data_1bw6_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 1bw6 _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 full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.026 0 CA-C-O 121.428 0.632 . . . . 6.1 110.906 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -163.93 -77.65 0.03 OUTLIER Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.085 -1.606 . . . . 4.22 109.085 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.574 ' HB3' ' HB3' ' A' ' 8' ' ' LEU . 57.5 Cg_endo -78.64 -103.33 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.202 0 O-C-N 123.704 1.37 . . . . 4.97 109.111 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.527 ' HA ' HG21 ' A' ' 37' ' ' ILE . 0.0 OUTLIER 46.66 36.61 3.83 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.135 -0.978 . . . . 3.99 112.044 178.463 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.5 ttt85 -166.44 -56.85 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.887 -1.133 . . . . 5.07 112.05 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.3 ttp180 -140.32 -52.84 0.5 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.972 -1.08 . . . . 5.48 112.286 -178.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.24 -176.08 4.33 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.853 -1.154 . . . . 2.25 111.894 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.574 ' HB3' ' HB3' ' A' ' 3' ' ' PRO . 2.4 pp -156.75 -167.04 2.26 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.756 -0.59 . . . . 1.95 110.465 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 69.0 p -90.39 148.25 22.94 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.948 -1.095 . . . . 1.63 110.831 -179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -54.75 -35.57 63.89 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 121.524 -0.735 . . . . 1.18 111.554 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 -60.94 -56.34 22.34 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.315 -0.865 . . . . 4.33 111.144 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.467 ' CG ' HD11 ' A' ' 8' ' ' LEU . 9.6 pt-20 -70.6 -21.37 62.67 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.204 -0.935 . . . . 1.81 110.369 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.494 ' HD3' ' CG2' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -64.91 -35.17 80.28 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.322 -0.861 . . . . 3.54 109.75 178.982 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.403 ' HA ' HD11 ' A' ' 17' ' ' ILE . 18.8 t -61.18 -41.83 97.5 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.633 -0.667 . . . . 1.2 109.564 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 32.3 mtp85 -61.78 -36.88 82.36 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.702 -0.624 . . . . 4.26 109.744 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.512 HG22 ' HG ' ' A' ' 42' ' ' LEU . 1.2 mp -61.67 -44.33 98.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 N-CA-C 109.296 -0.631 . . . . 1.2 109.296 179.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.48 HG13 HD11 ' A' ' 45' ' ' ILE . 3.7 mt -61.61 -33.82 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.722 -0.611 . . . . 1.32 110.471 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -72.15 -36.7 69.39 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.355 -0.841 . . . . 2.07 110.918 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -88.95 -11.7 43.69 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.288 -0.883 . . . . 1.51 111.621 -179.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.649 ' HA ' HG22 ' A' ' 31' ' ' ILE . 5.2 p -97.93 -28.08 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 120.963 -1.085 . . . . 1.14 110.916 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -95.95 -21.51 17.99 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.168 -0.957 . . . . 2.59 110.826 179.876 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.419 ' N ' ' HG3' ' A' ' 21' ' ' GLU . 3.4 mt-10 -62.81 -40.56 97.75 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.267 -0.895 . . . . 2.14 110.51 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -81.94 114.26 49.2 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.592 -0.692 . . . . 1.83 110.3 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -82.54 -11.99 10.3 Favored 'Trans proline' 0 C--N 1.314 -1.282 0 O-C-N 123.924 1.486 . . . . 2.46 112.203 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -124.27 13.87 8.95 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.865 -1.147 . . . . 2.35 112.28 -179.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.426 HD22 ' HA ' ' A' ' 26' ' ' LEU . 14.9 mt -101.89 166.74 10.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.823 -1.173 . . . . 2.27 110.291 179.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.443 ' HB2' ' HB3' ' A' ' 30' ' ' GLU . 3.6 mtt180 -79.56 148.77 31.62 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.372 -0.83 . . . . 3.91 110.79 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.483 ' HD3' ' HA ' ' A' ' 43' ' ' SER . 24.0 ttmt -76.59 -48.8 18.04 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.641 -0.662 . . . . 3.0 109.514 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.27 -44.78 73.7 Favored Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.569 -1.412 . . . . 0.77 109.569 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.443 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 32.1 tt0 -58.24 -46.49 85.85 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.609 -0.936 . . . . 2.16 109.937 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.649 HG22 ' HA ' ' A' ' 20' ' ' VAL . 3.8 mt -63.91 -37.39 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.465 -0.772 . . . . 1.61 109.491 178.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.28 -58.94 6.42 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.486 -0.759 . . . . 1.25 110.51 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.12 -15.54 63.45 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.258 -0.902 . . . . 3.91 110.991 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 31.4 ttt85 -60.73 -37.78 82.89 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.175 -0.953 . . . . 3.46 110.042 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.498 ' HE1' HG13 ' A' ' 16' ' ' ILE . 0.6 OUTLIER -136.65 17.1 3.1 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.437 -0.79 . . . . 0.71 111.441 179.78 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -163.17 -100.13 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.804 -1.185 . . . . 0.94 111.772 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.527 HG21 ' HA ' ' A' ' 4' ' ' LYS . 19.6 pt -138.82 178.47 1.64 Allowed Pre-proline 0 N--CA 1.503 2.21 0 O-C-N 120.864 -1.148 . . . . 1.55 111.115 -178.334 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.524 ' HD2' ' HB ' ' A' ' 37' ' ' ILE . 24.6 Cg_exo -59.67 174.18 1.3 Allowed 'Trans proline' 0 N--CA 1.495 1.612 0 O-C-N 123.778 1.41 . . . . 1.56 111.372 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -76.82 50.42 3.05 Favored 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 123.888 1.467 . . . . 3.65 111.469 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.0 m -100.52 -60.51 1.51 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.227 -0.921 . . . . 2.82 108.801 178.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.483 ' HB ' HD13 ' A' ' 37' ' ' ILE . 1.2 m -89.97 -29.36 18.52 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.701 -0.625 . . . . 1.49 109.441 178.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.522 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 3.1 mp -71.34 -22.99 61.84 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.585 -0.697 . . . . 1.34 110.906 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.483 ' HA ' ' HD3' ' A' ' 28' ' ' LYS . 43.7 t -74.23 -42.69 59.31 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.3 -0.875 . . . . 1.75 110.036 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 m -70.31 -41.2 73.62 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.635 -0.666 . . . . 1.62 110.475 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.522 ' CG1' ' HA ' ' A' ' 42' ' ' LEU . 2.1 pp -73.39 -12.58 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.529 -0.732 . . . . 1.69 111.424 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.476 HD22 ' HA ' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -78.36 -26.56 46.73 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.111 -0.993 . . . . 2.09 110.562 179.532 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.5 mttt -87.09 -46.68 9.57 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.238 -0.914 . . . . 3.36 110.351 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.456 ' OD1' ' HA ' ' A' ' 45' ' ' ILE . 9.0 p-10 -95.29 25.89 4.1 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.463 -0.773 . . . . 0.85 110.332 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.7 pttt -51.67 -39.5 58.36 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.28 -0.888 . . . . 2.41 111.218 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -72.85 -29.37 63.15 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.193 -0.942 . . . . 4.47 110.129 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.68 -32.76 71.57 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.543 -0.723 . . . . 1.22 110.274 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -78.49 -35.73 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.283 0 O-C-N 121.396 -0.815 . . . . 1.56 109.08 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.14 21.6 10.61 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.548 -0.72 . . . . 2.29 110.108 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.21 73.85 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.211 -0.93 . . . . 1.8 110.208 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.6 t -60.19 -56.76 17.66 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.671 -0.643 . . . . 3.92 110.598 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 . . . . . 0 N--CA 1.501 2.11 0 CA-C-O 117.597 -1.192 . . . . 6.42 111.406 179.558 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.026 0 CA-C-O 121.428 0.632 . . . . 5.7300000000000004 110.906 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -163.93 -77.65 0.03 OUTLIER Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.085 -1.606 . . . . 3.5 109.085 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.604 ' HB3' ' HB3' ' A' ' 8' ' ' LEU . 57.5 Cg_endo -78.64 -103.33 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.202 0 O-C-N 123.704 1.37 . . . . 4.1600000000000001 109.111 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.628 ' HA ' HG22 ' A' ' 37' ' ' ILE . 0.0 OUTLIER 46.66 36.61 3.83 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.135 -0.978 . . . . 3.5699999999999998 112.044 178.463 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.5 ttt85 -166.44 -56.85 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.887 -1.133 . . . . 4.4000000000000004 112.05 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.3 ttp180 -140.32 -52.84 0.5 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.972 -1.08 . . . . 4.9199999999999999 112.286 -178.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.24 -176.08 4.33 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.853 -1.154 . . . . 2.0299999999999998 111.894 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.841 HD11 ' HG3' ' A' ' 13' ' ' LYS . 2.4 pp -156.75 -167.04 2.26 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.756 -0.59 . . . . 1.3400000000000001 110.465 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.58 ' O ' HD12 ' A' ' 8' ' ' LEU . 69.0 p -90.39 148.25 22.94 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.948 -1.095 . . . . 1.0900000000000001 110.831 -179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.583 ' HE1' HG22 ' A' ' 52' ' ' ILE . 44.0 t80 -54.75 -35.57 63.89 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 121.524 -0.735 . . . . 1.03 111.554 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 -60.94 -56.34 22.34 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.315 -0.865 . . . . 3.6699999999999999 111.144 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.808 ' HG3' HD13 ' A' ' 8' ' ' LEU . 9.6 pt-20 -70.6 -21.37 62.67 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.204 -0.935 . . . . 1.8100000000000001 110.369 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.841 ' HG3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -64.91 -35.17 80.28 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.322 -0.861 . . . . 3.0499999999999998 109.75 178.982 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.8 t -61.18 -41.83 97.5 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.633 -0.667 . . . . 0.72999999999999998 109.564 179.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 32.3 mtp85 -61.78 -36.88 82.36 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.702 -0.624 . . . . 3.6200000000000001 109.744 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.508 HG13 ' HE1' ' A' ' 35' ' ' PHE . 1.2 mp -61.67 -44.33 98.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 N-CA-C 109.296 -0.631 . . . . 0.51000000000000001 109.296 179.116 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.52 ' HA ' HG12 ' A' ' 20' ' ' VAL . 3.7 mt -61.61 -33.82 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.722 -0.611 . . . . 0.69999999999999996 110.471 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -72.15 -36.7 69.39 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.355 -0.841 . . . . 1.4199999999999999 110.918 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -88.95 -11.7 43.69 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.288 -0.883 . . . . 1.51 111.621 -179.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.625 ' HA ' HG21 ' A' ' 31' ' ' ILE . 5.2 p -97.93 -28.08 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 120.963 -1.085 . . . . 0.40000000000000002 110.916 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -95.95 -21.51 17.99 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.168 -0.957 . . . . 2.5899999999999999 110.826 179.876 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 21' ' ' GLU . 3.4 mt-10 -62.81 -40.56 97.75 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.267 -0.895 . . . . 2.1400000000000001 110.51 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.585 ' CG ' HD12 ' A' ' 26' ' ' LEU . 70.4 m-80 -81.94 114.26 49.2 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.592 -0.692 . . . . 1.8300000000000001 110.3 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -82.54 -11.99 10.3 Favored 'Trans proline' 0 C--N 1.314 -1.282 0 O-C-N 123.924 1.486 . . . . 2.1000000000000001 112.203 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -124.27 13.87 8.95 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.865 -1.147 . . . . 2.3500000000000001 112.28 -179.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.585 HD12 ' CG ' ' A' ' 23' ' ' ASN . 14.9 mt -101.89 166.74 10.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.823 -1.173 . . . . 1.6599999999999999 110.291 179.398 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.489 ' HB2' ' HB3' ' A' ' 30' ' ' GLU . 3.6 mtt180 -79.56 148.77 31.62 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.372 -0.83 . . . . 3.23 110.79 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.796 ' HG3' HD12 ' A' ' 46' ' ' LEU . 24.0 ttmt -76.59 -48.8 18.04 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.641 -0.662 . . . . 2.4900000000000002 109.514 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.407 ' HA3' ' HG3' ' A' ' 39' ' ' PRO . . . -68.27 -44.78 73.7 Favored Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.569 -1.412 . . . . 0.68000000000000005 109.569 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.489 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 32.1 tt0 -58.24 -46.49 85.85 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.609 -0.936 . . . . 2.1600000000000001 109.937 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.625 HG21 ' HA ' ' A' ' 20' ' ' VAL . 3.8 mt -63.91 -37.39 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.465 -0.772 . . . . 1.03 109.491 178.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.695 ' CB ' HD22 ' A' ' 42' ' ' LEU . . . -59.28 -58.94 6.42 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.486 -0.759 . . . . 0.55000000000000004 110.51 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.12 -15.54 63.45 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.258 -0.902 . . . . 3.3300000000000001 110.991 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 31.4 ttt85 -60.73 -37.78 82.89 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.175 -0.953 . . . . 2.8300000000000001 110.042 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.508 ' HE1' HG13 ' A' ' 16' ' ' ILE . 0.6 OUTLIER -136.65 17.1 3.1 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.437 -0.79 . . . . 0.70999999999999996 111.441 179.78 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.566 ' OD1' HD11 ' A' ' 42' ' ' LEU . 13.5 t-20 -163.17 -100.13 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.804 -1.185 . . . . 0.81999999999999995 111.772 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.628 HG22 ' HA ' ' A' ' 4' ' ' LYS . 19.6 pt -138.82 178.47 1.64 Allowed Pre-proline 0 N--CA 1.503 2.21 0 O-C-N 120.864 -1.148 . . . . 0.92000000000000004 111.115 -178.334 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.566 ' HD2' ' HB ' ' A' ' 37' ' ' ILE . 24.6 Cg_exo -59.67 174.18 1.3 Allowed 'Trans proline' 0 N--CA 1.495 1.612 0 O-C-N 123.778 1.41 . . . . 1.3200000000000001 111.372 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.407 ' HG3' ' HA3' ' A' ' 29' ' ' GLY . 36.5 Cg_endo -76.82 50.42 3.05 Favored 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 123.888 1.467 . . . . 3.1200000000000001 111.469 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.0 m -100.52 -60.51 1.51 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.227 -0.921 . . . . 2.5499999999999998 108.801 178.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.502 ' HB ' HD11 ' A' ' 37' ' ' ILE . 1.2 m -89.97 -29.36 18.52 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.701 -0.625 . . . . 1.3200000000000001 109.441 178.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.695 HD22 ' CB ' ' A' ' 32' ' ' ALA . 3.1 mp -71.34 -22.99 61.84 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.585 -0.697 . . . . 0.69999999999999996 110.906 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.48 ' HA ' ' HD3' ' A' ' 28' ' ' LYS . 43.7 t -74.23 -42.69 59.31 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.3 -0.875 . . . . 1.6100000000000001 110.036 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 m -70.31 -41.2 73.62 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.635 -0.666 . . . . 1.1499999999999999 110.475 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.662 HG21 ' HD3' ' A' ' 13' ' ' LYS . 2.1 pp -73.39 -12.58 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.529 -0.732 . . . . 0.95999999999999996 111.424 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.796 HD12 ' HG3' ' A' ' 28' ' ' LYS . 0.1 OUTLIER -78.36 -26.56 46.73 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.111 -0.993 . . . . 1.52 110.562 179.532 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.5 mttt -87.09 -46.68 9.57 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.238 -0.914 . . . . 2.7999999999999998 110.351 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.489 ' OD1' ' HA ' ' A' ' 45' ' ' ILE . 9.0 p-10 -95.29 25.89 4.1 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.463 -0.773 . . . . 0.79000000000000004 110.332 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.7 pttt -51.67 -39.5 58.36 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.28 -0.888 . . . . 1.96 111.218 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -72.85 -29.37 63.15 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.193 -0.942 . . . . 3.8399999999999999 110.129 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.68 -32.76 71.57 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.543 -0.723 . . . . 0.73999999999999999 110.274 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.583 HG22 ' HE1' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -78.49 -35.73 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.283 0 O-C-N 121.396 -0.815 . . . . 0.98999999999999999 109.08 179.16 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.14 21.6 10.61 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.548 -0.72 . . . . 1.7 110.108 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.21 73.85 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.211 -0.93 . . . . 1.6299999999999999 110.208 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.6 t -60.19 -56.76 17.66 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.671 -0.643 . . . . 3.4399999999999999 110.598 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 . . . . . 0 N--CA 1.501 2.11 0 CA-C-O 117.597 -1.192 . . . . 6.4199999999999999 111.406 179.558 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.026 0 CA-C-O 121.428 0.632 . . . . 5.7300000000000004 110.906 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -163.93 -77.65 0.03 OUTLIER Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.085 -1.606 . . . . 3.5 109.085 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.604 ' HB3' ' HB3' ' A' ' 8' ' ' LEU . 57.5 Cg_endo -78.64 -103.33 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.202 0 O-C-N 123.704 1.37 . . . . 4.1600000000000001 109.111 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.628 ' HA ' HG22 ' A' ' 37' ' ' ILE . 0.0 OUTLIER 46.66 36.61 3.83 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.135 -0.978 . . . . 3.5699999999999998 112.044 178.463 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.5 ttt85 -166.44 -56.85 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.887 -1.133 . . . . 4.4000000000000004 112.05 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.3 ttp180 -140.32 -52.84 0.5 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.972 -1.08 . . . . 4.9199999999999999 112.286 -178.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.24 -176.08 4.33 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.853 -1.154 . . . . 2.0299999999999998 111.894 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.841 HD11 ' HG3' ' A' ' 13' ' ' LYS . 2.4 pp -156.75 -167.04 2.26 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.756 -0.59 . . . . 1.3400000000000001 110.465 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.58 ' O ' HD12 ' A' ' 8' ' ' LEU . 69.0 p -90.39 148.25 22.94 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.948 -1.095 . . . . 1.0900000000000001 110.831 -179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.583 ' HE1' HG22 ' A' ' 52' ' ' ILE . 44.0 t80 -54.75 -35.57 63.89 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 121.524 -0.735 . . . . 1.03 111.554 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 -60.94 -56.34 22.34 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.315 -0.865 . . . . 3.6699999999999999 111.144 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.808 ' HG3' HD13 ' A' ' 8' ' ' LEU . 9.6 pt-20 -70.6 -21.37 62.67 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.204 -0.935 . . . . 1.8100000000000001 110.369 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.841 ' HG3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -64.91 -35.17 80.28 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.322 -0.861 . . . . 3.0499999999999998 109.75 178.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.8 t -61.18 -41.83 97.5 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.633 -0.667 . . . . 0.72999999999999998 109.564 179.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 32.3 mtp85 -61.78 -36.88 82.36 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.702 -0.624 . . . . 3.6200000000000001 109.744 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.508 HG13 ' HE1' ' A' ' 35' ' ' PHE . 1.2 mp -61.67 -44.33 98.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 N-CA-C 109.296 -0.631 . . . . 0.51000000000000001 109.296 179.116 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.52 ' HA ' HG12 ' A' ' 20' ' ' VAL . 3.7 mt -61.61 -33.82 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.722 -0.611 . . . . 0.69999999999999996 110.471 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -72.15 -36.7 69.39 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.355 -0.841 . . . . 1.4199999999999999 110.918 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -88.95 -11.7 43.69 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.288 -0.883 . . . . 1.51 111.621 -179.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.625 ' HA ' HG21 ' A' ' 31' ' ' ILE . 5.2 p -97.93 -28.08 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.975 0 O-C-N 120.963 -1.085 . . . . 0.40000000000000002 110.916 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -95.95 -21.51 17.99 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.168 -0.957 . . . . 2.5899999999999999 110.826 179.876 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 21' ' ' GLU . 3.4 mt-10 -62.81 -40.56 97.75 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.267 -0.895 . . . . 2.1400000000000001 110.51 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.585 ' CG ' HD12 ' A' ' 26' ' ' LEU . 70.4 m-80 -81.94 114.26 49.2 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.592 -0.692 . . . . 1.8300000000000001 110.3 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -82.54 -11.99 10.3 Favored 'Trans proline' 0 C--N 1.314 -1.282 0 O-C-N 123.924 1.486 . . . . 2.1000000000000001 112.203 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -124.27 13.87 8.95 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.865 -1.147 . . . . 2.3500000000000001 112.28 -179.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.585 HD12 ' CG ' ' A' ' 23' ' ' ASN . 14.9 mt -101.89 166.74 10.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.823 -1.173 . . . . 1.6599999999999999 110.291 179.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.489 ' HB2' ' HB3' ' A' ' 30' ' ' GLU . 3.6 mtt180 -79.56 148.77 31.62 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.372 -0.83 . . . . 3.23 110.79 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.796 ' HG3' HD12 ' A' ' 46' ' ' LEU . 24.0 ttmt -76.59 -48.8 18.04 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.641 -0.662 . . . . 2.4900000000000002 109.514 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.407 ' HA3' ' HG3' ' A' ' 39' ' ' PRO . . . -68.27 -44.78 73.7 Favored Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.569 -1.412 . . . . 0.68000000000000005 109.569 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.489 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 32.1 tt0 -58.24 -46.49 85.85 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.609 -0.936 . . . . 2.1600000000000001 109.937 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.625 HG21 ' HA ' ' A' ' 20' ' ' VAL . 3.8 mt -63.91 -37.39 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.465 -0.772 . . . . 1.03 109.491 178.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.695 ' CB ' HD22 ' A' ' 42' ' ' LEU . . . -59.28 -58.94 6.42 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.486 -0.759 . . . . 0.55000000000000004 110.51 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.12 -15.54 63.45 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.258 -0.902 . . . . 3.3300000000000001 110.991 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 31.4 ttt85 -60.73 -37.78 82.89 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.175 -0.953 . . . . 2.8300000000000001 110.042 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.508 ' HE1' HG13 ' A' ' 16' ' ' ILE . 0.6 OUTLIER -136.65 17.1 3.1 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.437 -0.79 . . . . 0.70999999999999996 111.441 179.78 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.566 ' OD1' HD11 ' A' ' 42' ' ' LEU . 13.5 t-20 -163.17 -100.13 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.804 -1.185 . . . . 0.81999999999999995 111.772 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.628 HG22 ' HA ' ' A' ' 4' ' ' LYS . 19.6 pt -138.82 178.47 1.64 Allowed Pre-proline 0 N--CA 1.503 2.21 0 O-C-N 120.864 -1.148 . . . . 0.92000000000000004 111.115 -178.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.566 ' HD2' ' HB ' ' A' ' 37' ' ' ILE . 24.6 Cg_exo -59.67 174.18 1.3 Allowed 'Trans proline' 0 N--CA 1.495 1.612 0 O-C-N 123.778 1.41 . . . . 1.3200000000000001 111.372 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.407 ' HG3' ' HA3' ' A' ' 29' ' ' GLY . 36.5 Cg_endo -76.82 50.42 3.05 Favored 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 123.888 1.467 . . . . 3.1200000000000001 111.469 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 3.0 m -100.52 -60.51 1.51 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.227 -0.921 . . . . 2.5499999999999998 108.801 178.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.502 ' HB ' HD11 ' A' ' 37' ' ' ILE . 1.2 m -89.97 -29.36 18.52 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.701 -0.625 . . . . 1.3200000000000001 109.441 178.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.695 HD22 ' CB ' ' A' ' 32' ' ' ALA . 3.1 mp -71.34 -22.99 61.84 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.585 -0.697 . . . . 0.69999999999999996 110.906 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.48 ' HA ' ' HD3' ' A' ' 28' ' ' LYS . 43.7 t -74.23 -42.69 59.31 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.3 -0.875 . . . . 1.6100000000000001 110.036 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 m -70.31 -41.2 73.62 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.635 -0.666 . . . . 1.1499999999999999 110.475 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.662 HG21 ' HD3' ' A' ' 13' ' ' LYS . 2.1 pp -73.39 -12.58 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.529 -0.732 . . . . 0.95999999999999996 111.424 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.796 HD12 ' HG3' ' A' ' 28' ' ' LYS . 0.1 OUTLIER -78.36 -26.56 46.73 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.111 -0.993 . . . . 1.52 110.562 179.532 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.5 mttt -87.09 -46.68 9.57 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.238 -0.914 . . . . 2.7999999999999998 110.351 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.489 ' OD1' ' HA ' ' A' ' 45' ' ' ILE . 9.0 p-10 -95.29 25.89 4.1 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.463 -0.773 . . . . 0.79000000000000004 110.332 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.7 pttt -51.67 -39.5 58.36 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.28 -0.888 . . . . 1.96 111.218 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -72.85 -29.37 63.15 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.193 -0.942 . . . . 3.8399999999999999 110.129 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.68 -32.76 71.57 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.543 -0.723 . . . . 0.73999999999999999 110.274 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.583 HG22 ' HE1' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -78.49 -35.73 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.283 0 O-C-N 121.396 -0.815 . . . . 0.98999999999999999 109.08 179.16 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.14 21.6 10.61 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.548 -0.72 . . . . 1.7 110.108 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.21 73.85 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.211 -0.93 . . . . 1.6299999999999999 110.208 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.6 t -60.19 -56.76 17.66 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.671 -0.643 . . . . 3.4399999999999999 110.598 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 . . . . . 0 N--CA 1.501 2.11 0 CA-C-O 117.597 -1.192 . . . . 6.4199999999999999 111.406 179.558 . . . . . . . . 0 0 . 1 stop_ save_