data_1b9p_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 1b9p _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' ' ' CYS . . . . . . . . . . . . . 2.3 m . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 120.895 0.378 . . . . 6.2800000000000002 110.487 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.54 148.41 48.23 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.963 -0.46 . . . . 3.7599999999999998 110.556 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.1 m -115.02 67.2 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 122.032 0.92 . . . . 3.7599999999999998 109.493 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 61.34 11.98 3.99 Favored 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 113.426 0.898 . . . . 6.7199999999999998 113.426 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 56.48 24.03 8.14 Favored 'General case' 0 N--CA 1.502 2.171 0 CA-C-N 119.553 1.069 . . . . 2.6699999999999999 112.172 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.04 -69.58 0.15 Allowed 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.808 -1.182 . . . . 5.9900000000000002 107.808 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 31.75 87.84 0.1 Allowed Pre-proline 0 N--CA 1.504 2.235 0 N-CA-C 114.931 1.456 . . . . 4.4100000000000001 114.931 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -76.41 60.12 6.34 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 121.16 1.24 . . . . 3.2000000000000002 111.38 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -102.05 -82.29 1.64 Allowed Glycine 0 N--CA 1.493 2.467 0 N-CA-C 106.317 -2.713 . . . . 1.8899999999999999 106.317 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.4 mt -73.84 -34.83 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 N-CA-C 108.353 -0.98 . . . . 3.2799999999999998 108.353 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.428 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 4.3 m -59.93 -52.96 63.16 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 118.881 0.764 . . . . 1.3799999999999999 109.043 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -11.81 58.18 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.66 -0.65 . . . . 4.4900000000000002 111.765 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -95.88 -47.16 6.25 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 108.805 -0.813 . . . . 3.1000000000000001 108.805 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.52 -32.15 65.89 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 118.729 -0.653 . . . . 3.3700000000000001 112.481 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 11' ' ' SER . 10.8 mtp180 -58.26 -40.76 82.65 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 119.784 1.175 . . . . 5.1500000000000004 110.643 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -40.94 77.61 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 109.236 -0.653 . . . . 3.3799999999999999 109.236 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 74.2 mt -58.75 -44.35 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 N-CA-C 108.655 -0.869 . . . . 2.1200000000000001 108.655 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.11 99.26 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 110.079 -0.341 . . . . 1.97 110.079 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.5 tttm -52.7 -46.59 67.38 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 122.462 0.305 . . . . 5.1399999999999997 110.193 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -63.23 -42.13 99.19 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 122.47 -0.144 . . . . 3.5 110.997 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -68.51 -36.23 78.59 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.908 -0.495 . . . . 1.8600000000000001 111.79 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.7 mt -67.8 -50.91 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 CA-C-N 118.707 0.685 . . . . 2.9199999999999999 110.62 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.69 -44.59 66.37 Favored 'General case' 0 N--CA 1.503 2.209 0 CA-C-N 118.418 0.554 . . . . 4.3399999999999999 111.549 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 92.8 m -65.94 -34.69 78.69 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.992 -0.443 . . . . 2.5299999999999998 110.146 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.62 -44.93 76.83 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.919 -0.488 . . . . 3.0899999999999999 110.011 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -65.43 -42.74 92.11 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 122.006 -0.434 . . . . 3.5800000000000001 110.031 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 -60.45 -21.64 62.55 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 122.033 -0.417 . . . . 5.1100000000000003 111.407 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.57 -26.54 13.8 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.356 -0.84 . . . . 2.7000000000000002 110.409 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -84.72 -61.56 1.76 Allowed 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 119.067 0.849 . . . . 4.2300000000000004 110.916 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -43.46 98.83 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.786 -0.571 . . . . 4.4000000000000004 111.423 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -67.52 -14.94 63.37 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 112.693 0.627 . . . . 4.9500000000000002 112.693 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.5 161.91 25.74 Favored 'General case' 0 N--CA 1.5 2.038 0 CA-C-N 119.869 1.213 . . . . 2.4900000000000002 110.862 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.92 -50.2 71.79 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.99 -0.444 . . . . 4.9100000000000001 110.6 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 mp0 . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 119.028 -0.51 . . . . 7.1299999999999999 109.76 -179.851 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 2.3 m . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 120.895 0.378 . . . . 5.7800000000000002 110.487 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.54 148.41 48.23 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.963 -0.46 . . . . 3.3599999999999999 110.556 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.1 m -115.02 67.2 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 122.032 0.92 . . . . 3.1400000000000001 109.493 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 61.34 11.98 3.99 Favored 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 113.426 0.898 . . . . 6.7199999999999998 113.426 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 56.48 24.03 8.14 Favored 'General case' 0 N--CA 1.502 2.171 0 CA-C-N 119.553 1.069 . . . . 2.6699999999999999 112.172 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.04 -69.58 0.15 Allowed 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.808 -1.182 . . . . 5.4800000000000004 107.808 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 31.75 87.84 0.1 Allowed Pre-proline 0 N--CA 1.504 2.235 0 N-CA-C 114.931 1.456 . . . . 3.96 114.931 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -76.41 60.12 6.34 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 121.16 1.24 . . . . 2.7200000000000002 111.38 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -102.05 -82.29 1.64 Allowed Glycine 0 N--CA 1.493 2.467 0 N-CA-C 106.317 -2.713 . . . . 1.8899999999999999 106.317 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.4 mt -73.84 -34.83 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 N-CA-C 108.353 -0.98 . . . . 2.5800000000000001 108.353 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.436 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 4.3 m -59.93 -52.96 63.16 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 118.881 0.764 . . . . 1.3799999999999999 109.043 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -11.81 58.18 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.66 -0.65 . . . . 3.8599999999999999 111.765 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -95.88 -47.16 6.25 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 108.805 -0.813 . . . . 2.25 108.805 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.462 ' HA ' HD12 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -72.52 -32.15 65.89 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 118.729 -0.653 . . . . 2.8500000000000001 112.481 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 11' ' ' SER . 10.8 mtp180 -58.26 -40.76 82.65 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 119.784 1.175 . . . . 4.5499999999999998 110.643 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -40.94 77.61 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 109.236 -0.653 . . . . 2.5600000000000001 109.236 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.462 HD12 ' HA ' ' A' ' 14' ' ' ARG . 74.2 mt -58.75 -44.35 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 N-CA-C 108.655 -0.869 . . . . 1.3700000000000001 108.655 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.11 99.26 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 110.079 -0.341 . . . . 1.3799999999999999 110.079 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.5 tttm -52.7 -46.59 67.38 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 122.462 0.305 . . . . 4.71 110.193 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -63.23 -42.13 99.19 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 122.47 -0.144 . . . . 3.1000000000000001 110.997 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -68.51 -36.23 78.59 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.908 -0.495 . . . . 1.71 111.79 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.7 mt -67.8 -50.91 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 CA-C-N 118.707 0.685 . . . . 2.5499999999999998 110.62 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.69 -44.59 66.37 Favored 'General case' 0 N--CA 1.503 2.209 0 CA-C-N 118.418 0.554 . . . . 3.79 111.549 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 92.8 m -65.94 -34.69 78.69 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.992 -0.443 . . . . 1.8100000000000001 110.146 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.62 -44.93 76.83 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.919 -0.488 . . . . 2.6699999999999999 110.011 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -65.43 -42.74 92.11 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 122.006 -0.434 . . . . 3.5800000000000001 110.031 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 -60.45 -21.64 62.55 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 122.033 -0.417 . . . . 4.4100000000000001 111.407 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.57 -26.54 13.8 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.356 -0.84 . . . . 2.3599999999999999 110.409 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -84.72 -61.56 1.76 Allowed 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 119.067 0.849 . . . . 3.75 110.916 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -43.46 98.83 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.786 -0.571 . . . . 4.4000000000000004 111.423 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -67.52 -14.94 63.37 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 112.693 0.627 . . . . 4.4000000000000004 112.693 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.5 161.91 25.74 Favored 'General case' 0 N--CA 1.5 2.038 0 CA-C-N 119.869 1.213 . . . . 1.8899999999999999 110.862 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.92 -50.2 71.79 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.99 -0.444 . . . . 4.1500000000000004 110.6 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 mp0 . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 119.028 -0.51 . . . . 6.6600000000000001 109.76 -179.851 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 2.3 m . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 120.895 0.378 . . . . 5.78 110.487 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.54 148.41 48.23 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.963 -0.46 . . . . 3.36 110.556 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.1 m -115.02 67.2 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 122.032 0.92 . . . . 3.14 109.493 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 61.34 11.98 3.99 Favored 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 113.426 0.898 . . . . 6.72 113.426 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 56.48 24.03 8.14 Favored 'General case' 0 N--CA 1.502 2.171 0 CA-C-N 119.553 1.069 . . . . 2.67 112.172 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.04 -69.58 0.15 Allowed 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.808 -1.182 . . . . 5.48 107.808 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 31.75 87.84 0.1 Allowed Pre-proline 0 N--CA 1.504 2.235 0 N-CA-C 114.931 1.456 . . . . 3.96 114.931 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -76.41 60.12 6.34 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 121.16 1.24 . . . . 2.72 111.38 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -102.05 -82.29 1.64 Allowed Glycine 0 N--CA 1.493 2.467 0 N-CA-C 106.317 -2.713 . . . . 1.89 106.317 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.4 mt -73.84 -34.83 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 N-CA-C 108.353 -0.98 . . . . 2.58 108.353 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.436 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 4.3 m -59.93 -52.96 63.16 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 118.881 0.764 . . . . 1.38 109.043 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -11.81 58.18 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.66 -0.65 . . . . 3.86 111.765 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -95.88 -47.16 6.25 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 108.805 -0.813 . . . . 2.25 108.805 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.462 ' HA ' HD12 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -72.52 -32.15 65.89 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-O 118.729 -0.653 . . . . 2.85 112.481 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 11' ' ' SER . 10.8 mtp180 -58.26 -40.76 82.65 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 119.784 1.175 . . . . 4.55 110.643 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -40.94 77.61 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 109.236 -0.653 . . . . 2.56 109.236 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.462 HD12 ' HA ' ' A' ' 14' ' ' ARG . 74.2 mt -58.75 -44.35 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 N-CA-C 108.655 -0.869 . . . . 1.37 108.655 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.11 99.26 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 110.079 -0.341 . . . . 1.38 110.079 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.5 tttm -52.7 -46.59 67.38 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 122.462 0.305 . . . . 4.71 110.193 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -63.23 -42.13 99.19 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 122.47 -0.144 . . . . 3.1 110.997 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -68.51 -36.23 78.59 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.908 -0.495 . . . . 1.71 111.79 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.7 mt -67.8 -50.91 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 CA-C-N 118.707 0.685 . . . . 2.55 110.62 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.69 -44.59 66.37 Favored 'General case' 0 N--CA 1.503 2.209 0 CA-C-N 118.418 0.554 . . . . 3.79 111.549 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 92.8 m -65.94 -34.69 78.69 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.992 -0.443 . . . . 1.81 110.146 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.62 -44.93 76.83 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.919 -0.488 . . . . 2.67 110.011 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -65.43 -42.74 92.11 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 122.006 -0.434 . . . . 3.58 110.031 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 -60.45 -21.64 62.55 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 122.033 -0.417 . . . . 4.41 111.407 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.57 -26.54 13.8 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.356 -0.84 . . . . 2.36 110.409 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -84.72 -61.56 1.76 Allowed 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 119.067 0.849 . . . . 3.75 110.916 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.25 -43.46 98.83 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.786 -0.571 . . . . 4.4 111.423 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -67.52 -14.94 63.37 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 112.693 0.627 . . . . 4.4 112.693 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.5 161.91 25.74 Favored 'General case' 0 N--CA 1.5 2.038 0 CA-C-N 119.869 1.213 . . . . 1.89 110.862 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.92 -50.2 71.79 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.99 -0.444 . . . . 4.15 110.6 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.1 mp0 . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 119.028 -0.51 . . . . 6.66 109.76 -179.851 . . . . . . . . 0 0 . 1 stop_ save_