data_1wo9_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 1wo9 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.412 0 CA-C-O 120.666 0.269 . . . . 1.0 111.479 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.56 -179.43 16.58 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.555 -0.831 . . . . 1.0 112.499 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.15 -43.35 92.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.548 0.213 . . . . 1.0 110.969 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 16.6 p -137.45 173.79 11.29 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 121.354 0.597 . . . . 1.0 112.084 -179.731 72.748 89.171 79.248 102.799 2.027 105.869 84.73 156.315 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.432 ' C ' ' SG ' ' A' ' 19' ' ' CYS . 50.6 m -116.15 130.53 24.37 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 115.139 -0.937 . . . . 1.0 109.579 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.582 ' HG3' ' HB3' ' A' ' 21' ' ' PRO . 39.3 Cg_endo -66.48 71.87 0.43 Allowed 'Trans proline' 0 CA--C 1.502 -1.119 0 C-N-CA 122.106 1.871 . . . . 1.0 112.508 -178.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 5' ' ' THR . . . -171.9 2.44 0.03 OUTLIER Glycine 0 N--CA 1.438 -1.167 0 CA-C-N 113.466 -1.697 . . . . 1.0 112.892 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.538 ' O ' ' CZ2' ' A' ' 25' ' ' TRP . 6.0 mt-30 -113.68 126.84 55.7 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 118.244 1.022 . . . . 1.0 111.635 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.415 ' HA ' ' HA ' ' A' ' 18' ' ' THR . 17.6 p -104.44 142.31 34.82 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.787 -0.642 . . . . 1.0 109.399 179.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.478 ' HG2' ' HB2' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -122.78 148.32 45.5 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.125 -0.23 . . . . 1.0 110.713 -179.774 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.13 104.68 15.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.053 0.454 . . . . 1.0 110.89 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.456 ' O ' ' HB3' ' A' ' 13' ' ' ASP . 0.6 OUTLIER -110.55 113.85 26.8 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.688 -0.687 . . . . 1.0 109.203 179.469 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.456 ' HB3' ' O ' ' A' ' 12' ' ' GLN . 33.6 t70 71.44 -106.18 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.143 -0.688 . . . . 1.0 109.143 -178.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.7 t -120.42 -23.7 6.07 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.995 0.426 . . . . 1.0 110.358 178.779 -148.951 -164.582 48.314 102.643 2.025 103.157 151.727 -177.126 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.554 ' N ' ' OD1' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -80.55 174.96 11.09 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-O 121.673 0.749 . . . . 1.0 111.728 -179.565 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.7 t -118.97 149.73 41.13 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.331 -1.304 . . . . 1.0 110.22 178.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.643 ' HB3' ' O ' ' A' ' 26' ' ' GLY . 0.0 OUTLIER -132.33 155.47 48.33 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.245 -0.889 . . . . 1.0 109.191 -179.773 -11.991 -91.244 -53.944 103.377 2.026 103.36 94.105 -151.157 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.616 ' C ' ' CZ3' ' A' ' 25' ' ' TRP . 0.2 OUTLIER -128.04 151.38 49.23 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 118.421 -1.312 . . . . 1.0 110.638 178.186 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.432 ' SG ' ' C ' ' A' ' 5' ' ' THR . 0.7 OUTLIER -72.55 146.33 46.81 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.439 -1.319 . . . . 1.0 107.439 175.713 156.315 84.73 79.248 105.869 2.027 102.799 89.171 72.748 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.417 ' OG1' ' CD1' ' A' ' 24' ' ' ILE . 44.7 p -98.12 153.01 38.29 Favored Pre-proline 0 N--CA 1.451 -0.424 0 C-N-CA 119.364 -0.935 . . . . 1.0 109.361 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.582 ' HB3' ' HG3' ' A' ' 6' ' ' PRO . 1.6 Cg_endo -75.23 47.67 1.86 Allowed 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 121.914 1.743 . . . . 1.0 111.039 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 55.3 m -146.83 -16.34 0.42 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.716 -0.674 . . . . 1.0 111.324 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.94 6.06 32.65 Favored Glycine 0 N--CA 1.432 -1.581 0 C-N-CA 120.621 -0.799 . . . . 1.0 113.247 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.563 ' O ' HG12 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -111.99 119.74 60.74 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-O 122.432 1.11 . . . . 1.0 110.912 178.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.616 ' CZ3' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -87.44 113.85 23.52 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-N 113.606 -1.634 . . . . 1.0 107.553 -177.558 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.643 ' O ' ' HB3' ' A' ' 17' ' ' CYS . . . -124.28 161.64 18.64 Favored Glycine 0 N--CA 1.47 0.952 0 N-CA-C 115.395 0.918 . . . . 1.0 115.395 -177.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.539 ' HA ' ' HB3' ' A' ' 17' ' ' CYS . 2.0 t -142.58 175.59 9.68 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.094 0.558 . . . . 1.0 112.369 -179.331 -151.157 94.105 -53.944 103.36 2.026 103.377 -91.244 -11.991 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 t -111.39 -178.9 3.57 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 115.947 -0.57 . . . . 1.0 109.79 178.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.408 ' C ' HD22 ' A' ' 15' ' ' ASN . 0.0 OUTLIER -124.7 -53.84 1.66 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 114.486 1.291 . . . . 1.0 114.486 -178.439 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.778 ' O ' ' HB1' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -73.43 152.23 40.86 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-N 115.32 -0.855 . . . . 1.0 112.667 -178.072 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.778 ' HB1' ' O ' ' A' ' 30' ' ' LYS . . . 128.85 -161.57 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.99 1.316 . . . . 1.0 110.993 179.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.419 ' O ' ' C ' ' A' ' 33' ' ' ARG . 46.1 t 38.79 -106.01 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.87 1.063 . . . . 1.0 113.87 179.425 -177.126 151.727 48.314 103.157 2.025 102.643 -164.582 -148.951 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.581 ' O ' ' N ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -28.15 140.11 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.217 0.821 . . . . 1.0 113.217 -177.774 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.605 HG22 ' H ' ' A' ' 35' ' ' THR . 3.4 t 49.93 -67.55 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 114.689 -1.142 . . . . 1.0 113.136 179.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.605 ' H ' HG22 ' A' ' 34' ' ' THR . 9.0 t . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.106 -0.95 . . . . 1.0 110.679 -179.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.412 0 CA-C-O 120.666 0.269 . . . . 1.0 111.479 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.56 -179.43 16.58 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.555 -0.831 . . . . 1.0 112.499 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.15 -43.35 92.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.548 0.213 . . . . 1.0 110.969 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 16.6 p -137.45 173.79 11.29 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 121.354 0.597 . . . . 1.0 112.084 -179.731 72.748 89.171 79.248 102.799 2.027 105.869 84.73 156.315 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.432 ' C ' ' SG ' ' A' ' 19' ' ' CYS . 50.6 m -116.15 130.53 24.37 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 115.139 -0.937 . . . . 1.0 109.579 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.574 ' HG3' ' HB3' ' A' ' 21' ' ' PRO . 39.3 Cg_endo -66.48 71.87 0.43 Allowed 'Trans proline' 0 CA--C 1.502 -1.119 0 C-N-CA 122.106 1.871 . . . . 1.0 112.508 -178.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 5' ' ' THR . . . -171.9 2.44 0.03 OUTLIER Glycine 0 N--CA 1.438 -1.167 0 CA-C-N 113.466 -1.697 . . . . 1.0 112.892 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.538 ' O ' ' CZ2' ' A' ' 25' ' ' TRP . 6.0 mt-30 -113.68 126.84 55.7 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 118.244 1.022 . . . . 1.0 111.635 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . 1.076 HG22 HG23 ' A' ' 18' ' ' THR . 17.6 p -104.44 142.31 34.82 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.787 -0.642 . . . . 1.0 109.399 179.1 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.481 ' HG2' ' HB2' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -122.78 148.32 45.5 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.125 -0.23 . . . . 1.0 110.713 -179.774 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.13 104.68 15.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.053 0.454 . . . . 1.0 110.89 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.468 ' O ' ' HB3' ' A' ' 13' ' ' ASP . 0.6 OUTLIER -110.55 113.85 26.8 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.688 -0.687 . . . . 1.0 109.203 179.469 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.468 ' HB3' ' O ' ' A' ' 12' ' ' GLN . 33.6 t70 71.44 -106.18 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.143 -0.688 . . . . 1.0 109.143 -178.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.7 t -120.42 -23.7 6.07 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.995 0.426 . . . . 1.0 110.358 178.779 -148.951 -164.582 48.314 102.643 2.025 103.157 151.727 -177.126 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.554 ' OD1' ' N ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -80.55 174.96 11.09 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-O 121.673 0.749 . . . . 1.0 111.728 -179.565 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.7 t -118.97 149.73 41.13 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.331 -1.304 . . . . 1.0 110.22 178.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.67 ' HB3' ' O ' ' A' ' 26' ' ' GLY . 0.0 OUTLIER -132.33 155.47 48.33 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.245 -0.889 . . . . 1.0 109.191 -179.773 -11.991 -91.244 -53.944 103.377 2.026 103.36 94.105 -151.157 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . 1.076 HG23 HG22 ' A' ' 9' ' ' THR . 0.2 OUTLIER -128.04 151.38 49.23 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 118.421 -1.312 . . . . 1.0 110.638 178.186 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.432 ' SG ' ' C ' ' A' ' 5' ' ' THR . 0.7 OUTLIER -72.55 146.33 46.81 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.439 -1.319 . . . . 1.0 107.439 175.713 156.315 84.73 79.248 105.869 2.027 102.799 89.171 72.748 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.417 ' OG1' ' CD1' ' A' ' 24' ' ' ILE . 44.7 p -98.12 153.01 38.29 Favored Pre-proline 0 N--CA 1.451 -0.424 0 C-N-CA 119.364 -0.935 . . . . 1.0 109.361 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.574 ' HB3' ' HG3' ' A' ' 6' ' ' PRO . 1.6 Cg_endo -75.23 47.67 1.86 Allowed 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 121.914 1.743 . . . . 1.0 111.039 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.507 ' HB ' HD13 ' A' ' 24' ' ' ILE . 55.3 m -146.83 -16.34 0.42 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.716 -0.674 . . . . 1.0 111.324 -179.212 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.94 6.06 32.65 Favored Glycine 0 N--CA 1.432 -1.581 0 C-N-CA 120.621 -0.799 . . . . 1.0 113.247 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.577 ' O ' HG12 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -111.99 119.74 60.74 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-O 122.432 1.11 . . . . 1.0 110.912 178.943 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.616 ' CZ3' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -87.44 113.85 23.52 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-N 113.606 -1.634 . . . . 1.0 107.553 -177.558 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.67 ' O ' ' HB3' ' A' ' 17' ' ' CYS . . . -124.28 161.64 18.64 Favored Glycine 0 N--CA 1.47 0.952 0 N-CA-C 115.395 0.918 . . . . 1.0 115.395 -177.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.518 ' HA ' ' HB3' ' A' ' 17' ' ' CYS . 2.0 t -142.58 175.59 9.68 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.094 0.558 . . . . 1.0 112.369 -179.331 -151.157 94.105 -53.944 103.36 2.026 103.377 -91.244 -11.991 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 t -111.39 -178.9 3.57 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 115.947 -0.57 . . . . 1.0 109.79 178.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.465 ' C ' HD21 ' A' ' 15' ' ' ASN . 0.0 OUTLIER -124.7 -53.84 1.66 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 114.486 1.291 . . . . 1.0 114.486 -178.439 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.54 ' O ' ' CB ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -73.43 152.23 40.86 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-N 115.32 -0.855 . . . . 1.0 112.667 -178.072 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.54 ' CB ' ' O ' ' A' ' 30' ' ' LYS . . . 128.85 -161.57 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.99 1.316 . . . . 1.0 110.993 179.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.419 ' O ' ' C ' ' A' ' 33' ' ' ARG . 46.1 t 38.79 -106.01 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.87 1.063 . . . . 1.0 113.87 179.425 -177.126 151.727 48.314 103.157 2.025 102.643 -164.582 -148.951 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.581 ' O ' ' N ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -28.15 140.11 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.217 0.821 . . . . 1.0 113.217 -177.774 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.608 HG23 ' H ' ' A' ' 35' ' ' THR . 3.4 t 49.93 -67.55 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 114.689 -1.142 . . . . 1.0 113.136 179.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.608 ' H ' HG23 ' A' ' 34' ' ' THR . 9.0 t . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.106 -0.95 . . . . 1.0 110.679 -179.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.412 0 CA-C-O 120.666 0.269 . . . . 1.0 111.479 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.56 -179.43 16.58 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.555 -0.831 . . . . 1.0 112.499 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.15 -43.35 92.08 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.548 0.213 . . . . 1.0 110.969 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 16.6 p -137.45 173.79 11.29 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 121.354 0.597 . . . . 1.0 112.084 -179.731 72.748 89.171 79.248 102.799 2.027 105.869 84.73 156.315 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.432 ' C ' ' SG ' ' A' ' 19' ' ' CYS . 50.6 m -116.15 130.53 24.37 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 115.139 -0.937 . . . . 1.0 109.579 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.574 ' HG3' ' HB3' ' A' ' 21' ' ' PRO . 39.3 Cg_endo -66.48 71.87 0.43 Allowed 'Trans proline' 0 CA--C 1.502 -1.119 0 C-N-CA 122.106 1.871 . . . . 1.0 112.508 -178.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 5' ' ' THR . . . -171.9 2.44 0.03 OUTLIER Glycine 0 N--CA 1.438 -1.167 0 CA-C-N 113.466 -1.697 . . . . 1.0 112.892 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.538 ' O ' ' CZ2' ' A' ' 25' ' ' TRP . 6.0 mt-30 -113.68 126.84 55.7 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 118.244 1.022 . . . . 1.0 111.635 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 1.076 HG22 HG23 ' A' ' 18' ' ' THR . 17.6 p -104.44 142.31 34.82 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.787 -0.642 . . . . 1.0 109.399 179.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.481 ' HG2' ' HB2' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -122.78 148.32 45.5 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 121.125 -0.23 . . . . 1.0 110.713 -179.774 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.13 104.68 15.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.053 0.454 . . . . 1.0 110.89 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.468 ' O ' ' HB3' ' A' ' 13' ' ' ASP . 0.6 OUTLIER -110.55 113.85 26.8 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.688 -0.687 . . . . 1.0 109.203 179.469 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.468 ' HB3' ' O ' ' A' ' 12' ' ' GLN . 33.6 t70 71.44 -106.18 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.143 -0.688 . . . . 1.0 109.143 -178.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.7 t -120.42 -23.7 6.07 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.995 0.426 . . . . 1.0 110.358 178.779 -148.951 -164.582 48.314 102.643 2.025 103.157 151.727 -177.126 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.554 ' N ' ' OD1' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -80.55 174.96 11.09 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-O 121.673 0.749 . . . . 1.0 111.728 -179.565 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.7 t -118.97 149.73 41.13 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.331 -1.304 . . . . 1.0 110.22 178.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.67 ' HB3' ' O ' ' A' ' 26' ' ' GLY . 0.0 OUTLIER -132.33 155.47 48.33 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.245 -0.889 . . . . 1.0 109.191 -179.773 -11.991 -91.244 -53.944 103.377 2.026 103.36 94.105 -151.157 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 1.076 HG23 HG22 ' A' ' 9' ' ' THR . 0.2 OUTLIER -128.04 151.38 49.23 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 118.421 -1.312 . . . . 1.0 110.638 178.186 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.432 ' SG ' ' C ' ' A' ' 5' ' ' THR . 0.7 OUTLIER -72.55 146.33 46.81 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.439 -1.319 . . . . 1.0 107.439 175.713 156.315 84.73 79.248 105.869 2.027 102.799 89.171 72.748 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.417 ' OG1' ' CD1' ' A' ' 24' ' ' ILE . 44.7 p -98.12 153.01 38.29 Favored Pre-proline 0 N--CA 1.451 -0.424 0 C-N-CA 119.364 -0.935 . . . . 1.0 109.361 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.574 ' HB3' ' HG3' ' A' ' 6' ' ' PRO . 1.6 Cg_endo -75.23 47.67 1.86 Allowed 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 121.914 1.743 . . . . 1.0 111.039 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.507 ' HB ' HD13 ' A' ' 24' ' ' ILE . 55.3 m -146.83 -16.34 0.42 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.716 -0.674 . . . . 1.0 111.324 -179.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.94 6.06 32.65 Favored Glycine 0 N--CA 1.432 -1.581 0 C-N-CA 120.621 -0.799 . . . . 1.0 113.247 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.577 ' O ' HG12 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -111.99 119.74 60.74 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-O 122.432 1.11 . . . . 1.0 110.912 178.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.616 ' CZ3' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -87.44 113.85 23.52 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-N 113.606 -1.634 . . . . 1.0 107.553 -177.558 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.67 ' O ' ' HB3' ' A' ' 17' ' ' CYS . . . -124.28 161.64 18.64 Favored Glycine 0 N--CA 1.47 0.952 0 N-CA-C 115.395 0.918 . . . . 1.0 115.395 -177.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.518 ' HA ' ' HB3' ' A' ' 17' ' ' CYS . 2.0 t -142.58 175.59 9.68 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.094 0.558 . . . . 1.0 112.369 -179.331 -151.157 94.105 -53.944 103.36 2.026 103.377 -91.244 -11.991 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 t -111.39 -178.9 3.57 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 115.947 -0.57 . . . . 1.0 109.79 178.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.465 ' C ' HD21 ' A' ' 15' ' ' ASN . 0.0 OUTLIER -124.7 -53.84 1.66 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 114.486 1.291 . . . . 1.0 114.486 -178.439 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.54 ' O ' ' CB ' ' A' ' 31' ' ' ALA . 0.0 OUTLIER -73.43 152.23 40.86 Favored 'General case' 0 C--N 1.293 -1.85 0 CA-C-N 115.32 -0.855 . . . . 1.0 112.667 -178.072 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.54 ' CB ' ' O ' ' A' ' 30' ' ' LYS . . . 128.85 -161.57 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.99 1.316 . . . . 1.0 110.993 179.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.419 ' O ' ' C ' ' A' ' 33' ' ' ARG . 46.1 t 38.79 -106.01 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.87 1.063 . . . . 1.0 113.87 179.425 -177.126 151.727 48.314 103.157 2.025 102.643 -164.582 -148.951 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.581 ' O ' ' N ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -28.15 140.11 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.217 0.821 . . . . 1.0 113.217 -177.774 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.608 HG23 ' H ' ' A' ' 35' ' ' THR . 3.4 t 49.93 -67.55 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 114.689 -1.142 . . . . 1.0 113.136 179.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.608 ' H ' HG23 ' A' ' 34' ' ' THR . 9.0 t . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.106 -0.95 . . . . 1.0 110.679 -179.016 . . . . . . . . 1 1 . 1 stop_ save_