 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.408 ' O ' ' HG2' ' A' ' 32' ' ' GLN . 36.0 Cg_endo -108.34 10.92 0.13 Allowed 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 123.954 1.502 . . . . 0.0 110.426 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 31' ' ' PRO . 34.5 mt-30 -147.88 159.25 44.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.141 -0.974 . . . . 0.0 110.098 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 28' ' ' CYS . 6.0 t -82.16 122.68 28.18 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.432 -0.793 . . . . 0.0 109.597 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 58.6 mt -127.64 -171.28 2.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.296 -0.877 . . . . 0.0 109.163 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.579 ' HA ' ' HA2' ' A' ' 26' ' ' GLY . 86.8 m -107.28 174.3 5.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -0.933 . . . . 0.0 109.609 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.476 -179.896 . . . . . . . . 1 1 . 1 stop_ save_