data_1ata_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 1ata _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' ' ' GLU . . . . . 0.534 ' CD ' ' H3 ' ' A' ' 1' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.001 -0.74 . . . . 6.8899999999999997 109.001 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.65 89.6 5.02 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 119.422 -0.911 . . . . 3.2400000000000002 109.426 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -43.86 100.33 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.599 -0.841 . . . . 4.8399999999999999 110.958 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.4 169.05 0.67 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.47 -0.786 . . . . 4.1699999999999999 109.866 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 5.7 m -97.78 -166.37 1.37 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 119.336 -0.946 . . . . 0.91000000000000003 110.317 179.901 -42.517 -83.986 -119.894 104.39 2.018 103.744 -82.11 -90.517 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.5 p -90.39 -64.76 1.09 Allowed 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.528 -0.869 . . . . 1.8300000000000001 110.602 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -72.14 150.51 92.29 Favored Pre-proline 0 N--CA 1.493 1.722 0 C-N-CA 119.509 -0.877 . . . . 3.1099999999999999 110.224 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.539 ' O ' ' N ' ' A' ' 10' ' ' GLU . 1.3 Cg_endo -60.38 -175.18 0.11 Allowed 'Trans proline' 0 C--O 1.213 -0.774 0 C-N-CA 120.92 1.08 . . . . 1.05 109.662 178.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.438 ' O ' ' N ' ' A' ' 11' ' ' GLN . 7.6 m-80 57.08 -80.1 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 119.381 -0.928 . . . . 0.70999999999999996 110.024 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.539 ' N ' ' O ' ' A' ' 8' ' ' PRO . 16.8 mt-10 -47.78 99.78 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 118.889 -1.125 . . . . 1.8 109.084 179.334 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 9' ' ' ASN . 2.2 tt0 -125.07 166.73 15.86 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 119.923 -0.711 . . . . 1.8100000000000001 109.735 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.402 ' HE1' ' HG3' ' A' ' 14' ' ' LYS . 58.0 t-105 -61.77 136.03 57.83 Favored 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 119.051 -1.06 . . . . 0.55000000000000004 111.044 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.69 132.6 29.31 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 119.429 -0.909 . . . . 1.1000000000000001 109.098 177.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.402 ' HG3' ' HE1' ' A' ' 12' ' ' TRP . 18.3 mttt -81.7 -7.43 59.59 Favored 'General case' 0 C--N 1.297 -1.678 0 C-N-CA 118.504 -1.278 . . . . 2.8700000000000001 109.947 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.477 ' SG ' ' O ' ' A' ' 15' ' ' CYS . 0.0 OUTLIER -145.23 89.93 1.99 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.587 -0.845 . . . . 0.59999999999999998 110.134 179.381 148.4 109.992 -61.015 104.499 2.021 104.295 -88.017 -80.79 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -78.49 -144.97 2.66 Favored Glycine 0 N--CA 1.491 2.325 0 C-N-CA 119.35 -1.405 . . . . 0.51000000000000001 110.344 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 109.1 -129.94 9.76 Favored Glycine 0 N--CA 1.495 2.623 0 C-N-CA 119.836 -1.173 . . . . 0.66000000000000003 110.343 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 3.6 m -84.78 -177.34 6.56 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.361 -0.936 . . . . 0.81999999999999995 109.872 179.85 -38.445 -177.198 -113.488 104.114 2.018 104.273 -162.834 -84.469 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -154.09 -155.51 0.59 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 118.96 -1.096 . . . . 2.4100000000000001 110.743 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -104.22 177.75 24.19 Favored Glycine 0 N--CA 1.489 2.198 0 C-N-CA 119.817 -1.182 . . . . 0.73999999999999999 110.636 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.526 ' C ' ' H ' ' A' ' 23' ' ' ALA . 35.3 p -140.67 175.59 9.48 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.603 -0.839 . . . . 1.29 109.37 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.1 t -71.68 7.75 1.38 Allowed 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 118.823 -1.151 . . . . 0.58999999999999997 109.383 -179.932 -157.952 90.221 147.222 103.333 2.015 103.649 -130.756 -96.472 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.526 ' H ' ' C ' ' A' ' 21' ' ' THR . . . -138.11 -10.2 1.51 Allowed 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 115.516 -0.765 . . . . 1.28 110.733 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -148.91 89.2 1.65 Allowed 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.279 -0.968 . . . . 1.6799999999999999 110.047 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -42.55 -32.03 0.51 Allowed 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 119.9 -0.72 . . . . 2.4700000000000002 110.398 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.3 mt -136.37 115.58 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 119.387 -0.925 . . . . 1.6299999999999999 110.084 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -90.06 133.39 33.71 Favored Pre-proline 0 C--N 1.303 -1.434 0 C-N-CA 119.672 -0.811 . . . . 1.21 109.838 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -59.69 143.89 99.55 Favored 'Trans proline' 0 C--O 1.215 -0.636 0 C-N-CA 120.798 0.999 . . . . 0.79000000000000004 110.909 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 7.8 m -161.43 116.74 2.07 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 119.529 -0.868 . . . . 0.76000000000000001 109.988 179.724 -84.469 -162.834 -113.488 104.273 2.018 104.114 -177.198 -38.445 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 28.4 p -65.96 -9.87 33.99 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.626 -0.83 . . . . 1.76 110.806 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.3 mtt180 -64.87 -168.5 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 119.106 -1.038 . . . . 3.5099999999999998 110.154 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.491 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 80.1 mt-10 -122.22 -77.04 0.59 Allowed 'General case' 0 N--CA 1.498 1.969 0 C-N-CA 119.797 -0.761 . . . . 2.2799999999999998 110.393 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.491 ' SG ' ' O ' ' A' ' 32' ' ' GLU . 19.5 m -168.18 119.04 0.8 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.275 -0.97 . . . . 0.63 110.349 -179.581 -80.79 -88.017 -61.015 104.295 2.021 104.499 109.992 148.4 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -61.23 158.03 39.57 Favored Pre-proline 0 N--CA 1.493 1.694 0 C-N-CA 119.097 -1.041 . . . . 2.6000000000000001 108.948 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -54.71 160.98 6.56 Favored 'Trans proline' 0 CA--C 1.55 1.29 0 C-N-CA 120.941 1.094 . . . . 0.62 110.878 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -57.71 125.83 19.91 Favored 'Trans proline' 0 C--O 1.215 -0.658 0 C-N-CA 121.674 1.583 . . . . 0.60999999999999999 110.777 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.2 ttt85 -172.98 160.75 4.3 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.103 -1.039 . . . . 3.5099999999999998 110.497 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.46 132.69 54.68 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 119.551 -0.86 . . . . 0.40999999999999998 109.802 178.441 -90.517 -82.11 -119.894 103.744 2.018 104.39 -83.986 -42.517 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -171.81 -172.76 1.05 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 118.595 -1.242 . . . . 1.3 111.018 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.0 t -74.23 164.05 27.08 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 115.348 -0.842 . . . . 0.40000000000000002 110.59 -179.635 -151.035 58.014 82.963 103.791 2.018 104.412 94.848 173.316 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.2 mp -136.79 107.02 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 C-N-CA 119.759 -0.776 . . . . 1.05 110.272 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.466 ' C ' ' H ' ' A' ' 44' ' ' ALA . . . -75.5 -41.28 55.71 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.43 -0.908 . . . . 1.1599999999999999 110.443 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.4 -6.32 0.43 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.566 -0.854 . . . . 1.97 110.636 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.466 ' H ' ' C ' ' A' ' 42' ' ' ALA . . . -103.64 -42.74 5.56 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 119.503 -0.879 . . . . 1.1000000000000001 110.4 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.18 22.09 0.66 Allowed Glycine 0 N--CA 1.496 2.696 0 C-N-CA 119.585 -1.293 . . . . 0.34999999999999998 110.956 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -97.25 136.55 37.59 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 119.402 -0.919 . . . . 0.40999999999999998 110.067 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 34.0 m -118.02 166.61 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 C-N-CA 119.855 -0.738 . . . . 1.1399999999999999 110.156 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -106.37 120.75 42.7 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.52 -0.872 . . . . 2.7400000000000002 110.585 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 52' ' ' GLY . 5.2 t70 -72.28 150.95 43.13 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.633 -0.827 . . . . 0.65000000000000002 109.961 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -44.69 -24.05 0.17 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.805 -0.758 . . . . 1.3100000000000001 109.943 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.485 ' O ' ' ND2' ' A' ' 53' ' ' ASN . 44.7 mt-30 -85.15 23.14 1.3 Allowed 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 119.296 -0.962 . . . . 2.46 109.888 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' A' ' 49' ' ' ASP . . . 53.9 39.19 61.77 Favored Glycine 0 N--CA 1.487 2.057 0 C-N-CA 119.473 -1.346 . . . . 0.78000000000000003 109.975 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.485 ' ND2' ' O ' ' A' ' 51' ' ' GLN . 23.7 m-80 -116.07 120.29 38.6 Favored 'General case' 0 N--CA 1.503 2.181 0 C-N-CA 119.653 -0.819 . . . . 0.83999999999999997 110.509 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 33.4 t -74.84 114.98 13.92 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 119.283 -0.967 . . . . 0.47999999999999998 110.567 -179.758 173.316 94.848 82.963 104.412 2.018 103.791 58.014 -151.035 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 25.3 pt -140.01 154.2 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 119.64 -0.824 . . . . 1.1200000000000001 110.222 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -48.03 162.61 0.08 Allowed 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 119.592 -0.843 . . . . 2.5800000000000001 110.756 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -33.86 74.47 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.518 -0.873 . . . . 0.56999999999999995 109.369 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.454 ' C ' ' H ' ' A' ' 60' ' ' CYS . 26.7 mt-10 -69.91 -27.22 64.6 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.353 -0.939 . . . . 2.27 110.294 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -76.74 12.14 1.43 Allowed 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.236 -0.986 . . . . 1.25 109.886 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.454 ' H ' ' C ' ' A' ' 58' ' ' GLU . 1.2 m -67.25 159.7 75.67 Favored Pre-proline 0 N--CA 1.493 1.714 0 C-N-CA 119.675 -0.81 . . . . 0.77000000000000002 110.12 -179.926 -96.472 -130.756 147.222 103.649 2.015 103.333 90.221 -157.952 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . 0.43 ' O ' ' O ' ' A' ' 60' ' ' CYS . 6.1 Cg_exo -55.64 -162.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.326 -0.636 0 C-N-CA 120.893 1.062 . . . . 1.5 109.74 178.028 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.981 0 CA-C-O 116.364 -1.779 . . . . 4.6900000000000004 110.176 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.001 -0.74 . . . . 6.8899999999999997 109.001 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.65 89.6 5.02 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 119.422 -0.911 . . . . 3.0099999999999998 109.426 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -43.86 100.33 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.599 -0.841 . . . . 4.8399999999999999 110.958 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.4 169.05 0.67 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.47 -0.786 . . . . 3.8100000000000001 109.866 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 5.7 m -97.78 -166.37 1.37 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 119.336 -0.946 . . . . 0.91000000000000003 110.317 179.901 -42.517 -83.986 -119.894 104.39 2.018 103.744 -82.11 -90.517 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.5 p -90.39 -64.76 1.09 Allowed 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.528 -0.869 . . . . 1.3200000000000001 110.602 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -72.14 150.51 92.29 Favored Pre-proline 0 N--CA 1.493 1.722 0 C-N-CA 119.509 -0.877 . . . . 2.7200000000000002 110.224 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.539 ' O ' ' N ' ' A' ' 10' ' ' GLU . 1.3 Cg_endo -60.38 -175.18 0.11 Allowed 'Trans proline' 0 C--O 1.213 -0.774 0 C-N-CA 120.92 1.08 . . . . 0.92000000000000004 109.662 178.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.438 ' O ' ' N ' ' A' ' 11' ' ' GLN . 7.6 m-80 57.08 -80.1 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 119.381 -0.928 . . . . 0.54000000000000004 110.024 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.539 ' N ' ' O ' ' A' ' 8' ' ' PRO . 16.8 mt-10 -47.78 99.78 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 118.889 -1.125 . . . . 1.8 109.084 179.334 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.442 ' CB ' HD11 ' A' ' 41' ' ' ILE . 2.2 tt0 -125.07 166.73 15.86 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 119.923 -0.711 . . . . 1.1799999999999999 109.735 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.449 ' HE1' ' HG3' ' A' ' 14' ' ' LYS . 58.0 t-105 -61.77 136.03 57.83 Favored 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 119.051 -1.06 . . . . 0.5 111.044 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.451 HG22 ' O ' ' A' ' 37' ' ' ARG . 0.6 OUTLIER -139.69 132.6 29.31 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 119.429 -0.909 . . . . 0.54000000000000004 109.098 177.974 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.449 ' HG3' ' HE1' ' A' ' 12' ' ' TRP . 18.3 mttt -81.7 -7.43 59.59 Favored 'General case' 0 C--N 1.297 -1.678 0 C-N-CA 118.504 -1.278 . . . . 2.4199999999999999 109.947 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.477 ' SG ' ' O ' ' A' ' 15' ' ' CYS . 0.0 OUTLIER -145.23 89.93 1.99 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.587 -0.845 . . . . 0.59999999999999998 110.134 179.381 148.4 109.992 -61.015 104.499 2.021 104.295 -88.017 -80.79 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -78.49 -144.97 2.66 Favored Glycine 0 N--CA 1.491 2.325 0 C-N-CA 119.35 -1.405 . . . . 0.51000000000000001 110.344 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 109.1 -129.94 9.76 Favored Glycine 0 N--CA 1.495 2.623 0 C-N-CA 119.836 -1.173 . . . . 0.62 110.343 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 3.6 m -84.78 -177.34 6.56 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.361 -0.936 . . . . 0.57999999999999996 109.872 179.85 -38.445 -177.198 -113.488 104.114 2.018 104.273 -162.834 -84.469 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.674 ' HG3' ' HB2' ' A' ' 42' ' ' ALA . 3.2 tp10 -154.09 -155.51 0.59 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 118.96 -1.096 . . . . 2.4100000000000001 110.743 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -104.22 177.75 24.19 Favored Glycine 0 N--CA 1.489 2.198 0 C-N-CA 119.817 -1.182 . . . . 0.64000000000000001 110.636 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.494 ' C ' ' H ' ' A' ' 23' ' ' ALA . 35.3 p -140.67 175.59 9.48 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.603 -0.839 . . . . 0.71999999999999997 109.37 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.1 t -71.68 7.75 1.38 Allowed 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 118.823 -1.151 . . . . 0.56000000000000005 109.383 -179.932 -157.952 90.221 147.222 103.333 2.015 103.649 -130.756 -96.472 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.494 ' H ' ' C ' ' A' ' 21' ' ' THR . . . -138.11 -10.2 1.51 Allowed 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 115.516 -0.765 . . . . 0.73999999999999999 110.733 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -148.91 89.2 1.65 Allowed 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.279 -0.968 . . . . 1.6799999999999999 110.047 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -42.55 -32.03 0.51 Allowed 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 119.9 -0.72 . . . . 1.96 110.398 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.3 mt -136.37 115.58 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 119.387 -0.925 . . . . 1.0 110.084 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.612 HG12 ' O ' ' A' ' 19' ' ' GLU . 7.7 p -90.06 133.39 33.71 Favored Pre-proline 0 C--N 1.303 -1.434 0 C-N-CA 119.672 -0.811 . . . . 0.57999999999999996 109.838 -179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -59.69 143.89 99.55 Favored 'Trans proline' 0 C--O 1.215 -0.636 0 C-N-CA 120.798 0.999 . . . . 0.69999999999999996 110.909 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 7.8 m -161.43 116.74 2.07 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 119.529 -0.868 . . . . 0.76000000000000001 109.988 179.724 -84.469 -162.834 -113.488 104.273 2.018 104.114 -177.198 -38.445 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.4 ' H ' HG23 ' A' ' 30' ' ' THR . 28.4 p -65.96 -9.87 33.99 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.626 -0.83 . . . . 1.26 110.806 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.3 mtt180 -64.87 -168.5 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 119.106 -1.038 . . . . 2.8500000000000001 110.154 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.491 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 80.1 mt-10 -122.22 -77.04 0.59 Allowed 'General case' 0 N--CA 1.498 1.969 0 C-N-CA 119.797 -0.761 . . . . 2.2799999999999998 110.393 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.491 ' SG ' ' O ' ' A' ' 32' ' ' GLU . 19.5 m -168.18 119.04 0.8 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.275 -0.97 . . . . 0.63 110.349 -179.581 -80.79 -88.017 -61.015 104.295 2.021 104.499 109.992 148.4 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -61.23 158.03 39.57 Favored Pre-proline 0 N--CA 1.493 1.694 0 C-N-CA 119.097 -1.041 . . . . 2.1299999999999999 108.948 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -54.71 160.98 6.56 Favored 'Trans proline' 0 CA--C 1.55 1.29 0 C-N-CA 120.941 1.094 . . . . 0.55000000000000004 110.878 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -57.71 125.83 19.91 Favored 'Trans proline' 0 C--O 1.215 -0.658 0 C-N-CA 121.674 1.583 . . . . 0.56000000000000005 110.777 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.451 ' O ' HG22 ' A' ' 13' ' ' THR . 6.2 ttt85 -172.98 160.75 4.3 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.103 -1.039 . . . . 2.8199999999999998 110.497 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.46 132.69 54.68 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 119.551 -0.86 . . . . 0.35999999999999999 109.802 178.441 -90.517 -82.11 -119.894 103.744 2.018 104.39 -83.986 -42.517 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -171.81 -172.76 1.05 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 118.595 -1.242 . . . . 1.3 111.018 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.0 t -74.23 164.05 27.08 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 115.348 -0.842 . . . . 0.32000000000000001 110.59 -179.635 -151.035 58.014 82.963 103.791 2.018 104.412 94.848 173.316 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.442 HD11 ' CB ' ' A' ' 11' ' ' GLN . 4.2 mp -136.79 107.02 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 C-N-CA 119.759 -0.776 . . . . 0.33000000000000002 110.272 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.674 ' HB2' ' HG3' ' A' ' 19' ' ' GLU . . . -75.5 -41.28 55.71 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.43 -0.908 . . . . 0.41999999999999998 110.443 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.4 -6.32 0.43 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.566 -0.854 . . . . 1.47 110.636 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.427 ' H ' ' C ' ' A' ' 42' ' ' ALA . . . -103.64 -42.74 5.56 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 119.503 -0.879 . . . . 0.37 110.4 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.18 22.09 0.66 Allowed Glycine 0 N--CA 1.496 2.696 0 C-N-CA 119.585 -1.293 . . . . 0.31 110.956 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -97.25 136.55 37.59 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 119.402 -0.919 . . . . 0.37 110.067 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 34.0 m -118.02 166.61 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 C-N-CA 119.855 -0.738 . . . . 0.38 110.156 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -106.37 120.75 42.7 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.52 -0.872 . . . . 2.2799999999999998 110.585 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 52' ' ' GLY . 5.2 t70 -72.28 150.95 43.13 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.633 -0.827 . . . . 0.65000000000000002 109.961 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -44.69 -24.05 0.17 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.805 -0.758 . . . . 0.79000000000000004 109.943 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.433 ' N ' ' O ' ' A' ' 49' ' ' ASP . 44.7 mt-30 -85.15 23.14 1.3 Allowed 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 119.296 -0.962 . . . . 2.23 109.888 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' A' ' 49' ' ' ASP . . . 53.9 39.19 61.77 Favored Glycine 0 N--CA 1.487 2.057 0 C-N-CA 119.473 -1.346 . . . . 0.71999999999999997 109.975 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -116.07 120.29 38.6 Favored 'General case' 0 N--CA 1.503 2.181 0 C-N-CA 119.653 -0.819 . . . . 0.82999999999999996 110.509 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 33.4 t -74.84 114.98 13.92 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 119.283 -0.967 . . . . 0.40999999999999998 110.567 -179.758 173.316 94.848 82.963 104.412 2.018 103.791 58.014 -151.035 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 55' ' ' ILE . 25.3 pt -140.01 154.2 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 119.64 -0.824 . . . . 0.44 110.222 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -48.03 162.61 0.08 Allowed 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 119.592 -0.843 . . . . 2.0 110.756 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -33.86 74.47 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.518 -0.873 . . . . 0.5 109.369 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.411 ' C ' ' H ' ' A' ' 60' ' ' CYS . 26.7 mt-10 -69.91 -27.22 64.6 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.353 -0.939 . . . . 2.27 110.294 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -76.74 12.14 1.43 Allowed 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.236 -0.986 . . . . 1.25 109.886 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.43 ' O ' ' O ' ' A' ' 61' ' ' PRO . 1.2 m -67.25 159.7 75.67 Favored Pre-proline 0 N--CA 1.493 1.714 0 C-N-CA 119.675 -0.81 . . . . 0.77000000000000002 110.12 -179.926 -96.472 -130.756 147.222 103.649 2.015 103.333 90.221 -157.952 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.43 ' O ' ' O ' ' A' ' 60' ' ' CYS . 6.1 Cg_exo -55.64 -162.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.326 -0.636 0 C-N-CA 120.893 1.062 . . . . 1.3 109.74 178.028 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.981 0 CA-C-O 116.364 -1.779 . . . . 4.3700000000000001 110.176 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.001 -0.74 . . . . 6.8899999999999997 109.001 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.65 89.6 5.02 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 119.422 -0.911 . . . . 3.0099999999999998 109.426 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -43.86 100.33 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.599 -0.841 . . . . 4.8399999999999999 110.958 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.4 169.05 0.67 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.47 -0.786 . . . . 3.8100000000000001 109.866 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 5.7 m -97.78 -166.37 1.37 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 119.336 -0.946 . . . . 0.91000000000000003 110.317 179.901 -42.517 -83.986 -119.894 104.39 2.018 103.744 -82.11 -90.517 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.5 p -90.39 -64.76 1.09 Allowed 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.528 -0.869 . . . . 1.3200000000000001 110.602 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -72.14 150.51 92.29 Favored Pre-proline 0 N--CA 1.493 1.722 0 C-N-CA 119.509 -0.877 . . . . 2.7200000000000002 110.224 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.539 ' O ' ' N ' ' A' ' 10' ' ' GLU . 1.3 Cg_endo -60.38 -175.18 0.11 Allowed 'Trans proline' 0 C--O 1.213 -0.774 0 C-N-CA 120.92 1.08 . . . . 0.92000000000000004 109.662 178.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.438 ' O ' ' N ' ' A' ' 11' ' ' GLN . 7.6 m-80 57.08 -80.1 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 119.381 -0.928 . . . . 0.54000000000000004 110.024 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.539 ' N ' ' O ' ' A' ' 8' ' ' PRO . 16.8 mt-10 -47.78 99.78 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 118.889 -1.125 . . . . 1.8 109.084 179.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.442 ' CB ' HD11 ' A' ' 41' ' ' ILE . 2.2 tt0 -125.07 166.73 15.86 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 119.923 -0.711 . . . . 1.1799999999999999 109.735 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.449 ' HE1' ' HG3' ' A' ' 14' ' ' LYS . 58.0 t-105 -61.77 136.03 57.83 Favored 'General case' 0 C--N 1.295 -1.773 0 C-N-CA 119.051 -1.06 . . . . 0.5 111.044 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.451 HG22 ' O ' ' A' ' 37' ' ' ARG . 0.6 OUTLIER -139.69 132.6 29.31 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 119.429 -0.909 . . . . 0.54000000000000004 109.098 177.974 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.449 ' HG3' ' HE1' ' A' ' 12' ' ' TRP . 18.3 mttt -81.7 -7.43 59.59 Favored 'General case' 0 C--N 1.297 -1.678 0 C-N-CA 118.504 -1.278 . . . . 2.4199999999999999 109.947 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.477 ' SG ' ' O ' ' A' ' 15' ' ' CYS . 0.0 OUTLIER -145.23 89.93 1.99 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.587 -0.845 . . . . 0.59999999999999998 110.134 179.381 148.4 109.992 -61.015 104.499 2.021 104.295 -88.017 -80.79 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -78.49 -144.97 2.66 Favored Glycine 0 N--CA 1.491 2.325 0 C-N-CA 119.35 -1.405 . . . . 0.51000000000000001 110.344 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 109.1 -129.94 9.76 Favored Glycine 0 N--CA 1.495 2.623 0 C-N-CA 119.836 -1.173 . . . . 0.62 110.343 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 3.6 m -84.78 -177.34 6.56 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.361 -0.936 . . . . 0.57999999999999996 109.872 179.85 -38.445 -177.198 -113.488 104.114 2.018 104.273 -162.834 -84.469 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.674 ' HG3' ' HB2' ' A' ' 42' ' ' ALA . 3.2 tp10 -154.09 -155.51 0.59 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 118.96 -1.096 . . . . 2.4100000000000001 110.743 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -104.22 177.75 24.19 Favored Glycine 0 N--CA 1.489 2.198 0 C-N-CA 119.817 -1.182 . . . . 0.64000000000000001 110.636 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.494 ' C ' ' H ' ' A' ' 23' ' ' ALA . 35.3 p -140.67 175.59 9.48 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.603 -0.839 . . . . 0.71999999999999997 109.37 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.1 t -71.68 7.75 1.38 Allowed 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 118.823 -1.151 . . . . 0.56000000000000005 109.383 -179.932 -157.952 90.221 147.222 103.333 2.015 103.649 -130.756 -96.472 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.494 ' H ' ' C ' ' A' ' 21' ' ' THR . . . -138.11 -10.2 1.51 Allowed 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 115.516 -0.765 . . . . 0.73999999999999999 110.733 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -148.91 89.2 1.65 Allowed 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.279 -0.968 . . . . 1.6799999999999999 110.047 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -42.55 -32.03 0.51 Allowed 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 119.9 -0.72 . . . . 1.96 110.398 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.3 mt -136.37 115.58 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 119.387 -0.925 . . . . 1.0 110.084 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.612 HG12 ' O ' ' A' ' 19' ' ' GLU . 7.7 p -90.06 133.39 33.71 Favored Pre-proline 0 C--N 1.303 -1.434 0 C-N-CA 119.672 -0.811 . . . . 0.57999999999999996 109.838 -179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -59.69 143.89 99.55 Favored 'Trans proline' 0 C--O 1.215 -0.636 0 C-N-CA 120.798 0.999 . . . . 0.69999999999999996 110.909 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 7.8 m -161.43 116.74 2.07 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 119.529 -0.868 . . . . 0.76000000000000001 109.988 179.724 -84.469 -162.834 -113.488 104.273 2.018 104.114 -177.198 -38.445 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.4 ' H ' HG23 ' A' ' 30' ' ' THR . 28.4 p -65.96 -9.87 33.99 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.626 -0.83 . . . . 1.26 110.806 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.3 mtt180 -64.87 -168.5 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 119.106 -1.038 . . . . 2.8500000000000001 110.154 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.491 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 80.1 mt-10 -122.22 -77.04 0.59 Allowed 'General case' 0 N--CA 1.498 1.969 0 C-N-CA 119.797 -0.761 . . . . 2.2799999999999998 110.393 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.491 ' SG ' ' O ' ' A' ' 32' ' ' GLU . 19.5 m -168.18 119.04 0.8 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.275 -0.97 . . . . 0.63 110.349 -179.581 -80.79 -88.017 -61.015 104.295 2.021 104.499 109.992 148.4 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -61.23 158.03 39.57 Favored Pre-proline 0 N--CA 1.493 1.694 0 C-N-CA 119.097 -1.041 . . . . 2.1299999999999999 108.948 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -54.71 160.98 6.56 Favored 'Trans proline' 0 CA--C 1.55 1.29 0 C-N-CA 120.941 1.094 . . . . 0.55000000000000004 110.878 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -57.71 125.83 19.91 Favored 'Trans proline' 0 C--O 1.215 -0.658 0 C-N-CA 121.674 1.583 . . . . 0.56000000000000005 110.777 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.451 ' O ' HG22 ' A' ' 13' ' ' THR . 6.2 ttt85 -172.98 160.75 4.3 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.103 -1.039 . . . . 2.8199999999999998 110.497 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.7 m -60.46 132.69 54.68 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 119.551 -0.86 . . . . 0.35999999999999999 109.802 178.441 -90.517 -82.11 -119.894 103.744 2.018 104.39 -83.986 -42.517 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -171.81 -172.76 1.05 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 118.595 -1.242 . . . . 1.3 111.018 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.0 t -74.23 164.05 27.08 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 115.348 -0.842 . . . . 0.32000000000000001 110.59 -179.635 -151.035 58.014 82.963 103.791 2.018 104.412 94.848 173.316 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.442 HD11 ' CB ' ' A' ' 11' ' ' GLN . 4.2 mp -136.79 107.02 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 C-N-CA 119.759 -0.776 . . . . 0.33000000000000002 110.272 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.674 ' HB2' ' HG3' ' A' ' 19' ' ' GLU . . . -75.5 -41.28 55.71 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 119.43 -0.908 . . . . 0.41999999999999998 110.443 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.4 -6.32 0.43 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.566 -0.854 . . . . 1.47 110.636 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.427 ' H ' ' C ' ' A' ' 42' ' ' ALA . . . -103.64 -42.74 5.56 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 119.503 -0.879 . . . . 0.37 110.4 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.18 22.09 0.66 Allowed Glycine 0 N--CA 1.496 2.696 0 C-N-CA 119.585 -1.293 . . . . 0.31 110.956 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -97.25 136.55 37.59 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 119.402 -0.919 . . . . 0.37 110.067 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 34.0 m -118.02 166.61 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 C-N-CA 119.855 -0.738 . . . . 0.38 110.156 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -106.37 120.75 42.7 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.52 -0.872 . . . . 2.2799999999999998 110.585 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 52' ' ' GLY . 5.2 t70 -72.28 150.95 43.13 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.633 -0.827 . . . . 0.65000000000000002 109.961 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -44.69 -24.05 0.17 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.805 -0.758 . . . . 0.79000000000000004 109.943 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.485 ' O ' ' ND2' ' A' ' 53' ' ' ASN . 44.7 mt-30 -85.15 23.14 1.3 Allowed 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 119.296 -0.962 . . . . 2.23 109.888 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' A' ' 49' ' ' ASP . . . 53.9 39.19 61.77 Favored Glycine 0 N--CA 1.487 2.057 0 C-N-CA 119.473 -1.346 . . . . 0.71999999999999997 109.975 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.485 ' ND2' ' O ' ' A' ' 51' ' ' GLN . 23.7 m-80 -116.07 120.29 38.6 Favored 'General case' 0 N--CA 1.503 2.181 0 C-N-CA 119.653 -0.819 . . . . 0.82999999999999996 110.509 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 33.4 t -74.84 114.98 13.92 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 119.283 -0.967 . . . . 0.40999999999999998 110.567 -179.758 173.316 94.848 82.963 104.412 2.018 103.791 58.014 -151.035 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 55' ' ' ILE . 25.3 pt -140.01 154.2 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 119.64 -0.824 . . . . 0.44 110.222 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -48.03 162.61 0.08 Allowed 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 119.592 -0.843 . . . . 2.0 110.756 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -33.86 74.47 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.518 -0.873 . . . . 0.5 109.369 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.411 ' C ' ' H ' ' A' ' 60' ' ' CYS . 26.7 mt-10 -69.91 -27.22 64.6 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.353 -0.939 . . . . 2.27 110.294 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -76.74 12.14 1.43 Allowed 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.236 -0.986 . . . . 1.25 109.886 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.43 ' O ' ' O ' ' A' ' 61' ' ' PRO . 1.2 m -67.25 159.7 75.67 Favored Pre-proline 0 N--CA 1.493 1.714 0 C-N-CA 119.675 -0.81 . . . . 0.77000000000000002 110.12 -179.926 -96.472 -130.756 147.222 103.649 2.015 103.333 90.221 -157.952 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.43 ' O ' ' O ' ' A' ' 60' ' ' CYS . 6.1 Cg_exo -55.64 -162.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.326 -0.636 0 C-N-CA 120.893 1.062 . . . . 1.3 109.74 178.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.981 0 CA-C-O 116.364 -1.779 . . . . 4.3700000000000001 110.176 179.899 . . . . . . . . 1 1 . 1 stop_ save_